----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 21:38:49]------------------------- 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 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pnma (62) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.676940250000000 0.000000000000000 0.000000000000000 b 0.000000000000000 5.625053430000000 0.000000000000000 c 0.000000000000000 0.000000000000000 8.013880850000001 Atomic positions (fractional): *1 Al 0.99312051291081 0.75000000000000 0.61759763374992 26.982 2 Al 0.50687948708919 0.25000000000000 0.11759763374992 26.982 *3 Al 0.24997132706656 0.75000000000000 0.24317933756681 26.982 4 Al 0.00687948708919 0.25000000000000 0.38240236625008 26.982 *5 Al 0.00000000000000 0.50000000000000 0.00000000000000 26.982 6 Al 0.74997132706656 0.75000000000000 0.25682066243319 26.982 7 Al 0.75002867293344 0.25000000000000 0.75682066243319 26.982 8 Al 0.50000000000000 0.50000000000000 0.50000000000000 26.982 9 Al 0.50000000000000 0.00000000000000 0.50000000000000 26.982 10 Al 0.49312051291081 0.75000000000000 0.88240236625008 26.982 11 Al 0.25002867293344 0.25000000000000 0.74317933756681 26.982 12 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 *13 N 0.22681605594256 0.75000000000000 0.00841416210383 14.007 14 N 0.72681605594256 0.75000000000000 0.49158583789617 14.007 15 N 0.27318394405744 0.25000000000000 0.50841416210383 14.007 16 N 0.77318394405744 0.25000000000000 0.99158583789617 14.007 *17 O 0.99817065913857 0.51335576951528 0.24604763392617 15.999 *18 O 0.75965384382951 0.75000000000000 0.01261193482991 15.999 19 O 0.74034615617049 0.25000000000000 0.51261193482991 15.999 20 O 0.49817065913858 0.51335576951528 0.25395236607383 15.999 21 O 0.50182934086143 0.48664423048472 0.74604763392617 15.999 22 O 0.50182934086143 0.01335576951528 0.74604763392617 15.999 23 O 0.25965384382951 0.75000000000000 0.48738806517009 15.999 24 O 0.24034615617049 0.25000000000000 0.98738806517009 15.999 25 O 0.00182934086142 0.01335576951528 0.75395236607383 15.999 26 O 0.00182934086142 0.48664423048472 0.75395236607383 15.999 27 O 0.99817065913857 0.98664423048472 0.24604763392617 15.999 28 O 0.49817065913858 0.98664423048472 0.25395236607383 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.676940250000000 0.000000000000000 0.000000000000000 b 0.000000000000000 5.625053430000000 0.000000000000000 c 0.000000000000000 0.000000000000000 8.013880850000001 Atomic positions (fractional): *1 Al 0.99312051291081 0.75000000000000 0.61759763374992 26.982 > 1 2 Al 0.50687948708919 0.25000000000000 0.11759763374992 26.982 > 2 *3 Al 0.24997132706656 0.75000000000000 0.24317933756681 26.982 > 3 4 Al 0.00687948708919 0.25000000000000 0.38240236625008 26.982 > 4 *5 Al 0.00000000000000 0.50000000000000 0.00000000000000 26.982 > 5 6 Al 0.74997132706656 0.75000000000000 0.25682066243319 26.982 > 6 7 Al 0.75002867293344 0.25000000000000 0.75682066243319 26.982 > 7 8 Al 0.50000000000000 0.50000000000000 0.50000000000000 26.982 > 8 9 Al 0.50000000000000 0.00000000000000 0.50000000000000 26.982 > 9 10 Al 0.49312051291081 0.75000000000000 0.88240236625008 26.982 > 10 11 Al 0.25002867293344 0.25000000000000 0.74317933756681 26.982 > 11 12 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 > 12 *13 N 0.22681605594256 0.75000000000000 0.00841416210383 14.007 > 13 14 N 0.72681605594256 0.75000000000000 0.49158583789617 14.007 > 14 15 N 0.27318394405744 0.25000000000000 0.50841416210383 14.007 > 15 16 N 0.77318394405744 0.25000000000000 0.99158583789617 14.007 > 16 *17 O 0.99817065913857 0.51335576951528 0.24604763392617 15.999 > 17 *18 O 0.75965384382951 0.75000000000000 0.01261193482991 15.999 > 18 19 O 0.74034615617049 0.25000000000000 0.51261193482991 15.999 > 19 20 O 0.49817065913858 0.51335576951528 0.25395236607383 15.999 > 20 21 O 0.50182934086143 0.48664423048472 0.74604763392617 15.999 > 21 22 O 0.50182934086143 0.01335576951528 0.74604763392617 15.999 > 22 23 O 0.25965384382951 0.75000000000000 0.48738806517009 15.999 > 23 24 O 0.24034615617049 0.25000000000000 0.98738806517009 15.999 > 24 25 O 0.00182934086142 0.01335576951528 0.75395236607383 15.999 > 25 26 O 0.00182934086142 0.48664423048472 0.75395236607383 15.999 > 26 27 O 0.99817065913857 0.98664423048472 0.24604763392617 15.999 > 27 28 O 0.49817065913858 0.98664423048472 0.25395236607383 15.999 > 28 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.353880500000001 0.000000000000000 0.000000000000000 b 0.000000000000000 11.250106860000001 0.000000000000000 c 0.000000000000000 0.000000000000000 8.013880850000001 Atomic positions (fractional): *1 Al 0.49656025645541 0.37500000000000 0.61759763374992 26.982 > 1 2 Al 0.99656025645541 0.37500000000000 0.61759763374992 26.982 > 1 3 Al 0.49656025645541 0.87500000000000 0.61759763374992 26.982 > 1 4 Al 0.99656025645541 0.87500000000000 0.61759763374992 26.982 > 1 5 Al 0.25343974354459 0.12500000000000 0.11759763374992 26.982 > 2 6 Al 0.75343974354459 0.12500000000000 0.11759763374992 26.982 > 2 7 Al 0.25343974354459 0.62500000000000 0.11759763374992 26.982 > 2 8 Al 0.75343974354459 0.62500000000000 0.11759763374992 26.982 > 2 *9 Al 0.12498566353328 0.37500000000000 0.24317933756681 26.982 > 3 10 Al 0.62498566353328 0.37500000000000 0.24317933756681 26.982 > 3 11 Al 0.12498566353328 0.87500000000000 0.24317933756681 26.982 > 3 12 Al 0.62498566353328 0.87500000000000 0.24317933756681 26.982 > 3 13 Al 0.00343974354460 0.12500000000000 0.38240236625008 26.982 > 4 14 Al 0.50343974354459 0.12500000000000 0.38240236625008 26.982 > 4 15 Al 0.00343974354460 0.62500000000000 0.38240236625008 26.982 > 4 16 Al 0.50343974354459 0.62500000000000 0.38240236625008 26.982 > 4 *17 Al 0.00000000000000 0.25000000000000 0.00000000000000 26.982 > 5 18 Al 0.50000000000000 0.25000000000000 0.00000000000000 26.982 > 5 19 Al 0.00000000000000 0.75000000000000 0.00000000000000 26.982 > 5 20 Al 0.50000000000000 0.75000000000000 0.00000000000000 26.982 > 5 21 Al 0.37498566353328 0.37500000000000 0.25682066243319 26.982 > 6 22 Al 0.87498566353328 0.37500000000000 0.25682066243319 26.982 > 6 23 Al 0.37498566353328 0.87500000000000 0.25682066243319 26.982 > 6 24 Al 0.87498566353328 0.87500000000000 0.25682066243319 26.982 > 6 25 Al 0.37501433646672 0.12500000000000 0.75682066243319 26.982 > 7 26 Al 0.87501433646672 0.12500000000000 0.75682066243319 26.982 > 7 27 Al 0.37501433646672 0.62500000000000 0.75682066243319 26.982 > 7 28 Al 0.87501433646672 0.62500000000000 0.75682066243319 26.982 > 7 29 Al 0.25000000000000 0.25000000000000 0.50000000000000 26.982 > 8 30 Al 0.75000000000000 0.25000000000000 0.50000000000000 26.982 > 8 31 Al 0.25000000000000 0.75000000000000 0.50000000000000 26.982 > 8 32 Al 0.75000000000000 0.75000000000000 0.50000000000000 26.982 > 8 33 Al 0.25000000000000 0.00000000000000 0.50000000000000 26.982 > 9 34 Al 0.75000000000000 0.00000000000000 0.50000000000000 26.982 > 9 35 Al 0.25000000000000 0.50000000000000 0.50000000000000 26.982 > 9 36 Al 0.75000000000000 0.50000000000000 0.50000000000000 26.982 > 9 37 Al 0.24656025645540 0.37500000000000 0.88240236625008 26.982 > 10 38 Al 0.74656025645541 0.37500000000000 0.88240236625008 26.982 > 10 39 Al 0.24656025645540 0.87500000000000 0.88240236625008 26.982 > 10 40 Al 0.74656025645541 0.87500000000000 0.88240236625008 26.982 > 10 41 Al 0.12501433646672 0.12500000000000 0.74317933756681 26.982 > 11 42 Al 0.62501433646672 0.12500000000000 0.74317933756681 26.982 > 11 43 Al 0.12501433646672 0.62500000000000 0.74317933756681 26.982 > 11 44 Al 0.62501433646672 0.62500000000000 0.74317933756681 26.982 > 11 45 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 > 12 46 Al 0.50000000000000 0.00000000000000 0.00000000000000 26.982 > 12 47 Al 0.00000000000000 0.50000000000000 0.00000000000000 26.982 > 12 48 Al 0.50000000000000 0.50000000000000 0.00000000000000 26.982 > 12 *49 N 0.11340802797128 0.37500000000000 0.00841416210383 14.007 > 13 50 N 0.61340802797128 0.37500000000000 0.00841416210383 14.007 > 13 51 N 0.11340802797128 0.87500000000000 0.00841416210383 14.007 > 13 52 N 0.61340802797128 0.87500000000000 0.00841416210383 14.007 > 13 53 N 0.36340802797128 0.37500000000000 0.49158583789617 14.007 > 14 54 N 0.86340802797128 0.37500000000000 0.49158583789617 14.007 > 14 55 N 0.36340802797128 0.87500000000000 0.49158583789617 14.007 > 14 56 N 0.86340802797128 0.87500000000000 0.49158583789617 14.007 > 14 57 N 0.13659197202872 0.12500000000000 0.50841416210383 14.007 > 15 58 N 0.63659197202872 0.12500000000000 0.50841416210383 14.007 > 15 59 N 0.13659197202872 0.62500000000000 0.50841416210383 14.007 > 15 60 N 0.63659197202872 0.62500000000000 0.50841416210383 14.007 > 15 61 N 0.38659197202872 0.12500000000000 0.99158583789617 14.007 > 16 62 N 0.88659197202872 0.12500000000000 0.99158583789617 14.007 > 16 63 N 0.38659197202872 0.62500000000000 0.99158583789617 14.007 > 16 64 N 0.88659197202872 0.62500000000000 0.99158583789617 14.007 > 16 *65 O 0.49908532956929 0.25667788475764 0.24604763392617 15.999 > 17 66 O 0.99908532956929 0.25667788475764 0.24604763392617 15.999 > 17 67 O 0.49908532956929 0.75667788475764 0.24604763392617 15.999 > 17 68 O 0.99908532956929 0.75667788475764 0.24604763392617 15.999 > 17 *69 O 0.37982692191476 0.37500000000000 0.01261193482991 15.999 > 18 70 O 0.87982692191476 0.37500000000000 0.01261193482991 15.999 > 18 71 O 0.37982692191476 0.87500000000000 0.01261193482991 15.999 > 18 72 O 0.87982692191476 0.87500000000000 0.01261193482991 15.999 > 18 73 O 0.37017307808524 0.12500000000000 0.51261193482991 15.999 > 19 74 O 0.87017307808524 0.12500000000000 0.51261193482991 15.999 > 19 75 O 0.37017307808524 0.62500000000000 0.51261193482991 15.999 > 19 76 O 0.87017307808524 0.62500000000000 0.51261193482991 15.999 > 19 77 O 0.24908532956929 0.25667788475764 0.25395236607383 15.999 > 20 78 O 0.74908532956929 0.25667788475764 0.25395236607383 15.999 > 20 79 O 0.24908532956929 0.75667788475764 0.25395236607383 15.999 > 20 80 O 0.74908532956929 0.75667788475764 0.25395236607383 15.999 > 20 81 O 0.25091467043071 0.24332211524236 0.74604763392617 15.999 > 21 82 O 0.75091467043071 0.24332211524236 0.74604763392617 15.999 > 21 83 O 0.25091467043071 0.74332211524236 0.74604763392617 15.999 > 21 84 O 0.75091467043071 0.74332211524236 0.74604763392617 15.999 > 21 85 O 0.25091467043071 0.00667788475764 0.74604763392617 15.999 > 22 86 O 0.75091467043071 0.00667788475764 0.74604763392617 15.999 > 22 87 O 0.25091467043071 0.50667788475764 0.74604763392617 15.999 > 22 88 O 0.75091467043071 0.50667788475764 0.74604763392617 15.999 > 22 89 O 0.12982692191476 0.37500000000000 0.48738806517009 15.999 > 23 90 O 0.62982692191476 0.37500000000000 0.48738806517009 15.999 > 23 91 O 0.12982692191476 0.87500000000000 0.48738806517009 15.999 > 23 92 O 0.62982692191476 0.87500000000000 0.48738806517009 15.999 > 23 93 O 0.12017307808524 0.12500000000000 0.98738806517009 15.999 > 24 94 O 0.62017307808524 0.12500000000000 0.98738806517009 15.999 > 24 95 O 0.12017307808524 0.62500000000000 0.98738806517009 15.999 > 24 96 O 0.62017307808524 0.62500000000000 0.98738806517009 15.999 > 24 97 O 0.00091467043071 0.00667788475764 0.75395236607383 15.999 > 25 98 O 0.50091467043071 0.00667788475764 0.75395236607383 15.999 > 25 99 O 0.00091467043071 0.50667788475764 0.75395236607383 15.999 > 25 100 O 0.50091467043071 0.50667788475764 0.75395236607383 15.999 > 25 101 O 0.00091467043071 0.24332211524236 0.75395236607383 15.999 > 26 102 O 0.50091467043071 0.24332211524236 0.75395236607383 15.999 > 26 103 O 0.00091467043071 0.74332211524236 0.75395236607383 15.999 > 26 104 O 0.50091467043071 0.74332211524236 0.75395236607383 15.999 > 26 105 O 0.49908532956929 0.49332211524236 0.24604763392617 15.999 > 27 106 O 0.99908532956929 0.49332211524236 0.24604763392617 15.999 > 27 107 O 0.49908532956929 0.99332211524236 0.24604763392617 15.999 > 27 108 O 0.99908532956929 0.99332211524236 0.24604763392617 15.999 > 27 109 O 0.24908532956929 0.49332211524236 0.25395236607383 15.999 > 28 110 O 0.74908532956929 0.49332211524236 0.25395236607383 15.999 > 28 111 O 0.24908532956929 0.99332211524236 0.25395236607383 15.999 > 28 112 O 0.74908532956929 0.99332211524236 0.25395236607383 15.999 > 28 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.6621371 0.0000000 0.0000000 0.0000000 3.6213817 0.0000000 0.0000000 0.0000000 3.6505354 -------------------------- Born effective charges -------------------------- 1 Al 2.8303163 0.0000000 0.0144259 0.0000000 2.9178170 0.0000000 0.0965495 0.0000000 2.8590375 2 Al 2.8303163 0.0000000 -0.0144259 0.0000000 2.9178170 0.0000000 -0.0965495 0.0000000 2.8590375 3 Al 2.9943353 0.0000000 0.1181374 0.0000000 2.7094825 0.0000000 0.1683541 0.0000000 2.9488455 4 Al 2.8303163 0.0000000 0.0144259 0.0000000 2.9178170 0.0000000 0.0965495 0.0000000 2.8590375 5 Al 2.7790913 0.1426381 0.0007163 0.0741310 2.9643086 0.2173868 -0.0126590 0.1626013 2.7812758 6 Al 2.9943353 0.0000000 -0.1181374 0.0000000 2.7094825 0.0000000 -0.1683541 0.0000000 2.9488455 7 Al 2.9943353 0.0000000 0.1181374 0.0000000 2.7094825 0.0000000 0.1683541 0.0000000 2.9488455 8 Al 2.7790913 0.1426381 -0.0007163 0.0741310 2.9643086 -0.2173868 0.0126590 -0.1626013 2.7812758 9 Al 2.7790913 -0.1426381 -0.0007163 -0.0741310 2.9643086 0.2173868 0.0126590 0.1626013 2.7812758 10 Al 2.8303163 0.0000000 -0.0144259 0.0000000 2.9178170 0.0000000 -0.0965495 0.0000000 2.8590375 11 Al 2.9943353 0.0000000 -0.1181374 0.0000000 2.7094825 0.0000000 -0.1683541 0.0000000 2.9488455 12 Al 2.7790913 -0.1426381 0.0007163 -0.0741310 2.9643086 -0.2173868 -0.0126590 -0.1626013 2.7812758 13 N -2.3825012 0.0000000 0.1320249 0.0000000 -2.1816314 0.0000000 0.1223687 0.0000000 -2.2347566 14 N -2.3825012 0.0000000 -0.1320249 0.0000000 -2.1816314 0.0000000 -0.1223687 0.0000000 -2.2347566 15 N -2.3825012 0.0000000 -0.1320249 0.0000000 -2.1816314 0.0000000 -0.1223687 0.0000000 -2.2347566 16 N -2.3825012 0.0000000 0.1320249 0.0000000 -2.1816314 0.0000000 0.1223687 0.0000000 -2.2347566 17 O -1.9221282 -0.0085112 0.0209111 -0.0229319 -2.1774012 0.2099235 0.0271443 0.2150537 -2.1929289 18 O -2.3769853 0.0000000 -0.1864122 0.0000000 -2.0551743 0.0000000 -0.1937689 0.0000000 -1.9685444 19 O -2.3769853 0.0000000 0.1864122 0.0000000 -2.0551743 0.0000000 0.1937689 0.0000000 -1.9685444 20 O -1.9221282 -0.0085112 -0.0209111 -0.0229319 -2.1774012 -0.2099235 -0.0271443 -0.2150537 -2.1929289 21 O -1.9221282 -0.0085112 -0.0209111 -0.0229319 -2.1774012 -0.2099235 -0.0271443 -0.2150537 -2.1929289 22 O -1.9221282 0.0085112 -0.0209111 0.0229319 -2.1774012 0.2099235 -0.0271443 0.2150537 -2.1929289 23 O -2.3769853 0.0000000 0.1864122 0.0000000 -2.0551743 0.0000000 0.1937689 0.0000000 -1.9685444 24 O -2.3769853 0.0000000 -0.1864122 0.0000000 -2.0551743 0.0000000 -0.1937689 0.0000000 -1.9685444 25 O -1.9221282 0.0085112 0.0209111 0.0229319 -2.1774012 -0.2099235 0.0271443 -0.2150537 -2.1929289 26 O -1.9221282 -0.0085112 0.0209111 -0.0229319 -2.1774012 0.2099235 0.0271443 0.2150537 -2.1929289 27 O -1.9221282 0.0085112 0.0209111 0.0229319 -2.1774012 -0.2099235 0.0271443 -0.2150537 -2.1929289 28 O -1.9221282 0.0085112 -0.0209111 0.0229319 -2.1774012 0.2099235 -0.0271443 0.2150537 -2.1929289 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 336/336 Permutation basis: 14448/14448 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1889 Number of blocks in projector: 1889 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: 458 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 330 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 330 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 257 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 257 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 257 Use standard eigh solver. Tree of FC basis block matrices: - (1889, 1851), data: False |-- (257, 251), data: True |-- (257, 251), data: True |-- (257, 251), data: True |-- (330, 326), data: True |-- (330, 326), data: True |-- (458, 446), data: True ----- Solver_atoms: 1 -- 112 / 112 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 480 - Time: 3.018 Solver_block: 200 / 480 - Time: 3.049 Solver_block: 300 / 480 - Time: 3.039 Solver_block: 400 / 480 - Time: 3.042 Solver_block: 480 / 480 - Time: 2.455 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 14.653 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 336/336 Permutation basis: 14448/14448 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1889 Number of blocks in projector: 1889 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: 458 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 330 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 330 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 257 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 257 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 257 Use standard eigh solver. Tree of FC basis block matrices: - (1889, 1851), data: False |-- (257, 251), data: True |-- (257, 251), data: True |-- (257, 251), data: True |-- (330, 326), data: True |-- (330, 326), data: True |-- (458, 446), 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 21:39:23]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 21:39:24]------------------------- 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 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pnma (62) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.676940250000000 0.000000000000000 0.000000000000000 b 0.000000000000000 5.625053430000000 0.000000000000000 c 0.000000000000000 0.000000000000000 8.013880850000001 Atomic positions (fractional): 1 Al 0.99312051291081 0.75000000000000 0.61759763374992 26.982 2 Al 0.50687948708919 0.25000000000000 0.11759763374992 26.982 3 Al 0.24997132706656 0.75000000000000 0.24317933756681 26.982 4 Al 0.00687948708919 0.25000000000000 0.38240236625008 26.982 5 Al 0.00000000000000 0.50000000000000 0.00000000000000 26.982 6 Al 0.74997132706656 0.75000000000000 0.25682066243319 26.982 7 Al 0.75002867293344 0.25000000000000 0.75682066243319 26.982 8 Al 0.50000000000000 0.50000000000000 0.50000000000000 26.982 9 Al 0.50000000000000 0.00000000000000 0.50000000000000 26.982 10 Al 0.49312051291081 0.75000000000000 0.88240236625008 26.982 11 Al 0.25002867293344 0.25000000000000 0.74317933756681 26.982 12 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 13 N 0.22681605594256 0.75000000000000 0.00841416210383 14.007 14 N 0.72681605594256 0.75000000000000 0.49158583789617 14.007 15 N 0.27318394405744 0.25000000000000 0.50841416210383 14.007 16 N 0.77318394405744 0.25000000000000 0.99158583789617 14.007 17 O 0.99817065913857 0.51335576951528 0.24604763392617 15.999 18 O 0.75965384382951 0.75000000000000 0.01261193482991 15.999 19 O 0.74034615617049 0.25000000000000 0.51261193482991 15.999 20 O 0.49817065913858 0.51335576951528 0.25395236607383 15.999 21 O 0.50182934086143 0.48664423048472 0.74604763392617 15.999 22 O 0.50182934086143 0.01335576951528 0.74604763392617 15.999 23 O 0.25965384382951 0.75000000000000 0.48738806517009 15.999 24 O 0.24034615617049 0.25000000000000 0.98738806517009 15.999 25 O 0.00182934086142 0.01335576951528 0.75395236607383 15.999 26 O 0.00182934086142 0.48664423048472 0.75395236607383 15.999 27 O 0.99817065913857 0.98664423048472 0.24604763392617 15.999 28 O 0.49817065913858 0.98664423048472 0.25395236607383 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.353880500000001 0.000000000000000 0.000000000000000 b 0.000000000000000 11.250106860000001 0.000000000000000 c 0.000000000000000 0.000000000000000 8.013880850000001 Atomic positions (fractional): 1 Al 0.49656025645541 0.37500000000000 0.61759763374992 26.982 > 1 2 Al 0.99656025645541 0.37500000000000 0.61759763374992 26.982 > 1 3 Al 0.49656025645541 0.87500000000000 0.61759763374992 26.982 > 1 4 Al 0.99656025645541 0.87500000000000 0.61759763374992 26.982 > 1 5 Al 0.25343974354459 0.12500000000000 0.11759763374992 26.982 > 5 6 Al 0.75343974354459 0.12500000000000 0.11759763374992 26.982 > 5 7 Al 0.25343974354459 0.62500000000000 0.11759763374992 26.982 > 5 8 Al 0.75343974354459 0.62500000000000 0.11759763374992 26.982 > 5 9 Al 0.12498566353328 0.37500000000000 0.24317933756681 26.982 > 9 10 Al 0.62498566353328 0.37500000000000 0.24317933756681 26.982 > 9 11 Al 0.12498566353328 0.87500000000000 0.24317933756681 26.982 > 9 12 Al 0.62498566353328 0.87500000000000 0.24317933756681 26.982 > 9 13 Al 0.00343974354460 0.12500000000000 0.38240236625008 26.982 > 13 14 Al 0.50343974354459 0.12500000000000 0.38240236625008 26.982 > 13 15 Al 0.00343974354460 0.62500000000000 0.38240236625008 26.982 > 13 16 Al 0.50343974354459 0.62500000000000 0.38240236625008 26.982 > 13 17 Al 0.00000000000000 0.25000000000000 0.00000000000000 26.982 > 17 18 Al 0.50000000000000 0.25000000000000 0.00000000000000 26.982 > 17 19 Al 0.00000000000000 0.75000000000000 0.00000000000000 26.982 > 17 20 Al 0.50000000000000 0.75000000000000 0.00000000000000 26.982 > 17 21 Al 0.37498566353328 0.37500000000000 0.25682066243319 26.982 > 21 22 Al 0.87498566353328 0.37500000000000 0.25682066243319 26.982 > 21 23 Al 0.37498566353328 0.87500000000000 0.25682066243319 26.982 > 21 24 Al 0.87498566353328 0.87500000000000 0.25682066243319 26.982 > 21 25 Al 0.37501433646672 0.12500000000000 0.75682066243319 26.982 > 25 26 Al 0.87501433646672 0.12500000000000 0.75682066243319 26.982 > 25 27 Al 0.37501433646672 0.62500000000000 0.75682066243319 26.982 > 25 28 Al 0.87501433646672 0.62500000000000 0.75682066243319 26.982 > 25 29 Al 0.25000000000000 0.25000000000000 0.50000000000000 26.982 > 29 30 Al 0.75000000000000 0.25000000000000 0.50000000000000 26.982 > 29 31 Al 0.25000000000000 0.75000000000000 0.50000000000000 26.982 > 29 32 Al 0.75000000000000 0.75000000000000 0.50000000000000 26.982 > 29 33 Al 0.25000000000000 0.00000000000000 0.50000000000000 26.982 > 33 34 Al 0.75000000000000 0.00000000000000 0.50000000000000 26.982 > 33 35 Al 0.25000000000000 0.50000000000000 0.50000000000000 26.982 > 33 36 Al 0.75000000000000 0.50000000000000 0.50000000000000 26.982 > 33 37 Al 0.24656025645540 0.37500000000000 0.88240236625008 26.982 > 37 38 Al 0.74656025645541 0.37500000000000 0.88240236625008 26.982 > 37 39 Al 0.24656025645540 0.87500000000000 0.88240236625008 26.982 > 37 40 Al 0.74656025645541 0.87500000000000 0.88240236625008 26.982 > 37 41 Al 0.12501433646672 0.12500000000000 0.74317933756681 26.982 > 41 42 Al 0.62501433646672 0.12500000000000 0.74317933756681 26.982 > 41 43 Al 0.12501433646672 0.62500000000000 0.74317933756681 26.982 > 41 44 Al 0.62501433646672 0.62500000000000 0.74317933756681 26.982 > 41 45 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 > 45 46 Al 0.50000000000000 0.00000000000000 0.00000000000000 26.982 > 45 47 Al 0.00000000000000 0.50000000000000 0.00000000000000 26.982 > 45 48 Al 0.50000000000000 0.50000000000000 0.00000000000000 26.982 > 45 49 N 0.11340802797128 0.37500000000000 0.00841416210383 14.007 > 49 50 N 0.61340802797128 0.37500000000000 0.00841416210383 14.007 > 49 51 N 0.11340802797128 0.87500000000000 0.00841416210383 14.007 > 49 52 N 0.61340802797128 0.87500000000000 0.00841416210383 14.007 > 49 53 N 0.36340802797128 0.37500000000000 0.49158583789617 14.007 > 53 54 N 0.86340802797128 0.37500000000000 0.49158583789617 14.007 > 53 55 N 0.36340802797128 0.87500000000000 0.49158583789617 14.007 > 53 56 N 0.86340802797128 0.87500000000000 0.49158583789617 14.007 > 53 57 N 0.13659197202872 0.12500000000000 0.50841416210383 14.007 > 57 58 N 0.63659197202872 0.12500000000000 0.50841416210383 14.007 > 57 59 N 0.13659197202872 0.62500000000000 0.50841416210383 14.007 > 57 60 N 0.63659197202872 0.62500000000000 0.50841416210383 14.007 > 57 61 N 0.38659197202872 0.12500000000000 0.99158583789617 14.007 > 61 62 N 0.88659197202872 0.12500000000000 0.99158583789617 14.007 > 61 63 N 0.38659197202872 0.62500000000000 0.99158583789617 14.007 > 61 64 N 0.88659197202872 0.62500000000000 0.99158583789617 14.007 > 61 65 O 0.49908532956929 0.25667788475764 0.24604763392617 15.999 > 65 66 O 0.99908532956929 0.25667788475764 0.24604763392617 15.999 > 65 67 O 0.49908532956929 0.75667788475764 0.24604763392617 15.999 > 65 68 O 0.99908532956929 0.75667788475764 0.24604763392617 15.999 > 65 69 O 0.37982692191476 0.37500000000000 0.01261193482991 15.999 > 69 70 O 0.87982692191476 0.37500000000000 0.01261193482991 15.999 > 69 71 O 0.37982692191476 0.87500000000000 0.01261193482991 15.999 > 69 72 O 0.87982692191476 0.87500000000000 0.01261193482991 15.999 > 69 73 O 0.37017307808524 0.12500000000000 0.51261193482991 15.999 > 73 74 O 0.87017307808524 0.12500000000000 0.51261193482991 15.999 > 73 75 O 0.37017307808524 0.62500000000000 0.51261193482991 15.999 > 73 76 O 0.87017307808524 0.62500000000000 0.51261193482991 15.999 > 73 77 O 0.24908532956929 0.25667788475764 0.25395236607383 15.999 > 77 78 O 0.74908532956929 0.25667788475764 0.25395236607383 15.999 > 77 79 O 0.24908532956929 0.75667788475764 0.25395236607383 15.999 > 77 80 O 0.74908532956929 0.75667788475764 0.25395236607383 15.999 > 77 81 O 0.25091467043071 0.24332211524236 0.74604763392617 15.999 > 81 82 O 0.75091467043071 0.24332211524236 0.74604763392617 15.999 > 81 83 O 0.25091467043071 0.74332211524236 0.74604763392617 15.999 > 81 84 O 0.75091467043071 0.74332211524236 0.74604763392617 15.999 > 81 85 O 0.25091467043071 0.00667788475764 0.74604763392617 15.999 > 85 86 O 0.75091467043071 0.00667788475764 0.74604763392617 15.999 > 85 87 O 0.25091467043071 0.50667788475764 0.74604763392617 15.999 > 85 88 O 0.75091467043071 0.50667788475764 0.74604763392617 15.999 > 85 89 O 0.12982692191476 0.37500000000000 0.48738806517009 15.999 > 89 90 O 0.62982692191476 0.37500000000000 0.48738806517009 15.999 > 89 91 O 0.12982692191476 0.87500000000000 0.48738806517009 15.999 > 89 92 O 0.62982692191476 0.87500000000000 0.48738806517009 15.999 > 89 93 O 0.12017307808524 0.12500000000000 0.98738806517009 15.999 > 93 94 O 0.62017307808524 0.12500000000000 0.98738806517009 15.999 > 93 95 O 0.12017307808524 0.62500000000000 0.98738806517009 15.999 > 93 96 O 0.62017307808524 0.62500000000000 0.98738806517009 15.999 > 93 97 O 0.00091467043071 0.00667788475764 0.75395236607383 15.999 > 97 98 O 0.50091467043071 0.00667788475764 0.75395236607383 15.999 > 97 99 O 0.00091467043071 0.50667788475764 0.75395236607383 15.999 > 97 100 O 0.50091467043071 0.50667788475764 0.75395236607383 15.999 > 97 101 O 0.00091467043071 0.24332211524236 0.75395236607383 15.999 > 101 102 O 0.50091467043071 0.24332211524236 0.75395236607383 15.999 > 101 103 O 0.00091467043071 0.74332211524236 0.75395236607383 15.999 > 101 104 O 0.50091467043071 0.74332211524236 0.75395236607383 15.999 > 101 105 O 0.49908532956929 0.49332211524236 0.24604763392617 15.999 > 105 106 O 0.99908532956929 0.49332211524236 0.24604763392617 15.999 > 105 107 O 0.49908532956929 0.99332211524236 0.24604763392617 15.999 > 105 108 O 0.99908532956929 0.99332211524236 0.24604763392617 15.999 > 105 109 O 0.24908532956929 0.49332211524236 0.25395236607383 15.999 > 109 110 O 0.74908532956929 0.49332211524236 0.25395236607383 15.999 > 109 111 O 0.24908532956929 0.99332211524236 0.25395236607383 15.999 > 109 112 O 0.74908532956929 0.99332211524236 0.25395236607383 15.999 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.6621371 0.0000000 0.0000000 0.0000000 3.6213817 0.0000000 0.0000000 0.0000000 3.6505354 -------------------------- Born effective charges -------------------------- 1 Al 2.8303163 0.0000000 0.0144259 0.0000000 2.9178170 0.0000000 0.0965495 0.0000000 2.8590375 2 Al 2.8303163 0.0000000 -0.0144259 0.0000000 2.9178170 0.0000000 -0.0965495 0.0000000 2.8590375 3 Al 2.9943353 0.0000000 0.1181374 0.0000000 2.7094825 0.0000000 0.1683541 0.0000000 2.9488455 4 Al 2.8303163 0.0000000 0.0144259 0.0000000 2.9178170 0.0000000 0.0965495 0.0000000 2.8590375 5 Al 2.7790913 0.1426381 0.0007163 0.0741310 2.9643086 0.2173868 -0.0126590 0.1626013 2.7812758 6 Al 2.9943353 0.0000000 -0.1181374 0.0000000 2.7094825 0.0000000 -0.1683541 0.0000000 2.9488455 7 Al 2.9943353 0.0000000 0.1181374 0.0000000 2.7094825 0.0000000 0.1683541 0.0000000 2.9488455 8 Al 2.7790913 0.1426381 -0.0007163 0.0741310 2.9643086 -0.2173868 0.0126590 -0.1626013 2.7812758 9 Al 2.7790913 -0.1426381 -0.0007163 -0.0741310 2.9643086 0.2173868 0.0126590 0.1626013 2.7812758 10 Al 2.8303163 0.0000000 -0.0144259 0.0000000 2.9178170 0.0000000 -0.0965495 0.0000000 2.8590375 11 Al 2.9943353 0.0000000 -0.1181374 0.0000000 2.7094825 0.0000000 -0.1683541 0.0000000 2.9488455 12 Al 2.7790913 -0.1426381 0.0007163 -0.0741310 2.9643086 -0.2173868 -0.0126590 -0.1626013 2.7812758 13 N -2.3825012 0.0000000 0.1320249 0.0000000 -2.1816314 0.0000000 0.1223687 0.0000000 -2.2347566 14 N -2.3825012 0.0000000 -0.1320249 0.0000000 -2.1816314 0.0000000 -0.1223687 0.0000000 -2.2347566 15 N -2.3825012 0.0000000 -0.1320249 0.0000000 -2.1816314 0.0000000 -0.1223687 0.0000000 -2.2347566 16 N -2.3825012 0.0000000 0.1320249 0.0000000 -2.1816314 0.0000000 0.1223687 0.0000000 -2.2347566 17 O -1.9221282 -0.0085112 0.0209111 -0.0229319 -2.1774012 0.2099235 0.0271443 0.2150537 -2.1929289 18 O -2.3769853 0.0000000 -0.1864122 0.0000000 -2.0551743 0.0000000 -0.1937689 0.0000000 -1.9685444 19 O -2.3769853 0.0000000 0.1864122 0.0000000 -2.0551743 0.0000000 0.1937689 0.0000000 -1.9685444 20 O -1.9221282 -0.0085112 -0.0209111 -0.0229319 -2.1774012 -0.2099235 -0.0271443 -0.2150537 -2.1929289 21 O -1.9221282 -0.0085112 -0.0209111 -0.0229319 -2.1774012 -0.2099235 -0.0271443 -0.2150537 -2.1929289 22 O -1.9221282 0.0085112 -0.0209111 0.0229319 -2.1774012 0.2099235 -0.0271443 0.2150537 -2.1929289 23 O -2.3769853 0.0000000 0.1864122 0.0000000 -2.0551743 0.0000000 0.1937689 0.0000000 -1.9685444 24 O -2.3769853 0.0000000 -0.1864122 0.0000000 -2.0551743 0.0000000 -0.1937689 0.0000000 -1.9685444 25 O -1.9221282 0.0085112 0.0209111 0.0229319 -2.1774012 -0.2099235 0.0271443 -0.2150537 -2.1929289 26 O -1.9221282 -0.0085112 0.0209111 -0.0229319 -2.1774012 0.2099235 0.0271443 0.2150537 -2.1929289 27 O -1.9221282 0.0085112 0.0209111 0.0229319 -2.1774012 -0.2099235 0.0271443 -0.2150537 -2.1929289 28 O -1.9221282 0.0085112 -0.0209111 0.0229319 -2.1774012 0.2099235 -0.0271443 0.2150537 -2.1929289 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 65, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 69, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000006 (xzx) -0.00000006 (xzx) -0.00000006 (xxz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000001 (zx) 0.00000001 (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 21:39:48]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 21:39:49]------------------------- 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 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pnma (62) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.676940250000000 0.000000000000000 0.000000000000000 b 0.000000000000000 5.625053430000000 0.000000000000000 c 0.000000000000000 0.000000000000000 8.013880850000001 Atomic positions (fractional): 1 Al 0.99312051291081 0.75000000000000 0.61759763374992 26.982 2 Al 0.50687948708919 0.25000000000000 0.11759763374992 26.982 3 Al 0.24997132706656 0.75000000000000 0.24317933756681 26.982 4 Al 0.00687948708919 0.25000000000000 0.38240236625008 26.982 5 Al 0.00000000000000 0.50000000000000 0.00000000000000 26.982 6 Al 0.74997132706656 0.75000000000000 0.25682066243319 26.982 7 Al 0.75002867293344 0.25000000000000 0.75682066243319 26.982 8 Al 0.50000000000000 0.50000000000000 0.50000000000000 26.982 9 Al 0.50000000000000 0.00000000000000 0.50000000000000 26.982 10 Al 0.49312051291081 0.75000000000000 0.88240236625008 26.982 11 Al 0.25002867293344 0.25000000000000 0.74317933756681 26.982 12 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 13 N 0.22681605594256 0.75000000000000 0.00841416210383 14.007 14 N 0.72681605594256 0.75000000000000 0.49158583789617 14.007 15 N 0.27318394405744 0.25000000000000 0.50841416210383 14.007 16 N 0.77318394405744 0.25000000000000 0.99158583789617 14.007 17 O 0.99817065913857 0.51335576951528 0.24604763392617 15.999 18 O 0.75965384382951 0.75000000000000 0.01261193482991 15.999 19 O 0.74034615617049 0.25000000000000 0.51261193482991 15.999 20 O 0.49817065913858 0.51335576951528 0.25395236607383 15.999 21 O 0.50182934086143 0.48664423048472 0.74604763392617 15.999 22 O 0.50182934086143 0.01335576951528 0.74604763392617 15.999 23 O 0.25965384382951 0.75000000000000 0.48738806517009 15.999 24 O 0.24034615617049 0.25000000000000 0.98738806517009 15.999 25 O 0.00182934086142 0.01335576951528 0.75395236607383 15.999 26 O 0.00182934086142 0.48664423048472 0.75395236607383 15.999 27 O 0.99817065913857 0.98664423048472 0.24604763392617 15.999 28 O 0.49817065913858 0.98664423048472 0.25395236607383 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.353880500000001 0.000000000000000 0.000000000000000 b 0.000000000000000 11.250106860000001 0.000000000000000 c 0.000000000000000 0.000000000000000 8.013880850000001 Atomic positions (fractional): 1 Al 0.49656025645541 0.37500000000000 0.61759763374992 26.982 > 1 2 Al 0.99656025645541 0.37500000000000 0.61759763374992 26.982 > 1 3 Al 0.49656025645541 0.87500000000000 0.61759763374992 26.982 > 1 4 Al 0.99656025645541 0.87500000000000 0.61759763374992 26.982 > 1 5 Al 0.25343974354459 0.12500000000000 0.11759763374992 26.982 > 5 6 Al 0.75343974354459 0.12500000000000 0.11759763374992 26.982 > 5 7 Al 0.25343974354459 0.62500000000000 0.11759763374992 26.982 > 5 8 Al 0.75343974354459 0.62500000000000 0.11759763374992 26.982 > 5 9 Al 0.12498566353328 0.37500000000000 0.24317933756681 26.982 > 9 10 Al 0.62498566353328 0.37500000000000 0.24317933756681 26.982 > 9 11 Al 0.12498566353328 0.87500000000000 0.24317933756681 26.982 > 9 12 Al 0.62498566353328 0.87500000000000 0.24317933756681 26.982 > 9 13 Al 0.00343974354460 0.12500000000000 0.38240236625008 26.982 > 13 14 Al 0.50343974354459 0.12500000000000 0.38240236625008 26.982 > 13 15 Al 0.00343974354460 0.62500000000000 0.38240236625008 26.982 > 13 16 Al 0.50343974354459 0.62500000000000 0.38240236625008 26.982 > 13 17 Al 0.00000000000000 0.25000000000000 0.00000000000000 26.982 > 17 18 Al 0.50000000000000 0.25000000000000 0.00000000000000 26.982 > 17 19 Al 0.00000000000000 0.75000000000000 0.00000000000000 26.982 > 17 20 Al 0.50000000000000 0.75000000000000 0.00000000000000 26.982 > 17 21 Al 0.37498566353328 0.37500000000000 0.25682066243319 26.982 > 21 22 Al 0.87498566353328 0.37500000000000 0.25682066243319 26.982 > 21 23 Al 0.37498566353328 0.87500000000000 0.25682066243319 26.982 > 21 24 Al 0.87498566353328 0.87500000000000 0.25682066243319 26.982 > 21 25 Al 0.37501433646672 0.12500000000000 0.75682066243319 26.982 > 25 26 Al 0.87501433646672 0.12500000000000 0.75682066243319 26.982 > 25 27 Al 0.37501433646672 0.62500000000000 0.75682066243319 26.982 > 25 28 Al 0.87501433646672 0.62500000000000 0.75682066243319 26.982 > 25 29 Al 0.25000000000000 0.25000000000000 0.50000000000000 26.982 > 29 30 Al 0.75000000000000 0.25000000000000 0.50000000000000 26.982 > 29 31 Al 0.25000000000000 0.75000000000000 0.50000000000000 26.982 > 29 32 Al 0.75000000000000 0.75000000000000 0.50000000000000 26.982 > 29 33 Al 0.25000000000000 0.00000000000000 0.50000000000000 26.982 > 33 34 Al 0.75000000000000 0.00000000000000 0.50000000000000 26.982 > 33 35 Al 0.25000000000000 0.50000000000000 0.50000000000000 26.982 > 33 36 Al 0.75000000000000 0.50000000000000 0.50000000000000 26.982 > 33 37 Al 0.24656025645540 0.37500000000000 0.88240236625008 26.982 > 37 38 Al 0.74656025645541 0.37500000000000 0.88240236625008 26.982 > 37 39 Al 0.24656025645540 0.87500000000000 0.88240236625008 26.982 > 37 40 Al 0.74656025645541 0.87500000000000 0.88240236625008 26.982 > 37 41 Al 0.12501433646672 0.12500000000000 0.74317933756681 26.982 > 41 42 Al 0.62501433646672 0.12500000000000 0.74317933756681 26.982 > 41 43 Al 0.12501433646672 0.62500000000000 0.74317933756681 26.982 > 41 44 Al 0.62501433646672 0.62500000000000 0.74317933756681 26.982 > 41 45 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 > 45 46 Al 0.50000000000000 0.00000000000000 0.00000000000000 26.982 > 45 47 Al 0.00000000000000 0.50000000000000 0.00000000000000 26.982 > 45 48 Al 0.50000000000000 0.50000000000000 0.00000000000000 26.982 > 45 49 N 0.11340802797128 0.37500000000000 0.00841416210383 14.007 > 49 50 N 0.61340802797128 0.37500000000000 0.00841416210383 14.007 > 49 51 N 0.11340802797128 0.87500000000000 0.00841416210383 14.007 > 49 52 N 0.61340802797128 0.87500000000000 0.00841416210383 14.007 > 49 53 N 0.36340802797128 0.37500000000000 0.49158583789617 14.007 > 53 54 N 0.86340802797128 0.37500000000000 0.49158583789617 14.007 > 53 55 N 0.36340802797128 0.87500000000000 0.49158583789617 14.007 > 53 56 N 0.86340802797128 0.87500000000000 0.49158583789617 14.007 > 53 57 N 0.13659197202872 0.12500000000000 0.50841416210383 14.007 > 57 58 N 0.63659197202872 0.12500000000000 0.50841416210383 14.007 > 57 59 N 0.13659197202872 0.62500000000000 0.50841416210383 14.007 > 57 60 N 0.63659197202872 0.62500000000000 0.50841416210383 14.007 > 57 61 N 0.38659197202872 0.12500000000000 0.99158583789617 14.007 > 61 62 N 0.88659197202872 0.12500000000000 0.99158583789617 14.007 > 61 63 N 0.38659197202872 0.62500000000000 0.99158583789617 14.007 > 61 64 N 0.88659197202872 0.62500000000000 0.99158583789617 14.007 > 61 65 O 0.49908532956929 0.25667788475764 0.24604763392617 15.999 > 65 66 O 0.99908532956929 0.25667788475764 0.24604763392617 15.999 > 65 67 O 0.49908532956929 0.75667788475764 0.24604763392617 15.999 > 65 68 O 0.99908532956929 0.75667788475764 0.24604763392617 15.999 > 65 69 O 0.37982692191476 0.37500000000000 0.01261193482991 15.999 > 69 70 O 0.87982692191476 0.37500000000000 0.01261193482991 15.999 > 69 71 O 0.37982692191476 0.87500000000000 0.01261193482991 15.999 > 69 72 O 0.87982692191476 0.87500000000000 0.01261193482991 15.999 > 69 73 O 0.37017307808524 0.12500000000000 0.51261193482991 15.999 > 73 74 O 0.87017307808524 0.12500000000000 0.51261193482991 15.999 > 73 75 O 0.37017307808524 0.62500000000000 0.51261193482991 15.999 > 73 76 O 0.87017307808524 0.62500000000000 0.51261193482991 15.999 > 73 77 O 0.24908532956929 0.25667788475764 0.25395236607383 15.999 > 77 78 O 0.74908532956929 0.25667788475764 0.25395236607383 15.999 > 77 79 O 0.24908532956929 0.75667788475764 0.25395236607383 15.999 > 77 80 O 0.74908532956929 0.75667788475764 0.25395236607383 15.999 > 77 81 O 0.25091467043071 0.24332211524236 0.74604763392617 15.999 > 81 82 O 0.75091467043071 0.24332211524236 0.74604763392617 15.999 > 81 83 O 0.25091467043071 0.74332211524236 0.74604763392617 15.999 > 81 84 O 0.75091467043071 0.74332211524236 0.74604763392617 15.999 > 81 85 O 0.25091467043071 0.00667788475764 0.74604763392617 15.999 > 85 86 O 0.75091467043071 0.00667788475764 0.74604763392617 15.999 > 85 87 O 0.25091467043071 0.50667788475764 0.74604763392617 15.999 > 85 88 O 0.75091467043071 0.50667788475764 0.74604763392617 15.999 > 85 89 O 0.12982692191476 0.37500000000000 0.48738806517009 15.999 > 89 90 O 0.62982692191476 0.37500000000000 0.48738806517009 15.999 > 89 91 O 0.12982692191476 0.87500000000000 0.48738806517009 15.999 > 89 92 O 0.62982692191476 0.87500000000000 0.48738806517009 15.999 > 89 93 O 0.12017307808524 0.12500000000000 0.98738806517009 15.999 > 93 94 O 0.62017307808524 0.12500000000000 0.98738806517009 15.999 > 93 95 O 0.12017307808524 0.62500000000000 0.98738806517009 15.999 > 93 96 O 0.62017307808524 0.62500000000000 0.98738806517009 15.999 > 93 97 O 0.00091467043071 0.00667788475764 0.75395236607383 15.999 > 97 98 O 0.50091467043071 0.00667788475764 0.75395236607383 15.999 > 97 99 O 0.00091467043071 0.50667788475764 0.75395236607383 15.999 > 97 100 O 0.50091467043071 0.50667788475764 0.75395236607383 15.999 > 97 101 O 0.00091467043071 0.24332211524236 0.75395236607383 15.999 > 101 102 O 0.50091467043071 0.24332211524236 0.75395236607383 15.999 > 101 103 O 0.00091467043071 0.74332211524236 0.75395236607383 15.999 > 101 104 O 0.50091467043071 0.74332211524236 0.75395236607383 15.999 > 101 105 O 0.49908532956929 0.49332211524236 0.24604763392617 15.999 > 105 106 O 0.99908532956929 0.49332211524236 0.24604763392617 15.999 > 105 107 O 0.49908532956929 0.99332211524236 0.24604763392617 15.999 > 105 108 O 0.99908532956929 0.99332211524236 0.24604763392617 15.999 > 105 109 O 0.24908532956929 0.49332211524236 0.25395236607383 15.999 > 109 110 O 0.74908532956929 0.49332211524236 0.25395236607383 15.999 > 109 111 O 0.24908532956929 0.99332211524236 0.25395236607383 15.999 > 109 112 O 0.74908532956929 0.99332211524236 0.25395236607383 15.999 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.6621371 0.0000000 0.0000000 0.0000000 3.6213817 0.0000000 0.0000000 0.0000000 3.6505354 -------------------------- Born effective charges -------------------------- 1 Al 2.8303163 0.0000000 0.0144259 0.0000000 2.9178170 0.0000000 0.0965495 0.0000000 2.8590375 2 Al 2.8303163 0.0000000 -0.0144259 0.0000000 2.9178170 0.0000000 -0.0965495 0.0000000 2.8590375 3 Al 2.9943353 0.0000000 0.1181374 0.0000000 2.7094825 0.0000000 0.1683541 0.0000000 2.9488455 4 Al 2.8303163 0.0000000 0.0144259 0.0000000 2.9178170 0.0000000 0.0965495 0.0000000 2.8590375 5 Al 2.7790913 0.1426381 0.0007163 0.0741310 2.9643086 0.2173868 -0.0126590 0.1626013 2.7812758 6 Al 2.9943353 0.0000000 -0.1181374 0.0000000 2.7094825 0.0000000 -0.1683541 0.0000000 2.9488455 7 Al 2.9943353 0.0000000 0.1181374 0.0000000 2.7094825 0.0000000 0.1683541 0.0000000 2.9488455 8 Al 2.7790913 0.1426381 -0.0007163 0.0741310 2.9643086 -0.2173868 0.0126590 -0.1626013 2.7812758 9 Al 2.7790913 -0.1426381 -0.0007163 -0.0741310 2.9643086 0.2173868 0.0126590 0.1626013 2.7812758 10 Al 2.8303163 0.0000000 -0.0144259 0.0000000 2.9178170 0.0000000 -0.0965495 0.0000000 2.8590375 11 Al 2.9943353 0.0000000 -0.1181374 0.0000000 2.7094825 0.0000000 -0.1683541 0.0000000 2.9488455 12 Al 2.7790913 -0.1426381 0.0007163 -0.0741310 2.9643086 -0.2173868 -0.0126590 -0.1626013 2.7812758 13 N -2.3825012 0.0000000 0.1320249 0.0000000 -2.1816314 0.0000000 0.1223687 0.0000000 -2.2347566 14 N -2.3825012 0.0000000 -0.1320249 0.0000000 -2.1816314 0.0000000 -0.1223687 0.0000000 -2.2347566 15 N -2.3825012 0.0000000 -0.1320249 0.0000000 -2.1816314 0.0000000 -0.1223687 0.0000000 -2.2347566 16 N -2.3825012 0.0000000 0.1320249 0.0000000 -2.1816314 0.0000000 0.1223687 0.0000000 -2.2347566 17 O -1.9221282 -0.0085112 0.0209111 -0.0229319 -2.1774012 0.2099235 0.0271443 0.2150537 -2.1929289 18 O -2.3769853 0.0000000 -0.1864122 0.0000000 -2.0551743 0.0000000 -0.1937689 0.0000000 -1.9685444 19 O -2.3769853 0.0000000 0.1864122 0.0000000 -2.0551743 0.0000000 0.1937689 0.0000000 -1.9685444 20 O -1.9221282 -0.0085112 -0.0209111 -0.0229319 -2.1774012 -0.2099235 -0.0271443 -0.2150537 -2.1929289 21 O -1.9221282 -0.0085112 -0.0209111 -0.0229319 -2.1774012 -0.2099235 -0.0271443 -0.2150537 -2.1929289 22 O -1.9221282 0.0085112 -0.0209111 0.0229319 -2.1774012 0.2099235 -0.0271443 0.2150537 -2.1929289 23 O -2.3769853 0.0000000 0.1864122 0.0000000 -2.0551743 0.0000000 0.1937689 0.0000000 -1.9685444 24 O -2.3769853 0.0000000 -0.1864122 0.0000000 -2.0551743 0.0000000 -0.1937689 0.0000000 -1.9685444 25 O -1.9221282 0.0085112 0.0209111 0.0229319 -2.1774012 -0.2099235 0.0271443 -0.2150537 -2.1929289 26 O -1.9221282 -0.0085112 0.0209111 -0.0229319 -2.1774012 0.2099235 0.0271443 0.2150537 -2.1929289 27 O -1.9221282 0.0085112 0.0209111 0.0229319 -2.1774012 -0.2099235 0.0271443 -0.2150537 -2.1929289 28 O -1.9221282 0.0085112 -0.0209111 0.0229319 -2.1774012 0.2099235 -0.0271443 0.2150537 -2.1929289 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000006 (xzx) -0.00000006 (xzx) -0.00000006 (xxz) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 9 9 6 ] 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: 0.65, Number of G-points: 319, Lambda: 0.13 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/100) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 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 6.550 ( 0.000 0.000 0.000) 0.000 6.833 ( 0.000 0.000 0.000) 0.000 7.069 ( 0.000 0.000 0.000) 0.000 7.072 ( 0.000 0.000 0.000) 0.000 7.085 ( 0.000 0.000 0.000) 0.000 7.351 ( 0.000 0.000 0.000) 0.000 7.622 ( 0.000 0.000 0.000) 0.000 8.980 ( 0.000 0.000 0.000) 0.000 9.175 ( 0.000 0.000 0.000) 0.000 9.418 ( 0.000 0.000 0.000) 0.000 9.431 ( 0.000 0.000 0.000) 0.000 9.734 ( 0.000 0.000 0.000) 0.000 9.742 ( 0.000 0.000 0.000) 0.000 9.764 ( 0.000 0.000 0.000) 0.000 9.789 ( 0.000 0.000 0.000) 0.000 9.805 ( 0.000 0.000 0.000) 0.000 9.923 ( 0.000 0.000 0.000) 0.000 10.051 ( 0.000 0.000 0.000) 0.000 10.268 ( 0.000 0.000 0.000) 0.000 10.683 ( 0.000 0.000 0.000) 0.000 10.883 ( 0.000 0.000 0.000) 0.000 10.929 ( 0.000 0.000 0.000) 0.000 11.041 ( 0.000 0.000 0.000) 0.000 11.086 ( 0.000 0.000 0.000) 0.000 11.117 ( 0.000 0.000 0.000) 0.000 11.141 ( 0.000 0.000 0.000) 0.000 11.183 ( 0.000 0.000 0.000) 0.000 11.273 ( 0.000 0.000 0.000) 0.000 11.617 ( 0.000 0.000 0.000) 0.000 11.715 ( 0.000 0.000 0.000) 0.000 11.728 ( 0.000 0.000 0.000) 0.000 11.941 ( 0.000 0.000 0.000) 0.000 12.739 ( 0.000 0.000 0.000) 0.000 12.805 ( 0.000 0.000 0.000) 0.000 13.167 ( 0.000 0.000 0.000) 0.000 13.283 ( 0.000 0.000 0.000) 0.000 13.399 ( 0.000 0.000 0.000) 0.000 13.433 ( 0.000 0.000 0.000) 0.000 13.585 ( 0.000 0.000 0.000) 0.000 13.777 ( 0.000 0.000 0.000) 0.000 13.961 ( 0.000 0.000 0.000) 0.000 14.311 ( 0.000 0.000 0.000) 0.000 14.326 ( 0.000 0.000 0.000) 0.000 15.066 ( 0.000 0.000 0.000) 0.000 15.209 ( 0.000 0.000 0.000) 0.000 15.365 ( 0.000 0.000 0.000) 0.000 15.459 ( 0.000 0.000 0.000) 0.000 15.642 ( 0.000 0.000 0.000) 0.000 15.670 ( 0.000 0.000 0.000) 0.000 15.893 ( 0.000 0.000 0.000) 0.000 16.218 ( 0.000 0.000 0.000) 0.000 17.451 ( 0.000 0.000 0.000) 0.000 17.598 ( 0.000 0.000 0.000) 0.000 17.628 ( 0.000 0.000 0.000) 0.000 17.647 ( 0.000 0.000 0.000) 0.000 17.966 ( 0.000 0.000 0.000) 0.000 18.085 ( 0.000 0.000 0.000) 0.000 18.099 ( 0.000 0.000 0.000) 0.000 18.121 ( 0.000 0.000 0.000) 0.000 18.159 ( 0.000 0.000 0.000) 0.000 18.567 ( 0.000 0.000 0.000) 0.000 18.786 ( 0.000 0.000 0.000) 0.000 18.874 ( 0.000 0.000 0.000) 0.000 19.440 ( 0.000 0.000 0.000) 0.000 19.985 ( 0.000 0.000 0.000) 0.000 20.304 ( 0.000 0.000 0.000) 0.000 20.430 ( 0.000 0.000 0.000) 0.000 20.512 ( 0.000 0.000 0.000) 0.000 20.567 ( 0.000 0.000 0.000) 0.000 20.654 ( 0.000 0.000 0.000) 0.000 20.846 ( 0.000 0.000 0.000) 0.000 20.982 ( 0.000 0.000 0.000) 0.000 20.998 ( 0.000 0.000 0.000) 0.000 21.078 ( 0.000 0.000 0.000) 0.000 21.141 ( 0.000 0.000 0.000) 0.000 22.409 ( 0.000 0.000 0.000) 0.000 23.044 ( 0.000 0.000 0.000) 0.000 25.818 ( 0.000 0.000 0.000) 0.000 25.937 ( 0.000 0.000 0.000) 0.000 26.519 ( 0.000 0.000 0.000) 0.000 27.073 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/100) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.937 ( 48.060 0.000 0.000) 48.060 1.372 ( 69.895 0.000 0.000) 69.895 2.155 ( 108.743 0.000 0.000) 108.743 6.461 ( -9.521 0.000 0.000) 9.521 7.004 ( 16.088 0.000 0.000) 16.088 7.024 ( -1.836 0.000 0.000) 1.836 7.135 ( 3.659 0.000 0.000) 3.659 7.210 ( 11.684 0.000 0.000) 11.684 7.375 ( 2.196 0.000 0.000) 2.196 7.755 ( 9.636 0.000 0.000) 9.636 8.484 ( -31.302 0.000 0.000) 31.302 9.090 ( -26.743 0.000 0.000) 26.743 9.406 ( -1.233 0.000 0.000) 1.233 9.432 ( 7.705 0.000 0.000) 7.705 9.469 ( -16.537 0.000 0.000) 16.537 9.676 ( -18.255 0.000 0.000) 18.255 9.767 ( -3.843 0.000 0.000) 3.843 9.778 ( 2.025 0.000 0.000) 2.025 9.872 ( 5.877 0.000 0.000) 5.877 9.977 ( 7.041 0.000 0.000) 7.041 10.066 ( 2.491 0.000 0.000) 2.491 10.350 ( 2.614 0.000 0.000) 2.614 10.886 ( 21.717 0.000 0.000) 21.717 10.927 ( 7.951 0.000 0.000) 7.951 11.094 ( 13.424 0.000 0.000) 13.424 11.195 ( 5.509 0.000 0.000) 5.509 11.214 ( 12.196 0.000 0.000) 12.196 11.249 ( 5.208 0.000 0.000) 5.208 11.251 ( 12.635 0.000 0.000) 12.635 11.315 ( 23.473 0.000 0.000) 23.473 11.571 ( 27.524 0.000 0.000) 27.524 11.718 ( 3.730 0.000 0.000) 3.730 11.719 ( 9.081 0.000 0.000) 9.081 11.866 ( 11.127 0.000 0.000) 11.127 11.954 ( 1.103 0.000 0.000) 1.103 12.750 ( -6.619 0.000 0.000) 6.619 12.797 ( 5.875 0.000 0.000) 5.875 13.165 ( -1.690 0.000 0.000) 1.690 13.204 ( -7.050 0.000 0.000) 7.050 13.282 ( -8.922 0.000 0.000) 8.922 13.306 ( -25.795 0.000 0.000) 25.795 13.770 ( -0.720 0.000 0.000) 0.720 14.123 ( 14.701 0.000 0.000) 14.701 14.152 ( -8.376 0.000 0.000) 8.376 14.570 ( 15.378 0.000 0.000) 15.378 15.003 ( 11.872 0.000 0.000) 11.872 15.030 ( -5.415 0.000 0.000) 5.415 15.160 ( -4.220 0.000 0.000) 4.220 15.353 ( -14.544 0.000 0.000) 14.544 15.394 ( -6.562 0.000 0.000) 6.562 15.614 ( -2.713 0.000 0.000) 2.713 16.054 ( 12.607 0.000 0.000) 12.607 16.188 ( -5.923 0.000 0.000) 5.923 17.302 ( -19.738 0.000 0.000) 19.738 17.441 ( -1.055 0.000 0.000) 1.055 17.494 ( -8.369 0.000 0.000) 8.369 17.498 ( -13.517 0.000 0.000) 13.517 17.726 ( 5.000 0.000 0.000) 5.000 17.971 ( -4.843 0.000 0.000) 4.843 17.987 ( -6.880 0.000 0.000) 6.880 18.148 ( 2.997 0.000 0.000) 2.997 18.159 ( -0.038 0.000 0.000) 0.038 18.161 ( 1.427 0.000 0.000) 1.427 18.484 ( -7.590 0.000 0.000) 7.590 18.773 ( -7.037 0.000 0.000) 7.037 18.869 ( 4.109 0.000 0.000) 4.109 19.793 ( -16.379 0.000 0.000) 16.379 20.296 ( -0.837 0.000 0.000) 0.837 20.371 ( -5.399 0.000 0.000) 5.399 20.407 ( -6.521 0.000 0.000) 6.521 20.530 ( -6.708 0.000 0.000) 6.708 20.660 ( 5.336 0.000 0.000) 5.336 20.762 ( -1.212 0.000 0.000) 1.212 20.787 ( -6.074 0.000 0.000) 6.074 20.876 ( 2.335 0.000 0.000) 2.335 21.048 ( -2.792 0.000 0.000) 2.792 21.525 ( 31.770 0.000 0.000) 31.770 21.582 ( 8.066 0.000 0.000) 8.066 22.980 ( -5.983 0.000 0.000) 5.983 24.743 ( -7.309 0.000 0.000) 7.309 25.915 ( 9.265 0.000 0.000) 9.265 25.996 ( 5.738 0.000 0.000) 5.738 26.626 ( 10.563 0.000 0.000) 10.563 28.951 ( -5.946 0.000 0.000) 5.946 ======================= Grid point 2 (3/100) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.884 ( 48.695 0.000 0.000) 48.695 2.731 ( 68.813 0.000 0.000) 68.813 4.230 ( 102.560 0.000 0.000) 102.560 6.148 ( -23.265 0.000 0.000) 23.265 7.002 ( -0.360 0.000 0.000) 0.360 7.214 ( 4.493 0.000 0.000) 4.493 7.371 ( 18.602 0.000 0.000) 18.602 7.415 ( 0.784 0.000 0.000) 0.784 7.474 ( 13.315 0.000 0.000) 13.315 7.925 ( -23.274 0.000 0.000) 23.274 7.978 ( 9.962 0.000 0.000) 9.962 8.486 ( -32.698 0.000 0.000) 32.698 9.141 ( -16.355 0.000 0.000) 16.355 9.221 ( -18.369 0.000 0.000) 18.369 9.363 ( -3.558 0.000 0.000) 3.558 9.584 ( 1.281 0.000 0.000) 1.281 9.663 ( -6.209 0.000 0.000) 6.209 9.783 ( -0.702 0.000 0.000) 0.702 9.962 ( 5.332 0.000 0.000) 5.332 9.987 ( -3.292 0.000 0.000) 3.292 10.199 ( 8.207 0.000 0.000) 8.207 10.598 ( 24.527 0.000 0.000) 24.527 11.160 ( 13.908 0.000 0.000) 13.908 11.351 ( 10.249 0.000 0.000) 10.249 11.360 ( 6.314 0.000 0.000) 6.314 11.446 ( 30.575 0.000 0.000) 30.575 11.476 ( 19.735 0.000 0.000) 19.735 11.500 ( 21.863 0.000 0.000) 21.863 11.518 ( 11.553 0.000 0.000) 11.553 11.828 ( 26.830 0.000 0.000) 26.830 11.908 ( 16.849 0.000 0.000) 16.849 11.936 ( 13.544 0.000 0.000) 13.544 11.961 ( 0.158 0.000 0.000) 0.158 12.158 ( 18.464 0.000 0.000) 18.464 12.243 ( 38.015 0.000 0.000) 38.015 12.378 ( -36.846 0.000 0.000) 36.846 12.821 ( -16.264 0.000 0.000) 16.264 12.959 ( 10.052 0.000 0.000) 10.052 12.976 ( -13.607 0.000 0.000) 13.607 13.040 ( -9.193 0.000 0.000) 9.193 13.236 ( 1.425 0.000 0.000) 1.425 13.745 ( -2.031 0.000 0.000) 2.031 13.960 ( -11.472 0.000 0.000) 11.472 14.431 ( 13.164 0.000 0.000) 13.164 14.801 ( -19.290 0.000 0.000) 19.290 14.886 ( 15.947 0.000 0.000) 15.947 15.060 ( -5.254 0.000 0.000) 5.254 15.170 ( 0.652 0.000 0.000) 0.652 15.212 ( -11.608 0.000 0.000) 11.608 15.354 ( 19.653 0.000 0.000) 19.653 15.549 ( -3.392 0.000 0.000) 3.392 15.846 ( -29.681 0.000 0.000) 29.681 16.098 ( -8.530 0.000 0.000) 8.530 17.060 ( -4.208 0.000 0.000) 4.208 17.101 ( -26.560 0.000 0.000) 26.560 17.392 ( 0.665 0.000 0.000) 0.665 17.412 ( -1.802 0.000 0.000) 1.802 17.776 ( -14.505 0.000 0.000) 14.505 17.833 ( -8.893 0.000 0.000) 8.893 17.853 ( 7.995 0.000 0.000) 7.995 18.158 ( -0.036 0.000 0.000) 0.036 18.168 ( -0.628 0.000 0.000) 0.628 18.173 ( 0.069 0.000 0.000) 0.069 18.357 ( -4.334 0.000 0.000) 4.334 18.541 ( -14.702 0.000 0.000) 14.702 18.943 ( 1.155 0.000 0.000) 1.155 19.480 ( -13.946 0.000 0.000) 13.946 20.238 ( -8.227 0.000 0.000) 8.227 20.268 ( -2.157 0.000 0.000) 2.157 20.284 ( -5.716 0.000 0.000) 5.716 20.441 ( -3.061 0.000 0.000) 3.061 20.634 ( -11.195 0.000 0.000) 11.195 20.683 ( -4.171 0.000 0.000) 4.171 20.753 ( 4.067 0.000 0.000) 4.067 20.906 ( 0.369 0.000 0.000) 0.369 20.983 ( -3.504 0.000 0.000) 3.504 21.838 ( 16.586 0.000 0.000) 16.586 22.161 ( 32.316 0.000 0.000) 32.316 22.842 ( -7.200 0.000 0.000) 7.200 24.537 ( -13.615 0.000 0.000) 13.615 26.138 ( 12.340 0.000 0.000) 12.340 26.144 ( 8.868 0.000 0.000) 8.868 26.911 ( 17.938 0.000 0.000) 17.938 28.780 ( -11.424 0.000 0.000) 11.424 ======================= Grid point 3 (4/100) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.841 ( 49.085 0.000 0.000) 49.085 4.059 ( 66.625 0.000 0.000) 66.625 5.545 ( -37.563 0.000 0.000) 37.563 6.128 ( 89.525 0.000 0.000) 89.525 7.013 ( 1.627 0.000 0.000) 1.627 7.312 ( 5.531 0.000 0.000) 5.531 7.340 ( -8.370 0.000 0.000) 8.370 7.517 ( -38.719 0.000 0.000) 38.719 7.646 ( -6.239 0.000 0.000) 6.239 7.673 ( 6.271 0.000 0.000) 6.271 7.709 ( 5.566 0.000 0.000) 5.566 8.358 ( 11.896 0.000 0.000) 11.896 8.846 ( -13.547 0.000 0.000) 13.547 8.946 ( -8.498 0.000 0.000) 8.498 9.245 ( -8.746 0.000 0.000) 8.746 9.564 ( -3.125 0.000 0.000) 3.125 9.584 ( -1.030 0.000 0.000) 1.030 9.834 ( 5.757 0.000 0.000) 5.757 9.872 ( -9.527 0.000 0.000) 9.527 10.132 ( 12.829 0.000 0.000) 12.829 10.325 ( 3.090 0.000 0.000) 3.090 11.147 ( 22.150 0.000 0.000) 22.150 11.374 ( -16.189 0.000 0.000) 16.189 11.425 ( -21.180 0.000 0.000) 21.180 11.578 ( 22.781 0.000 0.000) 22.781 11.587 ( 13.618 0.000 0.000) 13.618 11.681 ( 6.283 0.000 0.000) 6.283 11.820 ( 9.712 0.000 0.000) 9.712 11.914 ( 16.042 0.000 0.000) 16.042 11.937 ( -2.270 0.000 0.000) 2.270 12.155 ( 38.196 0.000 0.000) 38.196 12.265 ( 11.152 0.000 0.000) 11.152 12.305 ( 20.832 0.000 0.000) 20.832 12.333 ( 24.269 0.000 0.000) 24.269 12.547 ( 18.471 0.000 0.000) 18.471 12.574 ( -11.442 0.000 0.000) 11.442 12.803 ( 3.676 0.000 0.000) 3.676 12.898 ( -0.763 0.000 0.000) 0.763 12.957 ( 28.995 0.000 0.000) 28.995 13.167 ( 12.344 0.000 0.000) 12.344 13.264 ( 0.650 0.000 0.000) 0.650 13.681 ( -4.718 0.000 0.000) 4.718 13.711 ( -13.154 0.000 0.000) 13.154 14.266 ( -33.850 0.000 0.000) 33.850 14.526 ( -4.428 0.000 0.000) 4.428 14.922 ( -17.197 0.000 0.000) 17.197 14.982 ( -9.693 0.000 0.000) 9.693 15.158 ( 10.834 0.000 0.000) 10.834 15.170 ( -10.556 0.000 0.000) 10.556 15.172 ( -28.567 0.000 0.000) 28.567 15.506 ( -0.452 0.000 0.000) 0.452 15.727 ( 17.334 0.000 0.000) 17.334 16.070 ( 18.721 0.000 0.000) 18.721 16.489 ( -34.728 0.000 0.000) 34.728 17.003 ( -6.570 0.000 0.000) 6.570 17.378 ( -1.277 0.000 0.000) 1.277 17.438 ( -18.344 0.000 0.000) 18.344 17.512 ( 9.795 0.000 0.000) 9.795 17.645 ( -9.874 0.000 0.000) 9.874 18.016 ( 7.404 0.000 0.000) 7.404 18.124 ( -3.936 0.000 0.000) 3.936 18.158 ( 0.031 0.000 0.000) 0.031 18.170 ( -0.308 0.000 0.000) 0.308 18.272 ( -11.548 0.000 0.000) 11.548 18.336 ( 2.754 0.000 0.000) 2.754 18.885 ( -7.253 0.000 0.000) 7.253 19.280 ( -4.973 0.000 0.000) 4.973 20.015 ( -15.740 0.000 0.000) 15.740 20.191 ( -3.617 0.000 0.000) 3.617 20.215 ( -3.034 0.000 0.000) 3.034 20.387 ( -2.977 0.000 0.000) 2.977 20.410 ( -9.078 0.000 0.000) 9.078 20.649 ( 1.148 0.000 0.000) 1.148 20.819 ( 2.678 0.000 0.000) 2.678 20.885 ( -2.548 0.000 0.000) 2.548 20.924 ( -2.363 0.000 0.000) 2.363 22.165 ( 15.617 0.000 0.000) 15.617 22.685 ( 0.974 0.000 0.000) 0.974 22.800 ( 22.917 0.000 0.000) 22.917 24.219 ( -18.657 0.000 0.000) 18.657 26.318 ( 8.221 0.000 0.000) 8.221 26.353 ( 8.779 0.000 0.000) 8.779 27.305 ( 21.744 0.000 0.000) 21.744 28.508 ( -16.153 0.000 0.000) 16.153 ======================= Grid point 4 (5/100) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.798 ( 48.428 0.000 0.000) 48.428 4.722 ( -45.433 0.000 0.000) 45.433 5.329 ( 62.866 0.000 0.000) 62.866 6.504 ( -56.577 0.000 0.000) 56.577 7.068 ( 4.089 0.000 0.000) 4.089 7.177 ( -7.118 0.000 0.000) 7.118 7.430 ( 6.345 0.000 0.000) 6.345 7.477 ( 32.310 0.000 0.000) 32.310 7.549 ( -5.432 0.000 0.000) 5.432 7.710 ( -2.549 0.000 0.000) 2.549 8.116 ( 38.685 0.000 0.000) 38.685 8.598 ( -13.084 0.000 0.000) 13.084 8.641 ( 22.587 0.000 0.000) 22.587 8.904 ( 3.678 0.000 0.000) 3.678 9.050 ( -9.971 0.000 0.000) 9.971 9.452 ( -40.270 0.000 0.000) 40.270 9.539 ( 0.189 0.000 0.000) 0.189 9.557 ( -1.393 0.000 0.000) 1.393 9.966 ( 7.844 0.000 0.000) 7.844 10.192 ( -15.842 0.000 0.000) 15.842 10.433 ( 15.162 0.000 0.000) 15.162 10.693 ( -16.961 0.000 0.000) 16.961 11.352 ( 5.298 0.000 0.000) 5.298 11.442 ( -2.881 0.000 0.000) 2.881 11.789 ( 4.937 0.000 0.000) 4.937 11.873 ( 11.018 0.000 0.000) 11.018 11.877 ( 0.448 0.000 0.000) 0.448 12.089 ( 14.023 0.000 0.000) 14.023 12.122 ( 12.718 0.000 0.000) 12.718 12.168 ( -13.763 0.000 0.000) 13.763 12.293 ( 21.551 0.000 0.000) 21.551 12.359 ( -9.992 0.000 0.000) 9.992 12.421 ( 8.448 0.000 0.000) 8.448 12.764 ( 18.621 0.000 0.000) 18.621 12.809 ( 13.626 0.000 0.000) 13.626 12.867 ( 12.103 0.000 0.000) 12.103 13.137 ( 13.504 0.000 0.000) 13.504 13.163 ( -0.425 0.000 0.000) 0.425 13.226 ( 0.998 0.000 0.000) 0.998 13.283 ( 34.076 0.000 0.000) 34.076 13.414 ( 0.584 0.000 0.000) 0.584 13.523 ( -3.161 0.000 0.000) 3.161 13.575 ( -5.191 0.000 0.000) 5.191 13.648 ( -16.886 0.000 0.000) 16.886 14.166 ( -29.898 0.000 0.000) 29.898 14.204 ( -39.934 0.000 0.000) 39.934 14.959 ( -3.212 0.000 0.000) 3.212 14.982 ( -3.489 0.000 0.000) 3.489 14.985 ( 13.005 0.000 0.000) 13.005 15.251 ( -4.175 0.000 0.000) 4.175 15.544 ( 4.939 0.000 0.000) 4.939 15.829 ( -28.163 0.000 0.000) 28.163 16.176 ( 26.435 0.000 0.000) 26.435 16.604 ( 29.063 0.000 0.000) 29.063 16.686 ( -23.946 0.000 0.000) 23.946 17.090 ( -19.643 0.000 0.000) 19.643 17.380 ( 2.021 0.000 0.000) 2.021 17.471 ( -7.225 0.000 0.000) 7.225 17.734 ( 12.496 0.000 0.000) 12.496 17.982 ( -11.572 0.000 0.000) 11.572 18.104 ( 1.889 0.000 0.000) 1.889 18.130 ( -2.320 0.000 0.000) 2.320 18.159 ( 0.159 0.000 0.000) 0.159 18.164 ( -0.292 0.000 0.000) 0.292 18.470 ( 9.927 0.000 0.000) 9.927 18.686 ( -11.567 0.000 0.000) 11.567 19.336 ( 10.517 0.000 0.000) 10.517 19.648 ( -19.559 0.000 0.000) 19.559 20.148 ( -0.706 0.000 0.000) 0.706 20.162 ( -1.970 0.000 0.000) 1.970 20.313 ( -1.450 0.000 0.000) 1.450 20.328 ( -2.465 0.000 0.000) 2.465 20.715 ( 4.781 0.000 0.000) 4.781 20.812 ( -4.688 0.000 0.000) 4.688 20.860 ( 1.638 0.000 0.000) 1.638 20.888 ( -1.433 0.000 0.000) 1.433 22.423 ( 10.608 0.000 0.000) 10.608 22.587 ( -6.513 0.000 0.000) 6.513 23.332 ( 26.305 0.000 0.000) 26.305 23.813 ( -22.719 0.000 0.000) 22.719 26.443 ( 4.080 0.000 0.000) 4.080 26.463 ( 2.255 0.000 0.000) 2.255 27.739 ( 22.109 0.000 0.000) 22.109 28.154 ( -19.899 0.000 0.000) 19.899 ======================= Grid point 9 (6/100) ======================= q-point: ( 0.00 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.947 ( 0.000 48.414 0.000) 48.414 1.366 ( 0.000 68.914 0.000) 68.914 2.128 ( 0.000 106.478 0.000) 106.478 6.753 ( 0.000 -8.593 0.000) 8.593 6.824 ( 0.000 25.915 0.000) 25.915 7.090 ( 0.000 1.847 0.000) 1.847 7.091 ( 0.000 0.756 0.000) 0.756 7.170 ( 0.000 6.087 0.000) 6.087 7.387 ( 0.000 3.584 0.000) 3.584 7.641 ( 0.000 1.755 0.000) 1.755 8.834 ( 0.000 -14.618 0.000) 14.618 8.884 ( 0.000 -32.506 0.000) 32.506 9.152 ( 0.000 -2.427 0.000) 2.427 9.593 ( 0.000 -14.677 0.000) 14.677 9.720 ( 0.000 2.330 0.000) 2.330 9.729 ( 0.000 -0.386 0.000) 0.386 9.766 ( 0.000 15.424 0.000) 15.424 9.815 ( 0.000 -1.810 0.000) 1.810 9.829 ( 0.000 -18.353 0.000) 18.353 9.852 ( 0.000 -3.096 0.000) 3.096 10.288 ( 0.000 1.400 0.000) 1.400 10.332 ( 0.000 3.914 0.000) 3.914 10.742 ( 0.000 7.176 0.000) 7.176 10.759 ( 0.000 0.232 0.000) 0.232 10.987 ( 0.000 7.323 0.000) 7.323 11.098 ( 0.000 5.049 0.000) 5.049 11.221 ( 0.000 9.091 0.000) 9.091 11.230 ( 0.000 7.469 0.000) 7.469 11.449 ( 0.000 27.063 0.000) 27.063 11.455 ( 0.000 18.119 0.000) 18.119 11.525 ( 0.000 18.045 0.000) 18.045 11.656 ( 0.000 5.037 0.000) 5.037 11.894 ( 0.000 16.868 0.000) 16.868 11.956 ( 0.000 20.251 0.000) 20.251 12.110 ( 0.000 15.504 0.000) 15.504 12.728 ( 0.000 -0.475 0.000) 0.475 12.780 ( 0.000 -2.737 0.000) 2.737 13.225 ( 0.000 -17.140 0.000) 17.140 13.260 ( 0.000 -2.197 0.000) 2.197 13.384 ( 0.000 -6.337 0.000) 6.337 13.541 ( 0.000 7.352 0.000) 7.352 13.582 ( 0.000 0.253 0.000) 0.253 13.665 ( 0.000 -20.773 0.000) 20.773 13.767 ( 0.000 -0.312 0.000) 0.312 14.423 ( 0.000 6.014 0.000) 6.014 15.033 ( 0.000 -10.379 0.000) 10.379 15.108 ( 0.000 3.705 0.000) 3.705 15.390 ( 0.000 1.270 0.000) 1.270 15.549 ( 0.000 -12.386 0.000) 12.386 15.672 ( 0.000 13.916 0.000) 13.916 15.729 ( 0.000 8.922 0.000) 8.922 15.853 ( 0.000 -4.607 0.000) 4.607 16.014 ( 0.000 -0.692 0.000) 0.692 16.320 ( 0.000 9.533 0.000) 9.533 17.212 ( 0.000 -20.686 0.000) 20.686 17.266 ( 0.000 -18.896 0.000) 18.896 17.543 ( 0.000 -5.425 0.000) 5.425 17.908 ( 0.000 9.686 0.000) 9.686 17.938 ( 0.000 -5.688 0.000) 5.688 18.054 ( 0.000 -2.376 0.000) 2.376 18.090 ( 0.000 -5.359 0.000) 5.359 18.109 ( 0.000 0.744 0.000) 0.744 18.457 ( 0.000 -10.929 0.000) 10.929 18.657 ( 0.000 -12.746 0.000) 12.746 19.009 ( 0.000 11.957 0.000) 11.957 19.479 ( 0.000 3.260 0.000) 3.260 19.691 ( 0.000 -21.072 0.000) 21.072 19.938 ( 0.000 -4.566 0.000) 4.566 20.318 ( 0.000 -17.651 0.000) 17.651 20.424 ( 0.000 -0.825 0.000) 0.825 20.424 ( 0.000 -3.891 0.000) 3.891 20.629 ( 0.000 -26.097 0.000) 26.097 20.920 ( 0.000 0.259 0.000) 0.259 20.929 ( 0.000 8.062 0.000) 8.062 21.035 ( 0.000 2.254 0.000) 2.254 21.189 ( 0.000 28.687 0.000) 28.687 21.376 ( 0.000 8.825 0.000) 8.825 22.717 ( 0.000 27.083 0.000) 27.083 23.069 ( 0.000 2.262 0.000) 2.262 25.836 ( 0.000 1.838 0.000) 1.838 25.927 ( 0.000 -5.307 0.000) 5.307 25.974 ( 0.000 2.904 0.000) 2.904 26.488 ( 0.000 -3.030 0.000) 3.030 27.041 ( 0.000 -3.228 0.000) 3.228 ======================= Grid point 10 (7/100) ======================= q-point: ( 0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.917 ( 48.132 47.208 0.000) 67.419 1.946 ( 47.761 49.327 0.000) 68.661 2.670 ( 69.228 65.547 0.000) 95.336 6.734 ( -9.380 25.462 0.000) 27.135 6.888 ( 10.742 -9.342 0.000) 14.236 7.102 ( 1.832 5.240 0.000) 5.551 7.212 ( 10.919 0.645 0.000) 10.938 7.221 ( 6.562 5.170 0.000) 8.354 7.405 ( 1.634 3.058 0.000) 3.467 7.748 ( 9.815 1.309 0.000) 9.901 8.491 ( -26.685 0.258 0.000) 26.687 8.839 ( -5.635 -23.799 0.000) 24.457 9.175 ( -0.327 -17.925 0.000) 17.928 9.406 ( -23.330 1.124 0.000) 23.357 9.448 ( -10.196 -12.109 0.000) 15.830 9.597 ( -5.257 2.400 0.000) 5.779 9.707 ( -10.305 5.907 0.000) 11.878 9.928 ( 7.134 7.179 0.000) 10.121 9.950 ( 6.200 -10.294 0.000) 12.017 9.972 ( 8.458 -1.535 0.000) 8.596 10.083 ( -2.570 5.298 0.000) 5.888 10.486 ( 0.546 9.019 0.000) 9.035 10.667 ( 0.912 -13.223 0.000) 13.255 10.955 ( 22.684 6.171 0.000) 23.508 11.182 ( 11.473 3.099 0.000) 11.884 11.255 ( 12.945 10.116 0.000) 16.428 11.299 ( 10.300 10.462 0.000) 14.681 11.358 ( 12.792 8.921 0.000) 15.596 11.462 ( 2.004 19.480 0.000) 19.583 11.660 ( 17.565 23.253 0.000) 29.142 11.712 ( 20.229 11.246 0.000) 23.145 11.717 ( 5.295 5.840 0.000) 7.883 11.893 ( 4.143 13.261 0.000) 13.893 12.013 ( 7.512 14.876 0.000) 16.665 12.109 ( -0.469 13.743 0.000) 13.751 12.736 ( -3.502 -1.752 0.000) 3.916 12.786 ( 3.451 -0.159 0.000) 3.455 13.069 ( -12.099 -10.695 0.000) 16.148 13.174 ( -6.879 -8.609 0.000) 11.020 13.318 ( 0.950 5.345 0.000) 5.428 13.321 ( -23.389 2.309 0.000) 23.503 13.771 ( -0.300 0.438 0.000) 0.531 13.815 ( 12.366 -16.161 0.000) 20.349 14.086 ( 19.944 -11.895 0.000) 23.222 14.493 ( 9.685 1.763 0.000) 9.844 14.911 ( -8.926 -9.174 0.000) 12.800 15.128 ( -5.694 4.444 0.000) 7.223 15.150 ( -0.421 2.501 0.000) 2.536 15.367 ( -8.802 -2.022 0.000) 9.031 15.545 ( -9.432 7.572 0.000) 12.095 15.730 ( -2.588 12.730 0.000) 12.990 15.967 ( 8.424 -9.602 0.000) 12.773 16.293 ( -5.959 9.648 0.000) 11.340 16.703 ( 34.008 -27.659 0.000) 43.836 17.119 ( -9.804 -18.310 0.000) 20.769 17.251 ( -2.377 -15.157 0.000) 15.342 17.365 ( -8.849 -4.803 0.000) 10.068 17.715 ( -16.495 2.472 0.000) 16.680 17.934 ( -2.989 -5.846 0.000) 6.566 18.012 ( -3.981 -0.672 0.000) 4.038 18.067 ( -1.466 -5.283 0.000) 5.483 18.185 ( 4.159 0.620 0.000) 4.205 18.405 ( -4.601 -4.962 0.000) 6.767 18.713 ( 2.871 -10.354 0.000) 10.744 18.916 ( -8.724 6.800 0.000) 11.062 19.087 ( -25.395 27.604 0.000) 37.508 19.500 ( -13.229 -19.237 0.000) 23.346 20.005 ( 1.780 -13.722 0.000) 13.837 20.298 ( -1.924 -8.086 0.000) 8.312 20.357 ( -5.246 -1.980 0.000) 5.607 20.525 ( 7.017 -6.855 0.000) 9.809 20.714 ( 5.240 -20.089 0.000) 20.761 20.766 ( -10.636 4.576 0.000) 11.579 20.965 ( 3.084 6.981 0.000) 7.632 20.965 ( -2.738 16.754 0.000) 16.977 21.246 ( -8.905 18.624 0.000) 20.644 21.560 ( 27.049 5.866 0.000) 27.678 22.261 ( -21.602 48.332 0.000) 52.940 22.996 ( -6.837 1.502 0.000) 7.000 24.994 ( -30.017 16.717 0.000) 34.358 25.927 ( 8.719 1.299 0.000) 8.815 26.024 ( 5.363 2.878 0.000) 6.086 26.592 ( 10.266 -3.326 0.000) 10.791 28.187 ( 35.378 -47.405 0.000) 59.151 ======================= Grid point 11 (8/100) ======================= q-point: ( 0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.663 ( 35.471 62.220 0.000) 71.621 3.008 ( 60.260 26.696 0.000) 65.909 4.432 ( 96.412 22.662 0.000) 99.040 6.428 ( -22.750 26.283 0.000) 34.762 7.013 ( 2.459 -3.751 0.000) 4.485 7.177 ( 4.962 2.663 0.000) 5.631 7.419 ( 1.712 0.093 0.000) 1.714 7.458 ( 9.706 -1.152 0.000) 9.774 7.481 ( 16.944 5.784 0.000) 17.904 7.964 ( 9.682 0.391 0.000) 9.690 7.996 ( -20.880 6.960 0.000) 22.009 8.532 ( -26.257 4.304 0.000) 26.607 9.040 ( -12.081 -4.898 0.000) 13.036 9.059 ( -8.347 -22.132 0.000) 23.654 9.370 ( -2.756 -7.972 0.000) 8.435 9.439 ( -10.340 4.302 0.000) 11.199 9.575 ( 1.920 2.404 0.000) 3.076 9.974 ( -1.462 -2.298 0.000) 2.724 9.984 ( 0.867 4.679 0.000) 4.759 10.113 ( 0.711 11.538 0.000) 11.560 10.165 ( 9.474 -2.621 0.000) 9.830 10.626 ( 18.991 3.188 0.000) 19.257 10.836 ( 13.308 -23.191 0.000) 26.738 11.366 ( 9.233 -0.339 0.000) 9.239 11.377 ( 10.302 -2.194 0.000) 10.533 11.544 ( 15.164 9.465 0.000) 17.876 11.583 ( 18.931 17.017 0.000) 25.455 11.638 ( 22.740 13.598 0.000) 26.496 11.703 ( 14.097 15.425 0.000) 20.896 11.852 ( 13.363 -1.380 0.000) 13.434 12.057 ( -2.905 7.486 0.000) 8.030 12.070 ( 17.917 16.896 0.000) 24.627 12.084 ( 14.677 9.585 0.000) 17.529 12.246 ( 15.759 8.374 0.000) 17.846 12.248 ( 30.712 -0.777 0.000) 30.721 12.469 ( -27.983 9.722 0.000) 29.624 12.718 ( -8.715 -6.602 0.000) 10.934 12.822 ( -11.996 -10.811 0.000) 16.149 13.021 ( -8.307 -6.011 0.000) 10.254 13.061 ( 4.809 8.123 0.000) 9.439 13.346 ( 1.559 8.726 0.000) 8.864 13.750 ( -1.953 0.703 0.000) 2.076 13.909 ( -4.552 -4.133 0.000) 6.149 14.377 ( 15.852 -6.557 0.000) 17.155 14.648 ( 3.939 -11.928 0.000) 12.562 14.668 ( -17.557 -8.974 0.000) 19.717 15.056 ( -8.434 2.150 0.000) 8.703 15.301 ( 13.459 2.117 0.000) 13.625 15.335 ( -12.616 5.040 0.000) 13.585 15.345 ( 10.501 0.073 0.000) 10.502 15.629 ( -6.634 8.280 0.000) 10.610 15.956 ( -27.309 10.078 0.000) 29.109 16.002 ( -3.969 -9.443 0.000) 10.243 16.867 ( -23.724 -20.634 0.000) 31.442 16.989 ( -1.955 -10.337 0.000) 10.521 17.265 ( -3.256 -7.348 0.000) 8.037 17.272 ( 11.818 -7.135 0.000) 13.805 17.548 ( 2.210 -10.395 0.000) 10.627 17.822 ( -8.164 0.620 0.000) 8.187 17.928 ( -3.244 3.225 0.000) 4.575 18.026 ( -2.988 -7.136 0.000) 7.736 18.237 ( 1.625 2.172 0.000) 2.712 18.310 ( -4.412 -0.380 0.000) 4.428 18.492 ( -20.518 -8.054 0.000) 22.042 18.708 ( -13.635 26.773 0.000) 30.045 18.880 ( 1.427 -6.376 0.000) 6.534 19.330 ( -3.843 -6.430 0.000) 7.491 19.990 ( -2.565 -15.428 0.000) 15.639 20.237 ( -4.649 -4.108 0.000) 6.204 20.241 ( -6.484 -0.784 0.000) 6.531 20.575 ( -6.561 6.472 0.000) 9.216 20.656 ( 4.849 -3.173 0.000) 5.795 20.767 ( 0.355 -6.474 0.000) 6.483 20.906 ( -3.285 15.683 0.000) 16.023 20.990 ( -3.174 8.921 0.000) 9.469 21.107 ( -5.511 17.396 0.000) 18.248 22.085 ( 1.438 24.577 0.000) 24.619 22.138 ( 30.663 -1.735 0.000) 30.712 22.838 ( -8.440 -0.409 0.000) 8.450 24.574 ( -18.309 2.922 0.000) 18.540 26.138 ( 11.671 0.087 0.000) 11.671 26.163 ( 8.275 1.956 0.000) 8.503 26.868 ( 17.281 -4.230 0.000) 17.791 28.453 ( -0.444 -28.426 0.000) 28.430 ======================= Grid point 12 (9/100) ======================= q-point: ( 0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.408 ( 40.412 50.165 0.000) 64.418 4.213 ( 61.997 15.374 0.000) 63.875 5.842 ( -36.068 27.877 0.000) 45.585 6.248 ( 85.603 12.950 0.000) 86.577 7.041 ( -0.292 -1.140 0.000) 1.176 7.293 ( 7.304 2.522 0.000) 7.727 7.370 ( -5.118 1.533 0.000) 5.342 7.529 ( -28.478 0.882 0.000) 28.492 7.601 ( 0.314 -4.302 0.000) 4.313 7.746 ( -2.830 8.381 0.000) 8.846 7.883 ( 0.052 14.260 0.000) 14.260 8.362 ( 10.282 3.229 0.000) 10.778 8.811 ( -10.246 1.023 0.000) 10.297 8.979 ( -2.332 -20.306 0.000) 20.439 9.117 ( -12.584 12.175 0.000) 17.509 9.480 ( 2.747 -9.799 0.000) 10.177 9.637 ( 3.731 8.205 0.000) 9.014 9.904 ( -5.736 2.590 0.000) 6.294 10.002 ( -0.066 2.572 0.000) 2.573 10.168 ( 8.860 9.619 0.000) 13.078 10.330 ( 6.377 0.941 0.000) 6.446 11.093 ( 10.799 -22.249 0.000) 24.731 11.132 ( 23.931 -1.607 0.000) 23.985 11.390 ( -44.065 -0.735 0.000) 44.071 11.487 ( 11.215 -3.297 0.000) 11.690 11.590 ( 9.329 -4.276 0.000) 10.262 11.799 ( 4.879 -0.786 0.000) 4.942 11.918 ( 11.815 10.216 0.000) 15.619 11.978 ( 14.828 14.735 0.000) 20.904 12.057 ( -6.779 6.314 0.000) 9.265 12.179 ( 30.868 4.624 0.000) 31.213 12.264 ( 11.316 -1.258 0.000) 11.386 12.374 ( 11.877 4.930 0.000) 12.860 12.442 ( 7.898 5.371 0.000) 9.551 12.569 ( 19.153 1.614 0.000) 19.221 12.628 ( 7.012 9.301 0.000) 11.648 12.747 ( 8.723 -4.817 0.000) 9.965 12.917 ( 3.577 2.928 0.000) 4.622 12.937 ( 29.986 -4.182 0.000) 30.276 13.200 ( 6.759 4.471 0.000) 8.104 13.370 ( 0.445 9.102 0.000) 9.113 13.687 ( -4.576 0.588 0.000) 4.614 13.736 ( -10.529 2.328 0.000) 10.783 14.201 ( -28.443 -3.189 0.000) 28.621 14.527 ( -3.553 0.113 0.000) 3.555 14.760 ( -25.949 -5.616 0.000) 26.549 14.837 ( 14.530 -18.523 0.000) 23.542 15.097 ( -8.163 2.801 0.000) 8.631 15.254 ( -15.291 -2.156 0.000) 15.442 15.379 ( -24.531 14.071 0.000) 28.280 15.535 ( -4.978 4.597 0.000) 6.776 15.713 ( 20.186 -2.194 0.000) 20.305 16.100 ( 18.305 0.435 0.000) 18.310 16.280 ( -30.723 -17.735 0.000) 35.474 16.926 ( -7.400 -12.615 0.000) 14.626 17.195 ( -5.652 -4.136 0.000) 7.004 17.421 ( 1.163 -6.038 0.000) 6.148 17.600 ( -14.058 6.922 0.000) 15.670 17.640 ( 6.006 -2.830 0.000) 6.639 17.955 ( 5.881 0.885 0.000) 5.947 17.966 ( -1.652 -10.257 0.000) 10.389 18.163 ( -11.086 -8.926 0.000) 14.233 18.258 ( -0.381 -0.391 0.000) 0.546 18.260 ( 0.870 4.061 0.000) 4.153 18.518 ( -6.303 17.434 0.000) 18.538 18.836 ( -6.165 -5.005 0.000) 7.941 19.331 ( 3.966 6.329 0.000) 7.469 19.923 ( -4.265 -9.522 0.000) 10.434 20.104 ( -7.600 0.402 0.000) 7.610 20.113 ( -7.197 -3.777 0.000) 8.128 20.496 ( -1.644 5.033 0.000) 5.294 20.709 ( -8.489 14.671 0.000) 16.950 20.752 ( 4.621 3.827 0.000) 6.000 20.844 ( -2.545 8.730 0.000) 9.093 20.852 ( -5.116 0.251 0.000) 5.123 21.031 ( -3.632 9.888 0.000) 10.534 22.222 ( 10.043 6.432 0.000) 11.926 22.665 ( 1.046 -1.971 0.000) 2.231 22.753 ( 21.655 -4.525 0.000) 22.122 24.201 ( -20.232 -1.944 0.000) 20.325 26.324 ( 7.608 0.800 0.000) 7.650 26.343 ( 8.498 -0.822 0.000) 8.538 27.244 ( 20.575 -5.956 0.000) 21.419 28.317 ( -11.812 -18.022 0.000) 21.548 ======================= Grid point 13 (10/100) ======================= q-point: ( 0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.227 ( 42.841 39.551 0.000) 58.307 5.062 ( -41.249 31.735 0.000) 52.044 5.414 ( 58.868 8.609 0.000) 59.494 6.520 ( -51.750 1.795 0.000) 51.782 7.176 ( 2.032 7.596 0.000) 7.863 7.259 ( -5.450 5.474 0.000) 7.725 7.309 ( 14.631 -3.986 0.000) 15.164 7.496 ( -7.647 -3.176 0.000) 8.280 7.689 ( 18.928 15.286 0.000) 24.330 7.780 ( 1.466 6.922 0.000) 7.076 8.211 ( 41.322 8.768 0.000) 42.242 8.603 ( 18.019 -0.410 0.000) 18.023 8.635 ( -8.966 5.082 0.000) 10.307 8.934 ( -1.833 -9.419 0.000) 9.596 8.946 ( -4.371 3.618 0.000) 5.674 9.327 ( -28.460 -5.715 0.000) 29.028 9.703 ( 2.715 13.867 0.000) 14.131 9.766 ( -5.757 13.322 0.000) 14.513 10.024 ( 4.360 1.650 0.000) 4.662 10.259 ( -18.319 6.355 0.000) 19.390 10.417 ( 12.982 0.940 0.000) 13.016 10.631 ( -15.743 -5.182 0.000) 16.574 11.268 ( 4.338 -15.155 0.000) 15.763 11.300 ( 0.387 -4.256 0.000) 4.274 11.762 ( 5.951 -4.206 0.000) 7.287 11.765 ( 6.829 -7.661 0.000) 10.263 11.946 ( -2.163 3.019 0.000) 3.714 12.005 ( 2.688 -9.569 0.000) 9.940 12.187 ( 12.161 5.136 0.000) 13.201 12.219 ( 3.211 -3.601 0.000) 4.824 12.280 ( 22.298 4.061 0.000) 22.664 12.373 ( -6.353 4.394 0.000) 7.724 12.451 ( -3.104 6.276 0.000) 7.002 12.698 ( 12.546 -4.834 0.000) 13.445 12.909 ( 4.612 4.667 0.000) 6.561 12.953 ( 14.040 7.341 0.000) 15.843 13.050 ( 11.671 -11.129 0.000) 16.127 13.166 ( 0.017 0.148 0.000) 0.149 13.232 ( 17.315 6.964 0.000) 18.663 13.366 ( 3.375 -0.489 0.000) 3.410 13.399 ( 10.968 8.024 0.000) 13.590 13.599 ( -2.796 2.190 0.000) 3.552 13.622 ( 3.258 7.354 0.000) 8.044 13.780 ( -5.142 11.671 0.000) 12.754 14.109 ( -35.053 -6.816 0.000) 35.710 14.191 ( -29.285 3.176 0.000) 29.457 14.949 ( -0.498 -1.121 0.000) 1.227 14.994 ( -3.935 1.125 0.000) 4.093 15.098 ( -1.411 8.291 0.000) 8.410 15.131 ( 2.687 -10.480 0.000) 10.819 15.487 ( 0.283 -5.251 0.000) 5.259 15.692 ( -23.753 -12.394 0.000) 26.793 16.165 ( 25.186 -2.390 0.000) 25.299 16.575 ( 24.024 -3.834 0.000) 24.328 16.642 ( -21.416 -6.710 0.000) 22.442 16.977 ( -16.383 -8.540 0.000) 18.475 17.376 ( -2.698 -6.274 0.000) 6.829 17.391 ( -5.374 -0.106 0.000) 5.375 17.787 ( 8.151 3.186 0.000) 8.752 17.932 ( -5.415 -4.031 0.000) 6.751 18.052 ( 0.192 -1.682 0.000) 1.693 18.054 ( 2.252 -0.874 0.000) 2.416 18.277 ( 0.997 6.559 0.000) 6.634 18.286 ( 1.248 4.943 0.000) 5.098 18.481 ( 4.217 3.259 0.000) 5.330 18.657 ( -11.001 -3.185 0.000) 11.453 19.496 ( 12.677 15.266 0.000) 19.843 19.772 ( -12.803 11.875 0.000) 17.462 19.983 ( -2.685 -8.920 0.000) 9.316 19.999 ( -3.760 -7.865 0.000) 8.718 20.483 ( 0.251 7.073 0.000) 7.078 20.533 ( -5.985 12.088 0.000) 13.488 20.804 ( 0.147 7.668 0.000) 7.669 20.813 ( -0.765 -0.668 0.000) 1.016 20.855 ( 4.290 1.565 0.000) 4.566 20.947 ( -4.764 7.337 0.000) 8.748 22.413 ( 8.700 -0.767 0.000) 8.734 22.558 ( -6.329 -2.785 0.000) 6.914 23.286 ( 26.527 -4.677 0.000) 26.937 23.775 ( -23.375 -3.907 0.000) 23.699 26.439 ( 3.613 -0.248 0.000) 3.621 26.452 ( 2.425 -0.888 0.000) 2.582 27.651 ( 20.411 -8.647 0.000) 22.167 28.025 ( -17.450 -12.395 0.000) 21.404 ======================= Grid point 18 (11/100) ======================= q-point: ( 0.00 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.918 ( 0.000 49.914 0.000) 49.914 2.717 ( 0.000 67.752 0.000) 67.752 4.178 ( 0.000 100.141 0.000) 100.141 6.453 ( 0.000 -22.948 0.000) 22.948 7.124 ( 0.000 2.751 0.000) 2.751 7.128 ( 0.000 1.649 0.000) 1.649 7.290 ( 0.000 5.433 0.000) 5.433 7.363 ( 0.000 14.800 0.000) 14.800 7.554 ( 0.000 20.446 0.000) 20.446 7.682 ( 0.000 2.178 0.000) 2.178 8.283 ( 0.000 -25.334 0.000) 25.334 8.417 ( 0.000 -25.446 0.000) 25.446 9.075 ( 0.000 -5.472 0.000) 5.472 9.230 ( 0.000 -19.433 0.000) 19.433 9.516 ( 0.000 -9.602 0.000) 9.602 9.588 ( 0.000 -15.172 0.000) 15.172 9.726 ( 0.000 0.208 0.000) 0.208 9.860 ( 0.000 10.157 0.000) 10.157 9.941 ( 0.000 6.803 0.000) 6.803 10.052 ( 0.000 9.285 0.000) 9.285 10.291 ( 0.000 -1.535 0.000) 1.535 10.465 ( 0.000 15.820 0.000) 15.820 10.888 ( 0.000 10.378 0.000) 10.378 11.011 ( 0.000 20.093 0.000) 20.093 11.173 ( 0.000 7.358 0.000) 7.358 11.248 ( 0.000 7.808 0.000) 7.808 11.425 ( 0.000 10.817 0.000) 10.817 11.436 ( 0.000 15.291 0.000) 15.291 11.666 ( 0.000 7.373 0.000) 7.373 11.808 ( 0.000 8.052 0.000) 8.052 11.872 ( 0.000 18.213 0.000) 18.213 12.012 ( 0.000 28.424 0.000) 28.424 12.098 ( 0.000 -14.754 0.000) 14.754 12.438 ( 0.000 13.085 0.000) 13.085 12.631 ( 0.000 42.491 0.000) 42.491 12.694 ( 0.000 -4.601 0.000) 4.601 12.750 ( 0.000 2.837 0.000) 2.837 12.903 ( 0.000 0.666 0.000) 0.666 13.110 ( 0.000 -17.195 0.000) 17.195 13.205 ( 0.000 -3.112 0.000) 3.112 13.430 ( 0.000 -4.474 0.000) 4.474 13.631 ( 0.000 5.592 0.000) 5.592 13.750 ( 0.000 13.692 0.000) 13.692 13.791 ( 0.000 2.999 0.000) 2.999 14.485 ( 0.000 0.218 0.000) 0.218 14.884 ( 0.000 -4.643 0.000) 4.643 15.172 ( 0.000 -25.638 0.000) 25.638 15.213 ( 0.000 7.672 0.000) 7.672 15.338 ( 0.000 -9.405 0.000) 9.405 15.711 ( 0.000 -7.928 0.000) 7.928 15.889 ( 0.000 5.710 0.000) 5.710 15.955 ( 0.000 -6.033 0.000) 6.033 15.970 ( 0.000 14.278 0.000) 14.278 16.551 ( 0.000 12.603 0.000) 12.603 16.751 ( 0.000 -23.089 0.000) 23.089 16.960 ( 0.000 -10.843 0.000) 10.843 17.400 ( 0.000 -8.136 0.000) 8.136 17.731 ( 0.000 -13.473 0.000) 13.473 18.003 ( 0.000 -2.722 0.000) 2.722 18.020 ( 0.000 -1.029 0.000) 1.029 18.029 ( 0.000 3.049 0.000) 3.049 18.093 ( 0.000 -2.728 0.000) 2.728 18.144 ( 0.000 -20.117 0.000) 20.117 18.316 ( 0.000 -20.580 0.000) 20.580 19.282 ( 0.000 14.310 0.000) 14.310 19.308 ( 0.000 -17.571 0.000) 17.571 19.520 ( 0.000 -0.629 0.000) 0.629 19.813 ( 0.000 -7.737 0.000) 7.737 19.881 ( 0.000 -25.127 0.000) 25.127 20.193 ( 0.000 -15.296 0.000) 15.296 20.351 ( 0.000 -4.221 0.000) 4.221 20.392 ( 0.000 -2.444 0.000) 2.444 20.897 ( 0.000 -0.933 0.000) 0.933 21.055 ( 0.000 -0.346 0.000) 0.346 21.135 ( 0.000 11.824 0.000) 11.824 21.517 ( 0.000 5.848 0.000) 5.848 21.780 ( 0.000 28.988 0.000) 28.988 23.111 ( 0.000 1.312 0.000) 1.312 23.334 ( 0.000 33.264 0.000) 33.264 25.759 ( 0.000 -11.432 0.000) 11.432 25.889 ( 0.000 3.444 0.000) 3.444 26.068 ( 0.000 6.371 0.000) 6.371 26.406 ( 0.000 -5.095 0.000) 5.095 26.947 ( 0.000 -6.210 0.000) 6.210 ======================= Grid point 19 (12/100) ======================= q-point: ( 0.11 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.685 ( 61.766 36.055 0.000) 71.519 2.997 ( 27.280 59.108 0.000) 65.099 4.397 ( 24.474 94.276 0.000) 97.401 6.606 ( 13.473 -20.739 0.000) 24.731 7.168 ( 2.126 5.491 0.000) 5.888 7.175 ( 4.994 1.469 0.000) 5.206 7.295 ( 1.660 2.987 0.000) 3.418 7.349 ( -0.899 14.531 0.000) 14.559 7.534 ( -2.286 14.874 0.000) 15.049 7.807 ( 11.616 3.516 0.000) 12.137 8.352 ( 6.424 -21.200 0.000) 22.152 8.440 ( -2.867 -8.253 0.000) 8.737 8.785 ( -12.228 -15.507 0.000) 19.748 9.172 ( -4.848 -13.747 0.000) 14.577 9.475 ( -26.595 4.674 0.000) 27.002 9.682 ( 6.559 -12.210 0.000) 13.860 9.738 ( 12.460 -9.189 0.000) 15.482 9.742 ( -7.223 10.789 0.000) 12.984 9.973 ( 3.604 5.623 0.000) 6.679 10.028 ( 4.733 -0.413 0.000) 4.751 10.262 ( -2.757 16.454 0.000) 16.684 10.599 ( -18.586 5.795 0.000) 19.468 10.602 ( 5.890 5.525 0.000) 8.076 11.149 ( 13.713 14.298 0.000) 19.811 11.229 ( 6.711 1.732 0.000) 6.931 11.440 ( 11.537 6.245 0.000) 13.118 11.526 ( 9.595 7.703 0.000) 12.304 11.660 ( 20.132 21.998 0.000) 29.820 11.729 ( 7.731 9.725 0.000) 12.423 11.917 ( 4.998 13.532 0.000) 14.426 11.920 ( 11.209 9.235 0.000) 14.523 12.137 ( 11.058 21.883 0.000) 24.519 12.142 ( 4.241 -14.979 0.000) 15.568 12.366 ( -6.025 8.358 0.000) 10.303 12.425 ( -14.327 32.549 0.000) 35.563 12.685 ( -0.701 -2.027 0.000) 2.144 12.819 ( 3.161 3.449 0.000) 4.679 12.850 ( -14.213 -11.554 0.000) 18.316 12.916 ( -0.421 2.675 0.000) 2.708 13.417 ( 9.180 2.172 0.000) 9.434 13.448 ( -14.861 11.488 0.000) 18.783 13.650 ( 16.208 -0.245 0.000) 16.210 13.804 ( 0.130 3.153 0.000) 3.155 13.935 ( 14.409 -1.852 0.000) 14.528 14.549 ( 4.195 2.961 0.000) 5.135 14.778 ( -9.025 -3.745 0.000) 9.771 15.063 ( -5.826 -13.940 0.000) 15.108 15.223 ( -2.725 -11.454 0.000) 11.774 15.234 ( -0.319 6.328 0.000) 6.336 15.661 ( -14.958 3.212 0.000) 15.299 15.697 ( 2.552 -15.097 0.000) 15.311 16.009 ( -4.342 12.223 0.000) 12.971 16.366 ( 24.517 -12.259 0.000) 27.411 16.510 ( -8.309 10.282 0.000) 13.220 16.692 ( -3.498 -20.862 0.000) 21.153 16.999 ( 3.513 -9.180 0.000) 9.829 17.271 ( -6.955 -4.505 0.000) 8.287 17.666 ( -23.410 -7.700 0.000) 24.644 17.722 ( -1.039 -13.084 0.000) 13.125 17.999 ( -0.419 -1.543 0.000) 1.599 18.006 ( -1.288 -0.031 0.000) 1.288 18.137 ( 2.523 -5.956 0.000) 6.468 18.272 ( 3.008 -7.377 0.000) 7.967 18.431 ( 8.808 -16.701 0.000) 18.882 18.900 ( -25.385 -10.717 0.000) 27.555 19.371 ( 0.797 8.290 0.000) 8.328 19.396 ( -11.946 7.710 0.000) 14.218 19.771 ( -2.554 -9.996 0.000) 10.317 20.026 ( 7.940 -19.474 0.000) 21.030 20.258 ( 2.228 -8.795 0.000) 9.072 20.398 ( 5.253 -5.961 0.000) 7.946 20.410 ( 4.619 -8.362 0.000) 9.553 20.819 ( -6.119 2.191 0.000) 6.500 21.143 ( 5.975 0.948 0.000) 6.049 21.154 ( 1.579 11.092 0.000) 11.204 21.484 ( -3.105 7.872 0.000) 8.462 21.853 ( 8.492 21.911 0.000) 23.499 23.025 ( -8.225 0.860 0.000) 8.269 23.118 ( -19.384 38.583 0.000) 43.178 25.196 ( -35.429 2.888 0.000) 35.546 25.967 ( 7.467 2.724 0.000) 7.948 26.110 ( 4.502 5.901 0.000) 7.422 26.501 ( 9.405 -5.657 0.000) 10.975 27.468 ( 30.066 -27.040 0.000) 40.436 ======================= Grid point 20 (13/100) ======================= q-point: ( 0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.710 ( 43.641 42.477 0.000) 60.900 3.778 ( 43.855 44.197 0.000) 62.262 5.274 ( 65.509 63.552 0.000) 91.271 6.845 ( 8.665 -12.670 0.000) 15.349 7.023 ( -18.723 27.076 0.000) 32.919 7.256 ( 2.491 2.758 0.000) 3.716 7.394 ( 4.105 -2.624 0.000) 4.872 7.468 ( -3.529 3.042 0.000) 4.659 7.470 ( 15.222 -6.866 0.000) 16.699 8.064 ( 12.202 8.477 0.000) 14.858 8.184 ( -14.097 11.351 0.000) 18.098 8.497 ( 7.568 -10.076 0.000) 12.602 8.882 ( -29.815 7.963 0.000) 30.860 8.886 ( 11.741 -13.414 0.000) 17.827 9.090 ( -0.922 -6.798 0.000) 6.860 9.642 ( -2.013 4.144 0.000) 4.607 9.668 ( -10.899 7.669 0.000) 13.326 9.893 ( 3.697 -5.078 0.000) 6.281 10.113 ( 10.986 -2.136 0.000) 11.192 10.184 ( 3.517 7.266 0.000) 8.072 10.208 ( 2.674 8.836 0.000) 9.232 10.423 ( 3.792 -14.107 0.000) 14.608 10.711 ( 9.456 5.300 0.000) 10.840 11.345 ( 5.988 -0.786 0.000) 6.039 11.387 ( 7.212 3.211 0.000) 7.894 11.748 ( 15.274 6.950 0.000) 16.781 11.787 ( 15.380 -0.229 0.000) 15.382 11.991 ( 9.825 17.794 0.000) 20.326 12.015 ( 20.010 13.634 0.000) 24.213 12.100 ( 2.233 2.638 0.000) 3.456 12.130 ( -5.018 29.047 0.000) 29.477 12.204 ( 7.001 0.696 0.000) 7.036 12.248 ( 13.819 0.983 0.000) 13.854 12.266 ( 6.686 -13.116 0.000) 14.722 12.433 ( 3.398 10.704 0.000) 11.230 12.555 ( -7.619 -1.102 0.000) 7.698 12.581 ( -11.921 -13.796 0.000) 18.233 12.773 ( -1.481 13.558 0.000) 13.639 12.931 ( 2.607 9.879 0.000) 10.218 13.300 ( 2.098 16.791 0.000) 16.922 13.541 ( 4.064 10.046 0.000) 10.837 13.787 ( -1.974 3.218 0.000) 3.775 13.887 ( 3.465 4.030 0.000) 5.315 14.198 ( 15.012 -9.708 0.000) 17.877 14.517 ( -3.266 -4.200 0.000) 5.321 14.550 ( -14.711 -2.562 0.000) 14.932 15.126 ( -11.902 4.834 0.000) 12.846 15.212 ( 9.208 -11.061 0.000) 14.392 15.259 ( 9.917 -9.404 0.000) 13.667 15.370 ( -14.796 -1.788 0.000) 14.904 15.766 ( -17.908 2.741 0.000) 18.116 15.776 ( 7.422 -11.474 0.000) 13.665 16.205 ( -19.542 14.324 0.000) 24.230 16.460 ( -20.711 -18.770 0.000) 27.951 16.637 ( -3.788 -21.337 0.000) 21.671 17.174 ( 16.506 -3.397 0.000) 16.852 17.226 ( 0.315 -0.445 0.000) 0.545 17.374 ( -2.961 -8.063 0.000) 8.589 17.728 ( 2.572 -7.325 0.000) 7.763 17.962 ( -5.974 0.411 0.000) 5.988 17.983 ( -0.612 1.906 0.000) 2.002 18.141 ( -4.895 -12.465 0.000) 13.391 18.264 ( -2.627 -3.879 0.000) 4.684 18.353 ( -13.716 -0.735 0.000) 13.735 18.663 ( 3.639 -14.848 0.000) 15.287 19.116 ( -15.057 14.894 0.000) 21.179 19.399 ( 3.061 11.024 0.000) 11.441 19.746 ( -0.014 -8.977 0.000) 8.977 20.094 ( -0.417 -11.259 0.000) 11.267 20.219 ( -3.641 -1.318 0.000) 3.873 20.540 ( 7.801 -7.407 0.000) 10.757 20.580 ( 9.580 -10.196 0.000) 13.990 20.698 ( -5.169 6.107 0.000) 8.001 21.167 ( -1.462 9.609 0.000) 9.719 21.200 ( -0.973 9.973 0.000) 10.021 21.398 ( -5.826 9.895 0.000) 11.483 22.146 ( 21.029 4.303 0.000) 21.465 22.714 ( -18.874 35.303 0.000) 40.031 22.827 ( -10.910 -0.758 0.000) 10.937 24.609 ( -25.792 -0.324 0.000) 25.794 26.149 ( 10.226 1.231 0.000) 10.300 26.227 ( 6.918 4.743 0.000) 8.388 26.752 ( 15.515 -7.265 0.000) 17.132 27.845 ( 8.916 -30.229 0.000) 31.516 ======================= Grid point 21 (14/100) ======================= q-point: ( 0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.494 ( 33.196 52.838 0.000) 62.400 4.644 ( 50.564 27.517 0.000) 57.566 6.500 ( -32.236 34.182 0.000) 46.985 6.691 ( 65.563 31.252 0.000) 72.631 6.953 ( 2.795 -4.306 0.000) 5.133 7.346 ( 12.001 0.851 0.000) 12.031 7.362 ( -4.840 -2.370 0.000) 5.389 7.479 ( 1.142 -7.682 0.000) 7.767 7.544 ( -14.282 -1.555 0.000) 14.366 8.023 ( -2.510 18.318 0.000) 18.490 8.198 ( 2.606 17.993 0.000) 18.181 8.558 ( 1.539 6.916 0.000) 7.085 8.649 ( 7.955 -1.786 0.000) 8.153 8.912 ( -4.129 8.655 0.000) 9.589 9.245 ( 5.225 -8.783 0.000) 10.219 9.375 ( -12.428 10.450 0.000) 16.238 9.673 ( 4.605 -6.404 0.000) 7.887 9.943 ( 2.577 0.621 0.000) 2.651 10.142 ( -1.686 15.646 0.000) 15.737 10.342 ( 6.180 5.776 0.000) 8.459 10.351 ( 11.827 -2.605 0.000) 12.110 10.644 ( 14.967 -17.822 0.000) 23.273 11.065 ( 24.188 -5.476 0.000) 24.800 11.407 ( -33.301 1.628 0.000) 33.341 11.472 ( 3.637 0.972 0.000) 3.765 11.507 ( -5.894 -1.692 0.000) 6.132 11.779 ( -11.204 -0.946 0.000) 11.244 11.996 ( -5.844 -7.986 0.000) 9.896 12.160 ( 8.663 12.044 0.000) 14.836 12.194 ( -7.316 -7.531 0.000) 10.499 12.293 ( 17.604 13.474 0.000) 22.169 12.294 ( 6.673 -3.367 0.000) 7.474 12.420 ( 5.710 -16.037 0.000) 17.023 12.510 ( 13.451 1.475 0.000) 13.532 12.530 ( 12.685 4.422 0.000) 13.434 12.688 ( 24.974 8.476 0.000) 26.373 12.831 ( 6.111 8.937 0.000) 10.827 12.903 ( 23.575 6.395 0.000) 24.427 13.082 ( 13.707 12.172 0.000) 18.331 13.372 ( 3.118 13.519 0.000) 13.874 13.567 ( -1.846 9.149 0.000) 9.334 13.720 ( -5.122 2.987 0.000) 5.929 13.827 ( -4.919 8.277 0.000) 9.628 14.226 ( -15.908 4.904 0.000) 16.647 14.483 ( 5.569 -10.524 0.000) 11.907 14.570 ( 12.779 -1.528 0.000) 12.870 14.691 ( -31.807 -1.936 0.000) 31.866 15.102 ( -13.491 -12.761 0.000) 18.570 15.134 ( -7.972 0.195 0.000) 7.974 15.444 ( -14.756 -2.916 0.000) 15.041 15.621 ( 20.336 -7.533 0.000) 21.686 15.793 ( -21.573 15.795 0.000) 26.738 15.858 ( -24.827 -17.746 0.000) 30.517 16.080 ( 13.224 -7.306 0.000) 15.108 16.534 ( -6.594 -23.743 0.000) 24.642 17.156 ( -10.912 -5.255 0.000) 12.111 17.303 ( -0.577 -5.116 0.000) 5.149 17.603 ( 18.233 -0.363 0.000) 18.236 17.609 ( -18.498 -9.212 0.000) 20.665 17.854 ( 4.969 6.174 0.000) 7.925 17.995 ( 2.043 1.760 0.000) 2.697 18.070 ( 0.408 1.908 0.000) 1.951 18.220 ( -0.668 -3.028 0.000) 3.101 18.305 ( 3.060 0.398 0.000) 3.085 18.681 ( -3.232 -10.565 0.000) 11.049 18.842 ( -12.613 14.405 0.000) 19.146 19.528 ( 10.715 12.392 0.000) 16.381 19.762 ( 1.340 -6.381 0.000) 6.521 20.038 ( -4.582 -5.130 0.000) 6.878 20.170 ( -1.000 5.214 0.000) 5.309 20.593 ( -1.554 4.818 0.000) 5.063 20.720 ( 6.147 -2.299 0.000) 6.563 20.727 ( 5.131 -4.549 0.000) 6.857 21.026 ( -14.054 10.235 0.000) 17.386 21.127 ( -4.971 13.808 0.000) 14.675 21.274 ( -5.954 11.307 0.000) 12.779 22.454 ( -7.003 17.526 0.000) 18.874 22.610 ( 11.325 -3.811 0.000) 11.949 22.643 ( 6.399 -5.416 0.000) 8.383 24.131 ( -23.941 -5.516 0.000) 24.568 26.334 ( 7.965 0.254 0.000) 7.969 26.360 ( 6.108 3.156 0.000) 6.876 27.083 ( 17.650 -10.013 0.000) 20.293 27.874 ( -4.606 -24.907 0.000) 25.329 ======================= Grid point 22 (15/100) ======================= q-point: ( 0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.147 ( 34.093 48.225 0.000) 59.059 5.644 ( 48.846 16.558 0.000) 51.576 5.834 ( -33.056 39.748 0.000) 51.697 6.579 ( -40.627 4.118 0.000) 40.835 7.155 ( 4.464 -4.898 0.000) 6.627 7.258 ( -5.598 -4.657 0.000) 7.282 7.385 ( 2.306 4.243 0.000) 4.830 7.452 ( -3.262 -3.513 0.000) 4.794 8.053 ( 4.187 21.107 0.000) 21.518 8.094 ( 9.819 25.541 0.000) 27.363 8.436 ( 50.562 15.790 0.000) 52.970 8.704 ( 9.941 1.776 0.000) 10.098 8.820 ( 9.004 8.371 0.000) 12.295 8.824 ( -5.123 12.989 0.000) 13.962 9.031 ( -13.322 5.495 0.000) 14.410 9.269 ( -16.987 0.017 0.000) 16.987 9.807 ( 10.050 -9.742 0.000) 13.997 9.992 ( 0.139 8.145 0.000) 8.146 10.124 ( -0.063 14.764 0.000) 14.764 10.410 ( -37.725 8.272 0.000) 38.622 10.478 ( 6.705 2.326 0.000) 7.097 10.531 ( -1.102 -6.419 0.000) 6.513 10.981 ( 15.226 -8.552 0.000) 17.463 11.255 ( -9.164 1.165 0.000) 9.238 11.608 ( 3.745 -8.137 0.000) 8.957 11.631 ( -1.601 -9.191 0.000) 9.330 11.755 ( 22.158 -13.548 0.000) 25.972 11.874 ( -2.794 -8.132 0.000) 8.599 12.030 ( -3.908 -10.942 0.000) 11.618 12.257 ( -11.695 -15.593 0.000) 19.491 12.338 ( 6.306 4.678 0.000) 7.852 12.418 ( -1.854 -3.511 0.000) 3.970 12.604 ( 12.637 9.560 0.000) 15.846 12.776 ( 4.461 12.688 0.000) 13.449 12.833 ( 12.827 -4.975 0.000) 13.758 12.875 ( 0.647 -5.960 0.000) 5.995 13.133 ( 14.583 9.063 0.000) 17.169 13.185 ( 3.116 3.340 0.000) 4.568 13.384 ( 12.850 7.640 0.000) 14.950 13.528 ( 5.794 14.711 0.000) 15.811 13.535 ( 6.431 4.016 0.000) 7.582 13.617 ( 4.090 -1.047 0.000) 4.222 13.783 ( -0.994 9.629 0.000) 9.680 13.978 ( -24.155 -0.658 0.000) 24.164 14.109 ( -8.076 15.192 0.000) 17.205 14.320 ( -19.698 9.952 0.000) 22.069 14.869 ( 14.576 -10.501 0.000) 17.965 14.938 ( 0.977 -4.620 0.000) 4.722 15.017 ( -5.023 0.432 0.000) 5.041 15.149 ( -15.017 -5.775 0.000) 16.089 15.435 ( -12.153 -10.890 0.000) 16.318 15.442 ( -11.688 4.190 0.000) 12.417 16.047 ( 21.145 -9.912 0.000) 23.353 16.370 ( -11.158 -19.859 0.000) 22.779 16.400 ( 16.373 -14.100 0.000) 21.608 16.780 ( -22.850 -12.535 0.000) 26.062 17.301 ( 1.495 -0.489 0.000) 1.573 17.379 ( -6.547 0.258 0.000) 6.553 17.850 ( 5.800 3.486 0.000) 6.767 17.900 ( -0.438 1.657 0.000) 1.714 18.072 ( 4.315 2.410 0.000) 4.942 18.101 ( 0.996 6.034 0.000) 6.115 18.289 ( 9.091 -4.061 0.000) 9.957 18.412 ( 6.382 7.912 0.000) 10.166 18.541 ( -9.231 -8.940 0.000) 12.851 18.621 ( -10.180 9.763 0.000) 14.105 19.773 ( 9.185 2.270 0.000) 9.462 19.794 ( 1.869 -7.084 0.000) 7.327 19.982 ( 3.264 13.828 0.000) 14.208 20.142 ( -4.692 20.394 0.000) 20.926 20.577 ( 0.392 4.471 0.000) 4.488 20.694 ( -13.455 3.989 0.000) 14.034 20.797 ( 0.706 0.273 0.000) 0.757 20.800 ( 1.298 -2.451 0.000) 2.773 21.079 ( 1.410 13.027 0.000) 13.103 21.161 ( -5.668 11.856 0.000) 13.141 22.415 ( 1.770 1.884 0.000) 2.585 22.490 ( -5.480 -3.571 0.000) 6.541 23.148 ( 26.505 -9.204 0.000) 28.057 23.654 ( -25.038 -8.513 0.000) 26.445 26.443 ( 2.949 0.427 0.000) 2.979 26.447 ( 2.395 1.552 0.000) 2.854 27.420 ( 16.333 -13.988 0.000) 21.504 27.703 ( -12.131 -19.046 0.000) 22.581 ======================= Grid point 27 (16/100) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.917 ( 0.000 51.093 0.000) 51.093 4.035 ( 0.000 65.442 0.000) 65.442 5.736 ( 0.000 -17.111 0.000) 17.111 6.118 ( 0.000 60.655 0.000) 60.655 7.149 ( 0.000 0.439 0.000) 0.439 7.205 ( 0.000 5.568 0.000) 5.568 7.348 ( 0.000 -25.664 0.000) 25.664 7.420 ( 0.000 11.611 0.000) 11.611 7.578 ( 0.000 -12.798 0.000) 12.798 7.719 ( 0.000 1.463 0.000) 1.463 7.931 ( 0.000 -10.890 0.000) 10.890 8.329 ( 0.000 17.348 0.000) 17.348 8.913 ( 0.000 -11.288 0.000) 11.288 8.940 ( 0.000 -7.989 0.000) 7.989 9.270 ( 0.000 -16.147 0.000) 16.147 9.545 ( 0.000 13.513 0.000) 13.513 9.738 ( 0.000 0.515 0.000) 0.515 10.052 ( 0.000 8.718 0.000) 8.718 10.077 ( 0.000 -3.491 0.000) 3.491 10.088 ( 0.000 7.283 0.000) 7.283 10.216 ( 0.000 -7.072 0.000) 7.072 11.039 ( 0.000 37.461 0.000) 37.461 11.065 ( 0.000 4.088 0.000) 4.088 11.199 ( 0.000 -3.981 0.000) 3.981 11.250 ( 0.000 -48.240 0.000) 48.240 11.385 ( 0.000 9.217 0.000) 9.217 11.506 ( 0.000 19.975 0.000) 19.975 11.662 ( 0.000 11.728 0.000) 11.728 11.819 ( 0.000 7.878 0.000) 7.878 11.823 ( 0.000 21.502 0.000) 21.502 11.955 ( 0.000 7.318 0.000) 7.318 12.258 ( 0.000 18.751 0.000) 18.751 12.384 ( 0.000 -13.801 0.000) 13.801 12.539 ( 0.000 21.276 0.000) 21.276 12.758 ( 0.000 6.028 0.000) 6.028 12.760 ( 0.000 -15.400 0.000) 15.400 12.852 ( 0.000 11.677 0.000) 11.677 13.140 ( 0.000 -2.157 0.000) 2.157 13.150 ( 0.000 2.743 0.000) 2.743 13.458 ( 0.000 36.440 0.000) 36.440 13.505 ( 0.000 14.679 0.000) 14.679 13.790 ( 0.000 8.700 0.000) 8.700 13.875 ( 0.000 4.815 0.000) 4.815 14.085 ( 0.000 19.079 0.000) 19.079 14.465 ( 0.000 -0.200 0.000) 0.200 14.591 ( 0.000 -28.903 0.000) 28.903 14.772 ( 0.000 -11.815 0.000) 11.815 14.989 ( 0.000 -21.871 0.000) 21.871 15.440 ( 0.000 15.517 0.000) 15.517 15.588 ( 0.000 -6.365 0.000) 6.365 15.758 ( 0.000 -14.071 0.000) 14.071 15.836 ( 0.000 -6.567 0.000) 6.567 16.229 ( 0.000 9.339 0.000) 9.339 16.427 ( 0.000 -10.200 0.000) 10.200 16.762 ( 0.000 8.067 0.000) 8.067 16.844 ( 0.000 -1.380 0.000) 1.380 17.299 ( 0.000 0.672 0.000) 0.672 17.522 ( 0.000 -5.327 0.000) 5.327 17.659 ( 0.000 -26.521 0.000) 26.521 17.881 ( 0.000 -22.302 0.000) 22.302 17.983 ( 0.000 0.028 0.000) 0.028 17.999 ( 0.000 -6.860 0.000) 6.860 18.035 ( 0.000 0.783 0.000) 0.783 18.054 ( 0.000 0.082 0.000) 0.082 18.982 ( 0.000 -15.176 0.000) 15.176 19.282 ( 0.000 -24.141 0.000) 24.141 19.447 ( 0.000 -4.687 0.000) 4.687 19.635 ( 0.000 10.976 0.000) 10.976 19.647 ( 0.000 -8.625 0.000) 8.625 20.066 ( 0.000 0.710 0.000) 0.710 20.245 ( 0.000 -6.580 0.000) 6.580 20.327 ( 0.000 -4.025 0.000) 4.025 20.900 ( 0.000 1.221 0.000) 1.221 21.029 ( 0.000 -2.013 0.000) 2.013 21.363 ( 0.000 10.613 0.000) 10.613 21.604 ( 0.000 2.791 0.000) 2.791 22.304 ( 0.000 23.717 0.000) 23.717 23.098 ( 0.000 -3.175 0.000) 3.175 23.984 ( 0.000 31.907 0.000) 31.907 25.476 ( 0.000 -17.204 0.000) 17.204 25.969 ( 0.000 4.618 0.000) 4.618 26.220 ( 0.000 8.846 0.000) 8.846 26.295 ( 0.000 -5.889 0.000) 5.889 26.799 ( 0.000 -8.625 0.000) 8.625 ======================= Grid point 28 (17/100) ======================= q-point: ( 0.11 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.456 ( 48.346 41.763 0.000) 63.887 4.189 ( 15.503 60.635 0.000) 62.586 5.935 ( 19.091 -9.013 0.000) 21.112 6.275 ( 16.169 53.073 0.000) 55.481 7.153 ( -2.660 -11.990 0.000) 12.282 7.176 ( 3.024 -0.551 0.000) 3.074 7.397 ( -1.964 11.239 0.000) 11.409 7.423 ( 3.145 -3.882 0.000) 4.996 7.607 ( 1.999 -11.086 0.000) 11.265 7.855 ( 13.303 1.342 0.000) 13.370 8.062 ( 12.428 -8.849 0.000) 15.257 8.443 ( 11.929 14.616 0.000) 18.866 8.687 ( -18.603 0.941 0.000) 18.627 8.937 ( 3.393 -9.311 0.000) 9.910 9.359 ( 7.975 -17.743 0.000) 19.453 9.554 ( -19.948 2.483 0.000) 20.102 9.685 ( 8.391 6.781 0.000) 10.788 9.953 ( -9.363 4.450 0.000) 10.367 10.002 ( 4.263 3.991 0.000) 5.840 10.137 ( 5.399 8.844 0.000) 10.362 10.408 ( 8.760 -3.879 0.000) 9.580 10.777 ( -24.832 9.270 0.000) 26.506 10.988 ( -3.842 31.723 0.000) 31.955 11.211 ( 6.847 -4.558 0.000) 8.225 11.275 ( 2.374 -45.657 0.000) 45.719 11.478 ( 5.136 0.582 0.000) 5.168 11.531 ( 2.234 12.127 0.000) 12.331 11.716 ( 4.579 10.091 0.000) 11.082 11.910 ( 10.221 7.412 0.000) 12.626 12.046 ( 15.591 17.779 0.000) 23.647 12.066 ( 11.086 6.164 0.000) 12.684 12.236 ( -9.848 -10.475 0.000) 14.378 12.325 ( 6.693 19.608 0.000) 20.719 12.567 ( -12.831 -9.930 0.000) 16.225 12.611 ( 4.025 19.709 0.000) 20.115 12.719 ( -4.305 3.866 0.000) 5.786 12.910 ( 3.932 7.863 0.000) 8.791 13.062 ( -11.074 15.752 0.000) 19.255 13.242 ( 0.902 16.924 0.000) 16.948 13.468 ( 9.956 9.496 0.000) 13.759 13.708 ( 15.875 2.453 0.000) 16.064 13.725 ( -4.317 13.757 0.000) 14.419 13.887 ( 0.054 4.561 0.000) 4.561 14.035 ( -0.375 11.021 0.000) 11.028 14.526 ( -6.392 -16.754 0.000) 17.932 14.704 ( -6.298 -8.433 0.000) 10.525 14.753 ( 20.046 1.675 0.000) 20.116 14.888 ( -5.621 -21.234 0.000) 21.966 15.428 ( -2.495 13.600 0.000) 13.827 15.458 ( -0.511 -9.713 0.000) 9.726 15.595 ( -20.016 -7.510 0.000) 21.378 16.092 ( -13.975 -3.737 0.000) 14.466 16.106 ( 17.780 -15.295 0.000) 23.453 16.406 ( -5.832 -8.661 0.000) 10.441 16.723 ( -4.917 11.417 0.000) 12.431 16.893 ( 5.276 -2.098 0.000) 5.678 17.187 ( -4.857 -3.314 0.000) 5.880 17.412 ( -17.642 -16.948 0.000) 24.464 17.582 ( 4.489 0.930 0.000) 4.584 17.945 ( 0.150 -12.264 0.000) 12.265 18.005 ( 1.704 0.370 0.000) 1.744 18.007 ( -0.723 0.265 0.000) 0.770 18.093 ( 12.180 -15.335 0.000) 19.584 18.153 ( 3.870 -4.524 0.000) 5.953 18.691 ( -18.543 -7.598 0.000) 20.039 19.449 ( -0.811 -0.595 0.000) 1.006 19.537 ( 14.766 -20.460 0.000) 25.231 19.634 ( -1.930 -4.579 0.000) 4.969 19.639 ( 0.963 7.396 0.000) 7.458 20.118 ( 5.980 -3.300 0.000) 6.830 20.270 ( 2.784 -7.351 0.000) 7.860 20.301 ( -1.709 -4.667 0.000) 4.970 20.872 ( -2.326 3.229 0.000) 3.980 21.102 ( 6.878 -3.582 0.000) 7.755 21.369 ( 0.291 10.049 0.000) 10.054 21.592 ( -1.647 3.204 0.000) 3.603 22.297 ( -0.353 21.298 0.000) 21.301 23.011 ( -8.414 -2.751 0.000) 8.852 23.815 ( -16.705 32.257 0.000) 36.326 25.124 ( -28.786 -9.562 0.000) 30.332 26.035 ( 6.365 4.184 0.000) 7.617 26.257 ( 3.903 8.962 0.000) 9.775 26.378 ( 8.137 -6.588 0.000) 10.470 27.036 ( 17.125 -18.142 0.000) 24.948 ======================= Grid point 29 (18/100) ======================= q-point: ( 0.22 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.499 ( 51.706 32.979 0.000) 61.328 4.624 ( 28.319 48.813 0.000) 56.433 6.398 ( 24.130 -14.075 0.000) 27.935 6.760 ( 34.879 55.325 0.000) 65.401 7.121 ( -1.256 -17.921 0.000) 17.965 7.271 ( 4.525 -2.299 0.000) 5.076 7.380 ( 3.015 8.686 0.000) 9.194 7.401 ( -5.587 3.454 0.000) 6.568 7.556 ( -9.023 1.084 0.000) 9.087 8.187 ( 18.573 3.076 0.000) 18.826 8.351 ( 14.666 -3.939 0.000) 15.185 8.388 ( -7.358 9.674 0.000) 12.154 8.810 ( 22.031 8.809 0.000) 23.727 9.050 ( 7.080 0.662 0.000) 7.111 9.116 ( -20.246 11.979 0.000) 23.524 9.539 ( 9.371 -18.984 0.000) 21.171 9.727 ( -12.277 2.983 0.000) 12.635 9.776 ( 1.459 -0.536 0.000) 1.554 10.198 ( 13.226 2.798 0.000) 13.518 10.283 ( -18.639 13.572 0.000) 23.057 10.327 ( 9.549 3.899 0.000) 10.315 10.493 ( 1.102 7.197 0.000) 7.281 10.930 ( -1.746 20.647 0.000) 20.720 11.332 ( 4.232 -1.360 0.000) 4.445 11.343 ( 4.453 -38.999 0.000) 39.252 11.577 ( 2.401 -4.938 0.000) 5.491 11.657 ( 12.833 -11.927 0.000) 17.520 11.830 ( 6.309 -0.203 0.000) 6.313 12.008 ( -11.329 -10.957 0.000) 15.761 12.099 ( -0.065 -7.251 0.000) 7.252 12.237 ( -0.669 8.370 0.000) 8.397 12.364 ( 19.532 8.307 0.000) 21.225 12.434 ( -14.037 6.074 0.000) 15.295 12.471 ( 10.050 6.284 0.000) 11.852 12.616 ( 8.361 27.903 0.000) 29.129 12.711 ( 9.530 6.884 0.000) 11.756 12.773 ( -14.418 25.372 0.000) 29.182 12.985 ( 3.753 8.196 0.000) 9.014 13.241 ( 0.506 15.483 0.000) 15.491 13.678 ( 6.686 2.795 0.000) 7.247 13.691 ( 0.972 19.999 0.000) 20.023 13.864 ( -2.200 3.847 0.000) 4.432 13.996 ( 9.331 -10.616 0.000) 14.134 14.078 ( 3.208 8.848 0.000) 9.412 14.422 ( 3.579 -2.554 0.000) 4.397 14.539 ( -10.625 -0.559 0.000) 10.640 14.857 ( 0.426 -19.900 0.000) 19.904 15.113 ( 15.793 -3.640 0.000) 16.207 15.181 ( -21.661 -13.899 0.000) 25.737 15.269 ( -14.469 5.765 0.000) 15.575 15.586 ( 11.535 -7.636 0.000) 13.833 15.730 ( -19.318 -4.573 0.000) 19.852 16.125 ( -17.530 -16.116 0.000) 23.813 16.244 ( -8.882 -16.398 0.000) 18.649 16.500 ( -17.673 13.844 0.000) 22.449 17.113 ( 15.776 -3.041 0.000) 16.067 17.147 ( -2.948 -6.176 0.000) 6.843 17.224 ( 2.687 -6.979 0.000) 7.478 17.608 ( -4.167 -6.439 0.000) 7.670 17.997 ( 5.668 1.829 0.000) 5.956 18.000 ( 0.108 0.262 0.000) 0.283 18.028 ( 2.624 2.159 0.000) 3.398 18.174 ( -1.075 -4.864 0.000) 4.982 18.318 ( 5.700 -10.226 0.000) 11.708 18.416 ( -4.711 1.180 0.000) 4.857 19.337 ( -10.616 8.474 0.000) 13.583 19.630 ( 1.791 -3.497 0.000) 3.929 19.659 ( 2.850 12.894 0.000) 13.205 19.773 ( 7.794 -20.341 0.000) 21.783 20.196 ( 1.123 -0.782 0.000) 1.368 20.370 ( 7.505 -9.500 0.000) 12.107 20.394 ( 11.909 -8.355 0.000) 14.548 20.833 ( -1.062 7.469 0.000) 7.544 21.255 ( 6.883 -3.063 0.000) 7.534 21.352 ( -2.913 8.524 0.000) 9.008 21.524 ( -5.390 3.557 0.000) 6.458 22.322 ( 4.345 12.055 0.000) 12.814 22.799 ( -12.175 -2.346 0.000) 12.399 23.381 ( -25.845 31.067 0.000) 40.412 24.536 ( -29.679 -7.418 0.000) 30.592 26.194 ( 9.183 3.479 0.000) 9.820 26.357 ( 5.743 8.583 0.000) 10.327 26.593 ( 13.160 -8.489 0.000) 15.661 27.305 ( 9.105 -24.269 0.000) 25.921 ======================= Grid point 30 (19/100) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.267 ( 36.466 34.614 0.000) 50.278 5.353 ( 35.906 34.461 0.000) 49.767 6.724 ( 9.132 -12.958 0.000) 15.852 6.986 ( -18.040 6.260 0.000) 19.095 7.237 ( -5.496 -5.626 0.000) 7.865 7.245 ( -6.389 2.030 0.000) 6.704 7.380 ( -6.084 -1.515 0.000) 6.269 7.406 ( 5.085 -6.871 0.000) 8.548 7.786 ( 54.347 54.880 0.000) 77.236 8.382 ( 4.709 16.735 0.000) 17.385 8.457 ( 7.524 2.110 0.000) 7.815 8.566 ( 9.545 11.021 0.000) 14.580 8.982 ( 7.334 17.858 0.000) 19.305 9.131 ( 4.969 12.634 0.000) 13.576 9.209 ( 9.540 6.701 0.000) 11.659 9.527 ( -6.409 -5.675 0.000) 8.561 9.529 ( -12.474 3.148 0.000) 12.865 9.907 ( 10.875 -5.719 0.000) 12.287 10.042 ( 3.870 -17.474 0.000) 17.897 10.335 ( -1.956 3.320 0.000) 3.853 10.608 ( 10.283 18.968 0.000) 21.576 10.649 ( 18.793 10.983 0.000) 21.767 10.950 ( 6.604 -3.017 0.000) 7.261 11.386 ( -1.086 -2.159 0.000) 2.416 11.435 ( 4.870 -20.653 0.000) 21.220 11.610 ( -36.574 10.061 0.000) 37.933 11.611 ( -1.480 -13.276 0.000) 13.358 11.805 ( -6.696 -10.217 0.000) 12.215 11.878 ( -0.886 -14.961 0.000) 14.987 11.958 ( -0.596 -21.799 0.000) 21.807 11.989 ( -6.232 -12.367 0.000) 13.849 12.372 ( 0.728 5.321 0.000) 5.370 12.625 ( 2.667 18.168 0.000) 18.363 12.710 ( 3.427 9.925 0.000) 10.500 12.753 ( 15.433 13.913 0.000) 20.779 12.860 ( 23.784 7.605 0.000) 24.971 13.007 ( 7.811 4.403 0.000) 8.967 13.072 ( 11.729 14.910 0.000) 18.970 13.302 ( 7.029 8.648 0.000) 11.145 13.662 ( -5.883 0.051 0.000) 5.883 13.680 ( -4.328 10.848 0.000) 11.679 13.833 ( -0.145 12.370 0.000) 12.371 14.022 ( -0.877 5.551 0.000) 5.620 14.255 ( 11.774 -9.222 0.000) 14.956 14.314 ( -11.515 2.768 0.000) 11.843 14.661 ( 14.994 7.121 0.000) 16.598 14.667 ( -28.233 -2.139 0.000) 28.314 14.821 ( -4.411 -10.267 0.000) 11.174 15.028 ( -7.847 -13.122 0.000) 15.289 15.398 ( -15.770 1.177 0.000) 15.814 15.417 ( 11.790 -11.158 0.000) 16.233 15.602 ( -15.261 -8.941 0.000) 17.687 15.881 ( 7.088 -11.763 0.000) 13.733 16.031 ( -19.504 -6.533 0.000) 20.569 16.119 ( -13.480 -0.964 0.000) 13.514 16.938 ( -18.749 -14.625 0.000) 23.778 17.252 ( 5.336 0.283 0.000) 5.344 17.506 ( -3.854 1.024 0.000) 3.988 17.585 ( 22.509 -2.769 0.000) 22.679 17.999 ( -1.284 6.057 0.000) 6.192 18.016 ( 1.658 0.674 0.000) 1.790 18.143 ( -1.270 -4.307 0.000) 4.491 18.213 ( 7.366 -0.074 0.000) 7.366 18.269 ( -0.907 -2.175 0.000) 2.357 18.527 ( 6.630 4.893 0.000) 8.240 19.097 ( -12.782 11.914 0.000) 17.474 19.650 ( -0.208 -5.732 0.000) 5.735 19.709 ( 0.477 -1.837 0.000) 1.898 19.938 ( 12.690 1.516 0.000) 12.780 20.289 ( 9.311 6.469 0.000) 11.338 20.541 ( 9.092 -7.989 0.000) 12.103 20.627 ( 9.865 -5.315 0.000) 11.206 20.836 ( 0.637 11.479 0.000) 11.496 21.205 ( -13.321 7.931 0.000) 15.503 21.307 ( -1.580 3.597 0.000) 3.929 21.408 ( -5.294 2.675 0.000) 5.931 22.522 ( 16.413 -3.444 0.000) 16.770 22.573 ( -10.036 -2.590 0.000) 10.364 22.879 ( -23.442 23.735 0.000) 33.360 23.973 ( -27.952 -10.601 0.000) 29.895 26.368 ( 7.914 3.422 0.000) 8.622 26.462 ( 4.477 7.437 0.000) 8.680 26.867 ( 14.172 -11.381 0.000) 18.176 27.389 ( -0.160 -23.334 0.000) 23.335 ======================= Grid point 31 (20/100) ======================= q-point: ( 0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.971 ( 28.790 32.966 0.000) 43.768 6.011 ( 38.199 20.435 0.000) 43.321 6.514 ( -26.832 25.437 0.000) 36.973 6.663 ( -22.477 3.381 0.000) 22.730 7.076 ( -1.875 -2.324 0.000) 2.986 7.148 ( -5.432 -5.768 0.000) 7.923 7.333 ( 0.661 -7.722 0.000) 7.750 7.367 ( -2.622 -5.203 0.000) 5.826 8.511 ( 7.275 22.130 0.000) 23.295 8.606 ( 0.722 16.758 0.000) 16.773 8.724 ( 15.650 12.920 0.000) 20.294 8.908 ( 40.737 28.758 0.000) 49.865 9.063 ( -15.637 11.312 0.000) 19.300 9.178 ( 11.977 20.329 0.000) 23.595 9.182 ( -4.476 5.072 0.000) 6.764 9.371 ( -3.729 13.953 0.000) 14.442 9.584 ( 18.491 -7.134 0.000) 19.819 10.046 ( 3.210 -6.801 0.000) 7.521 10.254 ( -4.829 -4.209 0.000) 6.406 10.297 ( 4.445 -8.344 0.000) 9.454 10.638 ( -6.160 16.225 0.000) 17.355 10.644 ( -38.281 14.903 0.000) 41.080 11.027 ( 18.420 8.521 0.000) 20.295 11.214 ( 11.198 -13.049 0.000) 17.195 11.427 ( -10.230 -6.020 0.000) 11.870 11.443 ( -1.897 -8.219 0.000) 8.435 11.588 ( 9.867 -4.409 0.000) 10.807 11.698 ( -1.971 -8.996 0.000) 9.210 11.799 ( -6.184 -12.100 0.000) 13.589 11.882 ( -10.462 -16.999 0.000) 19.961 12.045 ( 11.849 -26.760 0.000) 29.266 12.286 ( -10.005 -14.964 0.000) 18.001 12.763 ( 7.210 7.246 0.000) 10.222 12.797 ( 3.857 2.481 0.000) 4.586 12.938 ( 4.361 9.478 0.000) 10.433 12.999 ( -3.261 6.909 0.000) 7.640 13.273 ( 16.396 4.203 0.000) 16.926 13.354 ( 10.305 12.700 0.000) 16.355 13.496 ( 6.039 2.573 0.000) 6.564 13.557 ( -7.227 -3.268 0.000) 7.931 13.597 ( 5.960 4.546 0.000) 7.496 13.852 ( 3.068 15.283 0.000) 15.587 13.954 ( -23.551 0.115 0.000) 23.551 13.966 ( -5.503 6.748 0.000) 8.708 14.395 ( 0.736 8.363 0.000) 8.395 14.443 ( 2.965 -3.857 0.000) 4.865 14.733 ( 0.789 0.930 0.000) 1.220 14.891 ( -8.778 -11.569 0.000) 14.522 14.908 ( 10.177 4.137 0.000) 10.986 15.111 ( -12.286 4.267 0.000) 13.006 15.322 ( 1.812 -0.531 0.000) 1.888 15.576 ( -21.315 6.311 0.000) 22.230 15.764 ( 11.614 -17.605 0.000) 21.091 15.940 ( -8.057 -19.290 0.000) 20.905 16.098 ( 15.977 -14.478 0.000) 21.561 16.502 ( -23.417 -14.706 0.000) 27.652 17.357 ( 5.094 5.929 0.000) 7.817 17.442 ( -3.504 6.510 0.000) 7.393 17.920 ( 7.727 2.699 0.000) 8.185 17.975 ( -1.147 5.167 0.000) 5.293 18.107 ( 9.921 -2.887 0.000) 10.332 18.147 ( 2.136 -5.982 0.000) 6.351 18.192 ( -2.882 0.255 0.000) 2.893 18.299 ( -4.401 -13.984 0.000) 14.660 18.662 ( 8.428 17.593 0.000) 19.508 18.859 ( -11.325 14.210 0.000) 18.170 19.645 ( 0.491 -8.443 0.000) 8.457 19.678 ( -2.477 -8.782 0.000) 9.125 20.307 ( 23.266 12.728 0.000) 26.520 20.526 ( 12.717 15.683 0.000) 20.191 20.696 ( 5.667 1.210 0.000) 5.794 20.710 ( -4.978 -0.571 0.000) 5.011 20.787 ( -6.702 8.658 0.000) 10.949 20.865 ( -16.440 6.686 0.000) 17.748 21.273 ( 0.433 5.747 0.000) 5.763 21.323 ( -3.669 3.134 0.000) 4.825 22.443 ( -2.161 -0.354 0.000) 2.190 22.527 ( -11.394 10.087 0.000) 15.218 22.932 ( 24.262 -12.302 0.000) 27.203 23.437 ( -26.838 -13.337 0.000) 29.969 26.486 ( 3.938 4.300 0.000) 5.831 26.517 ( 0.810 5.818 0.000) 5.874 27.126 ( 11.833 -15.166 0.000) 19.236 27.314 ( -7.062 -19.496 0.000) 20.735 ======================= Grid point 36 (21/100) ======================= q-point: ( 0.00 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.928 ( 0.000 50.951 0.000) 50.951 4.912 ( 0.000 -47.985 0.000) 47.985 5.292 ( 0.000 61.464 0.000) 61.464 6.445 ( 0.000 -54.573 0.000) 54.573 7.037 ( 0.000 13.974 0.000) 13.974 7.141 ( 0.000 -1.488 0.000) 1.488 7.337 ( 0.000 7.366 0.000) 7.366 7.471 ( 0.000 -5.497 0.000) 5.497 7.745 ( 0.000 1.422 0.000) 1.422 7.787 ( 0.000 -2.890 0.000) 2.890 8.219 ( 0.000 68.084 0.000) 68.084 8.601 ( 0.000 9.925 0.000) 9.925 8.773 ( 0.000 -8.487 0.000) 8.487 8.821 ( 0.000 2.341 0.000) 2.341 8.980 ( 0.000 -12.424 0.000) 12.424 9.506 ( 0.000 -45.043 0.000) 45.043 9.936 ( 0.000 20.280 0.000) 20.280 9.961 ( 0.000 -7.661 0.000) 7.661 9.988 ( 0.000 -4.614 0.000) 4.614 10.167 ( 0.000 -1.863 0.000) 1.863 10.209 ( 0.000 7.609 0.000) 7.609 10.423 ( 0.000 -20.068 0.000) 20.068 11.043 ( 0.000 -2.638 0.000) 2.638 11.074 ( 0.000 -6.169 0.000) 6.169 11.674 ( 0.000 18.303 0.000) 18.303 11.701 ( 0.000 20.067 0.000) 20.067 11.765 ( 0.000 5.893 0.000) 5.893 11.956 ( 0.000 7.265 0.000) 7.265 11.988 ( 0.000 11.033 0.000) 11.033 12.050 ( 0.000 -18.781 0.000) 18.781 12.159 ( 0.000 15.883 0.000) 15.883 12.217 ( 0.000 17.059 0.000) 17.059 12.444 ( 0.000 -3.197 0.000) 3.197 12.488 ( 0.000 -13.105 0.000) 13.105 12.723 ( 0.000 5.690 0.000) 5.690 12.805 ( 0.000 -1.277 0.000) 1.277 13.098 ( 0.000 -2.777 0.000) 2.777 13.106 ( 0.000 -1.437 0.000) 1.437 13.422 ( 0.000 38.749 0.000) 38.749 13.648 ( 0.000 0.193 0.000) 0.193 13.850 ( 0.000 -18.196 0.000) 18.196 13.902 ( 0.000 0.585 0.000) 0.585 13.956 ( 0.000 3.274 0.000) 3.274 14.050 ( 0.000 15.012 0.000) 15.012 14.271 ( 0.000 -35.003 0.000) 35.003 14.391 ( 0.000 -14.766 0.000) 14.766 14.734 ( 0.000 27.706 0.000) 27.706 14.842 ( 0.000 13.253 0.000) 13.253 15.379 ( 0.000 -14.898 0.000) 14.898 15.412 ( 0.000 -19.067 0.000) 19.067 15.797 ( 0.000 18.805 0.000) 18.805 15.897 ( 0.000 10.989 0.000) 10.989 16.201 ( 0.000 -13.450 0.000) 13.450 16.218 ( 0.000 -9.953 0.000) 9.953 16.898 ( 0.000 7.386 0.000) 7.386 16.975 ( 0.000 15.949 0.000) 15.949 17.170 ( 0.000 -20.503 0.000) 20.503 17.350 ( 0.000 -19.227 0.000) 19.227 17.445 ( 0.000 11.651 0.000) 11.651 17.619 ( 0.000 -2.419 0.000) 2.419 17.865 ( 0.000 -2.381 0.000) 2.381 17.954 ( 0.000 -4.566 0.000) 4.566 18.047 ( 0.000 0.281 0.000) 0.281 18.050 ( 0.000 -0.205 0.000) 0.205 18.756 ( 0.000 -5.810 0.000) 5.810 18.840 ( 0.000 -15.524 0.000) 15.524 19.408 ( 0.000 1.355 0.000) 1.355 19.492 ( 0.000 -6.585 0.000) 6.585 19.881 ( 0.000 11.930 0.000) 11.930 20.090 ( 0.000 -9.194 0.000) 9.194 20.135 ( 0.000 4.934 0.000) 4.934 20.236 ( 0.000 -5.061 0.000) 5.061 20.936 ( 0.000 2.240 0.000) 2.240 20.983 ( 0.000 -2.433 0.000) 2.433 21.536 ( 0.000 6.575 0.000) 6.575 21.617 ( 0.000 -1.663 0.000) 1.663 22.707 ( 0.000 16.988 0.000) 16.988 22.972 ( 0.000 -9.783 0.000) 9.783 24.578 ( 0.000 27.938 0.000) 27.938 25.081 ( 0.000 -22.819 0.000) 22.819 26.068 ( 0.000 5.357 0.000) 5.357 26.179 ( 0.000 -5.810 0.000) 5.810 26.410 ( 0.000 10.172 0.000) 10.172 26.612 ( 0.000 -10.065 0.000) 10.065 ======================= Grid point 37 (22/100) ======================= q-point: ( 0.11 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.315 ( 36.176 44.668 0.000) 57.480 5.195 ( 26.783 -43.564 0.000) 51.139 5.366 ( 7.718 57.943 0.000) 58.454 6.446 ( 0.823 -49.998 0.000) 50.005 7.080 ( 4.275 10.233 0.000) 11.090 7.161 ( 1.985 -1.384 0.000) 2.420 7.429 ( 6.693 4.129 0.000) 7.864 7.510 ( 2.702 -3.389 0.000) 4.335 7.879 ( 13.428 2.007 0.000) 13.577 7.929 ( 13.600 -1.781 0.000) 13.716 8.256 ( 4.523 67.691 0.000) 67.842 8.665 ( 6.314 5.634 0.000) 8.462 8.705 ( -4.393 -0.180 0.000) 4.396 8.850 ( 4.866 2.466 0.000) 5.455 9.037 ( 5.218 -14.113 0.000) 15.047 9.419 ( -8.039 -29.955 0.000) 31.015 9.919 ( -4.489 -1.381 0.000) 4.697 9.987 ( 2.839 18.904 0.000) 19.116 10.085 ( 6.901 -27.546 0.000) 28.397 10.197 ( 1.492 10.318 0.000) 10.425 10.229 ( 5.229 -2.688 0.000) 5.879 10.425 ( 0.808 -17.502 0.000) 17.521 10.906 ( -14.187 5.229 0.000) 15.120 11.057 ( 2.001 -9.430 0.000) 9.640 11.601 ( -4.537 12.736 0.000) 13.520 11.649 ( -6.292 25.670 0.000) 26.430 11.776 ( -1.156 8.486 0.000) 8.565 11.922 ( -10.029 -17.792 0.000) 20.424 11.940 ( -4.283 5.470 0.000) 6.947 11.961 ( -0.019 -1.820 0.000) 1.820 12.216 ( 8.573 10.079 0.000) 13.232 12.373 ( 10.332 13.837 0.000) 17.269 12.409 ( -2.203 -7.405 0.000) 7.726 12.531 ( 5.786 0.007 0.000) 5.786 12.774 ( -2.167 1.286 0.000) 2.520 12.779 ( 4.721 0.486 0.000) 4.746 13.203 ( 7.130 5.861 0.000) 9.230 13.326 ( 16.250 -2.512 0.000) 16.443 13.423 ( -0.354 38.744 0.000) 38.745 13.647 ( -1.265 -4.473 0.000) 4.648 13.727 ( -8.568 -4.738 0.000) 9.791 13.906 ( 1.029 2.691 0.000) 2.881 13.958 ( -0.589 2.522 0.000) 2.590 14.044 ( 0.794 5.204 0.000) 5.264 14.252 ( -0.686 -34.358 0.000) 34.364 14.331 ( -3.944 -13.656 0.000) 14.214 14.689 ( 0.751 15.890 0.000) 15.908 14.978 ( 4.845 1.651 0.000) 5.118 15.329 ( 9.399 6.486 0.000) 11.419 15.645 ( -24.650 12.989 0.000) 27.863 15.730 ( 14.553 -22.858 0.000) 27.098 15.754 ( -7.610 18.036 0.000) 19.575 15.935 ( -17.775 -11.805 0.000) 21.338 16.134 ( -9.291 -18.240 0.000) 20.470 16.910 ( 2.452 4.245 0.000) 4.902 17.003 ( -2.908 15.284 0.000) 15.558 17.085 ( -5.457 -13.774 0.000) 14.816 17.183 ( -8.068 -0.099 0.000) 8.068 17.563 ( -0.687 -4.880 0.000) 4.928 17.658 ( 8.134 -13.497 0.000) 15.759 17.969 ( 11.893 4.823 0.000) 12.834 18.027 ( -0.731 1.880 0.000) 2.017 18.039 ( 5.812 -0.179 0.000) 5.815 18.079 ( 1.071 -3.221 0.000) 3.395 18.669 ( -3.221 7.436 0.000) 8.104 19.013 ( 12.166 -25.158 0.000) 27.945 19.459 ( 4.171 2.465 0.000) 4.844 19.539 ( 3.287 -5.047 0.000) 6.023 19.887 ( 0.864 12.199 0.000) 12.229 20.103 ( 1.549 -9.624 0.000) 9.747 20.126 ( 0.582 3.104 0.000) 3.158 20.208 ( -1.964 -4.693 0.000) 5.087 20.944 ( 0.979 3.941 0.000) 4.061 21.024 ( 4.169 -4.132 0.000) 5.870 21.533 ( -0.649 6.231 0.000) 6.265 21.610 ( -1.203 -1.464 0.000) 1.895 22.663 ( -4.332 15.415 0.000) 16.012 22.901 ( -6.978 -8.655 0.000) 11.118 24.393 ( -18.062 26.137 0.000) 31.771 24.839 ( -22.248 -18.821 0.000) 29.141 26.131 ( 6.116 5.468 0.000) 8.204 26.249 ( 6.848 -6.372 0.000) 9.353 26.462 ( 4.858 11.725 0.000) 12.691 26.719 ( 8.816 -14.333 0.000) 16.827 ======================= Grid point 38 (23/100) ======================= q-point: ( 0.22 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.155 ( 44.748 33.824 0.000) 56.093 5.597 ( 15.819 48.705 0.000) 51.210 5.826 ( 33.733 -33.409 0.000) 47.477 6.502 ( 5.134 -41.267 0.000) 41.585 7.188 ( 6.024 2.150 0.000) 6.396 7.220 ( 3.762 -1.861 0.000) 4.198 7.463 ( -4.118 2.933 0.000) 5.056 7.519 ( -3.883 -2.750 0.000) 4.758 8.221 ( 19.461 4.408 0.000) 19.954 8.275 ( 20.482 0.694 0.000) 20.494 8.446 ( 16.466 62.879 0.000) 64.999 8.643 ( 0.952 15.543 0.000) 15.572 8.903 ( 16.242 -5.008 0.000) 16.996 9.085 ( 16.179 1.379 0.000) 16.237 9.173 ( 11.811 -12.541 0.000) 17.227 9.246 ( -7.246 -4.894 0.000) 8.744 9.744 ( -12.060 1.669 0.000) 12.175 9.950 ( -7.574 15.576 0.000) 17.320 10.222 ( -11.502 -9.378 0.000) 14.840 10.223 ( 7.789 -50.882 0.000) 51.475 10.331 ( 9.930 5.597 0.000) 11.398 10.483 ( 5.908 -6.193 0.000) 8.559 10.730 ( 3.017 23.427 0.000) 23.621 11.161 ( 8.191 -18.044 0.000) 19.816 11.466 ( -11.385 25.951 0.000) 28.339 11.543 ( -1.064 3.967 0.000) 4.107 11.707 ( -4.721 7.633 0.000) 8.975 11.734 ( -8.299 -13.549 0.000) 15.889 11.817 ( -7.499 -4.827 0.000) 8.919 11.898 ( -6.715 -10.953 0.000) 12.848 12.410 ( -11.178 7.619 0.000) 13.528 12.504 ( -8.809 -0.661 0.000) 8.833 12.519 ( 21.034 5.781 0.000) 21.814 12.562 ( 16.502 1.738 0.000) 16.593 12.815 ( 7.277 5.727 0.000) 9.260 12.908 ( 7.391 -1.184 0.000) 7.485 13.193 ( -7.394 18.370 0.000) 19.802 13.412 ( 0.155 34.578 0.000) 34.579 13.479 ( -8.231 3.525 0.000) 8.954 13.597 ( 7.011 -7.094 0.000) 9.974 13.761 ( 5.521 -12.399 0.000) 13.573 13.876 ( -6.165 -5.275 0.000) 8.113 13.991 ( 6.175 9.495 0.000) 11.326 14.107 ( 6.619 4.885 0.000) 8.226 14.298 ( 5.502 -24.769 0.000) 25.372 14.333 ( 5.827 -14.529 0.000) 15.654 14.801 ( 9.928 16.182 0.000) 18.985 15.056 ( -32.522 8.856 0.000) 33.707 15.072 ( 6.811 -6.553 0.000) 9.451 15.298 ( -32.480 -8.773 0.000) 33.644 15.533 ( 6.553 6.039 0.000) 8.912 15.725 ( -8.045 7.869 0.000) 11.254 15.797 ( -8.255 -16.825 0.000) 18.740 15.957 ( -9.402 -13.331 0.000) 16.313 16.762 ( -18.415 12.846 0.000) 22.453 17.000 ( -14.261 -10.150 0.000) 17.504 17.070 ( 12.946 -0.542 0.000) 12.957 17.109 ( 10.978 -4.335 0.000) 11.803 17.578 ( 3.341 6.524 0.000) 7.330 17.827 ( 7.834 -15.601 0.000) 17.458 18.018 ( -0.009 1.998 0.000) 1.998 18.081 ( -0.631 -4.209 0.000) 4.256 18.112 ( 2.067 4.732 0.000) 5.164 18.195 ( 6.125 -3.418 0.000) 7.014 18.707 ( 8.352 24.845 0.000) 26.211 19.258 ( 11.582 -28.559 0.000) 30.818 19.477 ( -4.701 5.922 0.000) 7.561 19.570 ( -0.290 -3.466 0.000) 3.478 19.935 ( 4.948 12.831 0.000) 13.752 20.169 ( 5.878 -10.888 0.000) 12.373 20.199 ( 6.283 1.377 0.000) 6.432 20.260 ( 10.229 -4.959 0.000) 11.368 20.988 ( 3.715 8.024 0.000) 8.842 21.142 ( 7.391 -7.314 0.000) 10.398 21.489 ( -4.444 5.129 0.000) 6.786 21.549 ( -5.343 -0.936 0.000) 5.424 22.556 ( -5.735 10.549 0.000) 12.007 22.720 ( -10.654 -6.002 0.000) 12.228 23.923 ( -28.503 23.617 0.000) 37.016 24.310 ( -30.035 -15.523 0.000) 33.809 26.289 ( 9.382 6.028 0.000) 11.152 26.428 ( 10.881 -7.934 0.000) 13.467 26.572 ( 5.618 13.246 0.000) 14.388 26.884 ( 6.951 -18.450 0.000) 19.716 ======================= Grid point 39 (24/100) ======================= q-point: ( 0.33 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.929 ( 32.835 25.478 0.000) 41.561 5.974 ( 22.145 35.959 0.000) 42.230 6.386 ( 21.836 -20.701 0.000) 30.089 6.638 ( 7.966 -29.644 0.000) 30.695 7.244 ( -2.525 0.238 0.000) 2.536 7.282 ( 1.300 -4.067 0.000) 4.270 7.302 ( -11.692 3.997 0.000) 12.357 7.357 ( -10.218 -1.739 0.000) 10.365 8.540 ( 11.648 6.408 0.000) 13.295 8.650 ( 17.645 -2.778 0.000) 17.862 8.736 ( 7.505 20.249 0.000) 21.595 8.989 ( 39.196 53.377 0.000) 66.222 9.138 ( 4.552 -16.766 0.000) 17.373 9.250 ( 7.593 8.426 0.000) 11.342 9.407 ( 21.665 12.344 0.000) 24.935 9.512 ( -9.713 9.651 0.000) 13.692 9.617 ( 21.491 -0.915 0.000) 21.510 9.722 ( -9.322 1.815 0.000) 9.497 9.888 ( -16.941 -5.888 0.000) 17.935 10.353 ( 1.202 -32.627 0.000) 32.649 10.520 ( 13.101 -11.877 0.000) 17.683 10.691 ( 13.408 -14.803 0.000) 19.973 10.945 ( 14.261 18.282 0.000) 23.186 11.236 ( -10.770 23.989 0.000) 26.296 11.298 ( 3.393 -12.223 0.000) 12.685 11.562 ( 1.419 -6.839 0.000) 6.985 11.618 ( -4.524 -1.990 0.000) 4.942 11.618 ( -2.706 -7.724 0.000) 8.184 11.680 ( -5.151 -9.357 0.000) 10.681 11.755 ( -6.906 -7.474 0.000) 10.176 11.927 ( -33.764 16.399 0.000) 37.536 12.259 ( -18.507 -14.505 0.000) 23.514 12.890 ( 10.261 7.843 0.000) 12.915 12.911 ( 2.379 9.562 0.000) 9.854 12.954 ( 18.874 1.225 0.000) 18.913 13.036 ( 3.992 -2.449 0.000) 4.683 13.078 ( 2.288 17.972 0.000) 18.117 13.355 ( -2.069 -6.651 0.000) 6.965 13.455 ( 3.914 21.035 0.000) 21.396 13.645 ( 1.274 3.657 0.000) 3.872 13.726 ( -8.688 -4.509 0.000) 9.789 13.855 ( 3.559 -14.851 0.000) 15.272 14.135 ( 7.058 13.425 0.000) 15.167 14.291 ( 10.376 8.628 0.000) 13.495 14.402 ( -9.037 5.025 0.000) 10.340 14.482 ( -12.539 -13.183 0.000) 18.194 14.502 ( 9.336 -12.116 0.000) 15.296 14.695 ( -24.505 -15.753 0.000) 29.131 15.023 ( 10.455 15.428 0.000) 18.637 15.242 ( 8.091 -7.690 0.000) 11.162 15.498 ( -8.487 0.610 0.000) 8.509 15.525 ( -12.297 10.192 0.000) 15.971 15.645 ( 0.645 -11.519 0.000) 11.537 15.748 ( -12.285 -12.316 0.000) 17.396 16.348 ( -22.869 13.775 0.000) 26.697 16.638 ( -21.416 -15.279 0.000) 26.308 17.318 ( 13.038 6.246 0.000) 14.457 17.472 ( 20.118 -8.070 0.000) 21.676 17.643 ( 2.158 12.140 0.000) 12.330 17.945 ( 3.707 -17.171 0.000) 17.567 18.033 ( 1.494 1.296 0.000) 1.978 18.072 ( 0.314 -2.688 0.000) 2.706 18.114 ( -1.216 5.721 0.000) 5.849 18.218 ( -1.596 -4.503 0.000) 4.778 18.921 ( 10.129 25.918 0.000) 27.827 19.322 ( -9.258 10.789 0.000) 14.217 19.413 ( 3.647 -22.257 0.000) 22.553 19.513 ( -4.515 -8.331 0.000) 9.475 20.125 ( 15.037 11.887 0.000) 19.168 20.351 ( 12.531 -10.777 0.000) 16.528 20.413 ( 14.672 5.895 0.000) 15.812 20.522 ( 13.998 -5.307 0.000) 14.970 21.077 ( 4.283 11.864 0.000) 12.613 21.270 ( 4.076 -6.739 0.000) 7.876 21.336 ( -11.598 5.225 0.000) 12.721 21.409 ( -8.139 -2.091 0.000) 8.404 22.497 ( 1.794 0.642 0.000) 1.905 22.527 ( -7.493 -2.051 0.000) 7.769 23.334 ( -30.148 21.448 0.000) 37.000 23.709 ( -30.647 -16.234 0.000) 34.681 26.474 ( 8.931 7.283 0.000) 11.524 26.649 ( 11.097 -10.268 0.000) 15.119 26.662 ( 3.170 12.893 0.000) 13.277 26.972 ( 1.923 -18.541 0.000) 18.640 ======================= Grid point 40 (25/100) ======================= q-point: ( 0.44 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 164 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.422 ( 21.621 20.101 0.000) 29.521 6.446 ( 20.649 16.312 0.000) 26.315 6.655 ( 3.611 -5.257 0.000) 6.378 6.723 ( -3.795 -6.196 0.000) 7.266 7.089 ( -6.558 2.439 0.000) 6.997 7.097 ( -8.794 4.662 0.000) 9.953 7.189 ( -4.856 -6.264 0.000) 7.926 7.229 ( -5.440 -7.737 0.000) 9.458 8.772 ( 12.600 9.086 0.000) 15.535 8.882 ( 4.640 15.923 0.000) 16.585 8.961 ( 13.796 -6.134 0.000) 15.098 9.125 ( -4.816 -7.546 0.000) 8.952 9.249 ( -6.009 17.771 0.000) 18.759 9.351 ( -16.427 15.083 0.000) 22.301 9.514 ( 7.905 -3.765 0.000) 8.756 9.641 ( -6.959 -6.631 0.000) 9.612 9.851 ( 20.030 9.928 0.000) 22.356 9.878 ( 40.986 39.504 0.000) 56.925 10.174 ( 22.794 -12.219 0.000) 25.862 10.251 ( -7.042 6.576 0.000) 9.635 10.698 ( -6.307 -13.402 0.000) 14.812 10.981 ( 22.919 -31.526 0.000) 38.977 11.040 ( -37.963 21.997 0.000) 43.876 11.186 ( 6.526 13.046 0.000) 14.587 11.202 ( 5.836 9.895 0.000) 11.487 11.320 ( -9.726 -3.227 0.000) 10.248 11.528 ( -2.928 -12.789 0.000) 13.120 11.582 ( 0.832 0.546 0.000) 0.995 11.625 ( -4.556 -12.394 0.000) 13.205 11.639 ( -2.646 -3.748 0.000) 4.588 11.658 ( 0.341 -3.923 0.000) 3.938 11.820 ( -20.856 -26.540 0.000) 33.755 12.925 ( 0.216 8.707 0.000) 8.710 12.930 ( 0.115 8.401 0.000) 8.402 13.047 ( -1.527 -1.073 0.000) 1.866 13.049 ( -1.453 -2.154 0.000) 2.598 13.338 ( 12.273 5.539 0.000) 13.465 13.473 ( 8.740 -5.266 0.000) 10.204 13.508 ( -2.535 2.949 0.000) 3.888 13.561 ( -5.098 0.706 0.000) 5.146 13.734 ( 8.717 9.210 0.000) 12.681 13.936 ( 6.360 -9.491 0.000) 11.425 13.989 ( -17.594 8.696 0.000) 19.626 14.123 ( -10.563 4.233 0.000) 11.380 14.411 ( 2.559 1.083 0.000) 2.778 14.444 ( 3.238 8.229 0.000) 8.843 14.629 ( 5.242 -15.177 0.000) 16.056 14.647 ( 4.058 -9.307 0.000) 10.153 15.112 ( 2.506 10.675 0.000) 10.965 15.272 ( -12.326 10.223 0.000) 16.014 15.308 ( 3.335 -8.017 0.000) 8.683 15.481 ( -13.615 -11.497 0.000) 17.820 15.570 ( 13.767 6.645 0.000) 15.287 15.823 ( 16.287 -14.093 0.000) 21.538 15.914 ( -20.458 12.652 0.000) 24.054 16.206 ( -21.695 -15.339 0.000) 26.570 17.532 ( 8.261 11.705 0.000) 14.326 17.639 ( -2.748 13.317 0.000) 13.597 17.799 ( 12.227 -13.917 0.000) 18.525 17.949 ( -3.568 -17.132 0.000) 17.500 18.059 ( 1.196 3.078 0.000) 3.303 18.085 ( -1.464 5.567 0.000) 5.757 18.118 ( 3.838 -2.096 0.000) 4.374 18.181 ( -2.172 -3.787 0.000) 4.366 19.057 ( 4.709 20.737 0.000) 21.265 19.160 ( -6.703 15.473 0.000) 16.862 19.431 ( -0.446 -16.191 0.000) 16.197 19.441 ( -2.140 -12.465 0.000) 12.647 20.487 ( 19.396 7.194 0.000) 20.687 20.616 ( 12.713 -5.890 0.000) 14.012 20.691 ( 9.200 2.517 0.000) 9.538 20.706 ( 1.774 0.040 0.000) 1.774 21.073 ( -11.611 12.496 0.000) 17.057 21.079 ( -5.170 14.693 0.000) 15.575 21.277 ( -3.432 -7.134 0.000) 7.916 21.282 ( -1.612 -5.106 0.000) 5.354 22.501 ( 6.581 6.414 0.000) 9.190 22.687 ( 17.475 -11.744 0.000) 21.055 22.800 ( -22.892 16.455 0.000) 28.192 23.136 ( -27.113 -16.726 0.000) 31.857 26.619 ( 5.601 9.143 0.000) 10.722 26.685 ( -1.010 11.228 0.000) 11.273 26.842 ( 8.170 -13.160 0.000) 15.490 26.957 ( -3.434 -16.222 0.000) 16.582 ======================= Grid point 81 (26/100) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 75 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.393 ( 0.000 0.000 66.470) 66.470 1.425 ( 0.000 0.000 67.881) 67.881 1.971 ( 0.000 0.000 94.429) 94.429 6.150 ( 0.000 0.000 -35.624) 35.624 6.250 ( 0.000 0.000 -40.058) 40.058 7.040 ( 0.000 0.000 0.490) 0.490 7.091 ( 0.000 0.000 1.554) 1.554 7.354 ( 0.000 0.000 10.944) 10.944 7.486 ( 0.000 0.000 9.744) 9.744 7.583 ( 0.000 0.000 -2.937) 2.937 8.898 ( 0.000 0.000 -18.903) 18.903 9.175 ( 0.000 0.000 15.716) 15.716 9.221 ( 0.000 0.000 -67.266) 67.266 9.256 ( 0.000 0.000 -26.403) 26.403 9.324 ( 0.000 0.000 -29.963) 29.963 9.552 ( 0.000 0.000 5.228) 5.228 9.593 ( 0.000 0.000 6.082) 6.082 9.785 ( 0.000 0.000 2.874) 2.874 9.882 ( 0.000 0.000 2.664) 2.664 9.936 ( 0.000 0.000 8.556) 8.556 9.999 ( 0.000 0.000 -4.510) 4.510 10.088 ( 0.000 0.000 10.949) 10.949 10.691 ( 0.000 0.000 11.056) 11.056 10.898 ( 0.000 0.000 -10.590) 10.590 11.023 ( 0.000 0.000 -17.930) 17.930 11.038 ( 0.000 0.000 -16.517) 16.517 11.150 ( 0.000 0.000 17.348) 17.348 11.241 ( 0.000 0.000 6.041) 6.041 11.252 ( 0.000 0.000 10.257) 10.257 11.449 ( 0.000 0.000 13.660) 13.660 11.692 ( 0.000 0.000 -3.172) 3.172 11.704 ( 0.000 0.000 24.650) 24.650 11.758 ( 0.000 0.000 2.703) 2.703 11.837 ( 0.000 0.000 36.636) 36.636 11.957 ( 0.000 0.000 1.431) 1.431 12.668 ( 0.000 0.000 -7.032) 7.032 13.180 ( 0.000 0.000 -2.107) 2.107 13.193 ( 0.000 0.000 2.532) 2.532 13.410 ( 0.000 0.000 0.961) 0.961 13.433 ( 0.000 0.000 -0.281) 0.281 13.769 ( 0.000 0.000 -0.590) 0.590 13.906 ( 0.000 0.000 33.503) 33.503 14.022 ( 0.000 0.000 4.641) 4.641 14.214 ( 0.000 0.000 -0.170) 0.170 14.256 ( 0.000 0.000 -6.434) 6.434 14.560 ( 0.000 0.000 22.081) 22.081 15.169 ( 0.000 0.000 8.778) 8.778 15.347 ( 0.000 0.000 -1.726) 1.726 15.474 ( 0.000 0.000 1.183) 1.183 15.505 ( 0.000 0.000 -14.726) 14.726 15.649 ( 0.000 0.000 0.797) 0.797 15.827 ( 0.000 0.000 3.596) 3.596 16.470 ( 0.000 0.000 15.239) 15.239 16.718 ( 0.000 0.000 4.318) 4.318 17.156 ( 0.000 0.000 -21.282) 21.282 17.365 ( 0.000 0.000 -18.657) 18.657 17.617 ( 0.000 0.000 -3.887) 3.887 17.756 ( 0.000 0.000 5.254) 5.254 17.785 ( 0.000 0.000 -16.950) 16.950 17.985 ( 0.000 0.000 -6.158) 6.158 18.125 ( 0.000 0.000 0.826) 0.826 18.221 ( 0.000 0.000 2.818) 2.818 18.405 ( 0.000 0.000 -11.790) 11.790 18.528 ( 0.000 0.000 -11.303) 11.303 18.825 ( 0.000 0.000 2.975) 2.975 19.512 ( 0.000 0.000 5.552) 5.552 19.700 ( 0.000 0.000 -16.376) 16.376 20.151 ( 0.000 0.000 -8.209) 8.209 20.314 ( 0.000 0.000 1.085) 1.085 20.430 ( 0.000 0.000 -0.079) 0.079 20.497 ( 0.000 0.000 -1.398) 1.398 20.635 ( 0.000 0.000 5.975) 5.975 20.886 ( 0.000 0.000 -9.722) 9.722 20.920 ( 0.000 0.000 8.667) 8.667 21.069 ( 0.000 0.000 -0.987) 0.987 21.158 ( 0.000 0.000 20.224) 20.224 21.169 ( 0.000 0.000 2.900) 2.900 22.358 ( 0.000 0.000 -4.818) 4.818 23.192 ( 0.000 0.000 12.328) 12.328 23.882 ( 0.000 0.000 -1.863) 1.863 25.990 ( 0.000 0.000 4.768) 4.768 26.476 ( 0.000 0.000 -3.717) 3.717 27.125 ( 0.000 0.000 4.703) 4.703 27.760 ( 0.000 0.000 -5.070) 5.070 ======================= Grid point 82 (27/100) ======================= q-point: ( 0.11 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( 40.522 0.000 39.989) 56.931 1.669 ( 26.005 0.000 54.560) 60.441 3.106 ( 83.528 0.000 68.622) 108.101 6.128 ( -2.817 0.000 -31.937) 32.061 6.361 ( 10.176 0.000 -43.136) 44.320 6.995 ( -4.611 0.000 -0.971) 4.712 7.080 ( -0.726 0.000 -0.697) 1.007 7.457 ( 8.120 0.000 6.422) 10.353 7.485 ( -0.550 0.000 7.185) 7.206 7.671 ( 8.538 0.000 -4.458) 9.632 8.469 ( -29.955 0.000 -5.931) 30.537 8.964 ( -18.119 0.000 -15.760) 24.014 9.188 ( -7.270 0.000 -26.403) 27.386 9.267 ( 0.952 0.000 0.039) 0.952 9.373 ( 6.855 0.000 -44.858) 45.378 9.553 ( -7.839 0.000 -1.616) 8.004 9.654 ( -6.856 0.000 8.883) 11.221 9.799 ( 0.994 0.000 2.028) 2.259 9.880 ( 16.660 0.000 -11.543) 20.268 10.057 ( 0.761 0.000 17.673) 17.690 10.061 ( 11.147 0.000 -2.897) 11.517 10.220 ( 13.871 0.000 6.440) 15.293 10.472 ( -12.156 0.000 -5.498) 13.342 11.049 ( 4.674 0.000 5.729) 7.394 11.149 ( 20.928 0.000 -9.539) 22.999 11.288 ( 10.742 0.000 2.131) 10.951 11.310 ( 18.020 0.000 -5.991) 18.989 11.353 ( 12.177 0.000 15.431) 19.657 11.397 ( 16.153 0.000 -0.017) 16.153 11.581 ( 12.267 0.000 15.523) 19.785 11.707 ( 4.137 0.000 16.162) 16.683 11.750 ( 7.113 0.000 -0.453) 7.128 11.846 ( 7.901 0.000 -0.426) 7.912 11.960 ( 11.479 0.000 33.422) 35.338 11.983 ( 3.012 0.000 2.210) 3.736 12.717 ( 4.932 0.000 -7.442) 8.928 12.962 ( -14.121 0.000 7.752) 16.109 13.189 ( -1.983 0.000 1.831) 2.699 13.285 ( -7.478 0.000 8.374) 11.227 13.317 ( -6.747 0.000 2.617) 7.237 13.547 ( -30.669 0.000 18.823) 35.985 13.763 ( -0.345 0.000 -0.171) 0.385 14.138 ( 5.953 0.000 3.099) 6.711 14.237 ( -3.729 0.000 2.364) 4.415 14.623 ( 25.403 0.000 -11.023) 27.692 14.635 ( 7.633 0.000 10.875) 13.287 15.189 ( -2.160 0.000 8.383) 8.657 15.276 ( -3.216 0.000 3.540) 4.782 15.341 ( -11.061 0.000 -2.555) 11.352 15.421 ( -5.028 0.000 2.147) 5.467 15.622 ( -2.582 0.000 1.010) 2.772 15.877 ( 4.280 0.000 -6.534) 7.811 16.364 ( -13.865 0.000 5.573) 14.944 17.039 ( 16.446 0.000 -8.661) 18.587 17.085 ( -7.697 0.000 -22.057) 23.362 17.189 ( -5.013 0.000 -11.292) 12.355 17.600 ( -2.962 0.000 -5.877) 6.581 17.689 ( -6.324 0.000 6.507) 9.074 17.877 ( 3.132 0.000 -8.935) 9.468 17.927 ( -5.311 0.000 -4.708) 7.097 18.136 ( 0.820 0.000 0.401) 0.913 18.219 ( -0.296 0.000 2.442) 2.460 18.411 ( 0.259 0.000 -8.589) 8.593 18.469 ( -6.880 0.000 -4.716) 8.341 18.638 ( -13.865 0.000 -5.976) 15.098 19.169 ( -18.283 0.000 18.911) 26.304 19.581 ( -14.336 0.000 -16.208) 21.639 20.201 ( 1.379 0.000 -16.146) 16.205 20.305 ( -1.064 0.000 0.869) 1.374 20.397 ( -2.767 0.000 1.603) 3.198 20.417 ( -6.093 0.000 0.461) 6.110 20.660 ( -10.829 0.000 1.543) 10.938 20.697 ( 4.389 0.000 3.657) 5.713 21.014 ( -0.686 0.000 12.900) 12.918 21.042 ( -2.598 0.000 -0.792) 2.716 21.166 ( 7.965 0.000 3.624) 8.751 21.591 ( 28.505 0.000 5.211) 28.978 21.895 ( -19.638 0.000 19.239) 27.491 23.119 ( -6.480 0.000 11.833) 13.491 24.229 ( 13.118 0.000 -24.202) 27.529 26.051 ( 6.104 0.000 5.403) 8.152 26.433 ( -6.347 0.000 14.673) 15.987 26.702 ( 0.060 0.000 14.163) 14.163 28.408 ( 20.714 0.000 -31.785) 37.939 ======================= Grid point 83 (28/100) ======================= q-point: ( 0.22 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.315 ( 38.160 0.000 37.318) 53.374 2.712 ( 61.601 0.000 7.677) 62.078 4.857 ( 91.966 0.000 50.833) 105.079 5.991 ( -13.188 0.000 -18.546) 22.757 6.583 ( 11.016 0.000 -49.709) 50.915 6.880 ( -5.860 0.000 -8.882) 10.641 7.076 ( 0.588 0.000 -5.228) 5.261 7.434 ( -5.466 0.000 -0.274) 5.473 7.535 ( -1.778 0.000 -10.552) 10.701 7.817 ( -2.317 0.000 -11.924) 12.147 7.927 ( -22.913 0.000 -4.278) 23.309 8.645 ( -7.732 0.000 8.827) 11.735 9.093 ( -2.606 0.000 -14.272) 14.508 9.212 ( -6.854 0.000 -5.099) 8.542 9.240 ( -14.983 0.000 2.052) 15.123 9.542 ( 10.247 0.000 -21.806) 24.094 9.651 ( 2.044 0.000 11.274) 11.458 9.804 ( 0.626 0.000 2.565) 2.640 10.039 ( -8.590 0.000 -3.142) 9.147 10.076 ( -0.175 0.000 23.747) 23.747 10.227 ( 15.138 0.000 -2.289) 15.310 10.579 ( 28.879 0.000 -27.712) 40.025 10.669 ( 24.569 0.000 1.946) 24.646 11.194 ( 9.373 0.000 2.594) 9.726 11.416 ( 7.708 0.000 5.597) 9.525 11.523 ( 14.518 0.000 -0.087) 14.519 11.606 ( 13.962 0.000 21.623) 25.739 11.785 ( 25.504 0.000 -3.783) 25.783 11.826 ( 12.774 0.000 22.676) 26.026 11.872 ( 24.456 0.000 -6.772) 25.376 11.881 ( 9.710 0.000 2.243) 9.966 11.939 ( 2.565 0.000 -1.974) 3.236 12.079 ( 27.598 0.000 -8.573) 28.899 12.168 ( 16.691 0.000 1.090) 16.727 12.239 ( 14.477 0.000 28.152) 31.656 12.676 ( -20.936 0.000 17.379) 27.209 12.848 ( 7.256 0.000 -7.963) 10.773 12.855 ( -30.955 0.000 5.876) 31.508 13.044 ( -8.749 0.000 3.568) 9.449 13.139 ( -6.969 0.000 9.691) 11.936 13.278 ( 0.894 0.000 1.698) 1.918 13.756 ( -0.739 0.000 1.913) 2.050 14.091 ( -10.606 0.000 10.015) 14.587 14.203 ( -0.918 0.000 -10.948) 10.986 14.782 ( 3.952 0.000 -5.515) 6.785 14.968 ( -11.173 0.000 -5.300) 12.366 15.064 ( 6.306 0.000 -3.280) 7.108 15.164 ( -2.953 0.000 15.034) 15.321 15.313 ( -4.394 0.000 5.500) 7.040 15.337 ( 7.057 0.000 -0.494) 7.075 15.565 ( -2.401 0.000 2.497) 3.464 15.782 ( -19.327 0.000 -8.310) 21.037 16.055 ( -7.376 0.000 0.437) 7.389 16.829 ( -18.728 0.000 -19.780) 27.239 17.087 ( -2.417 0.000 1.338) 2.763 17.305 ( 5.850 0.000 -4.218) 7.212 17.545 ( -7.386 0.000 6.890) 10.101 17.586 ( 1.368 0.000 -14.785) 14.848 17.792 ( -8.256 0.000 -3.370) 8.917 17.875 ( -0.277 0.000 5.154) 5.161 18.151 ( 0.637 0.000 0.535) 0.832 18.193 ( -16.155 0.000 -3.449) 16.519 18.209 ( -0.668 0.000 1.963) 2.073 18.374 ( -3.508 0.000 -5.393) 6.434 18.488 ( -6.441 0.000 -6.618) 9.234 18.923 ( -8.293 0.000 1.691) 8.463 19.303 ( -11.222 0.000 -12.214) 16.587 20.130 ( -8.940 0.000 -15.890) 18.232 20.269 ( -2.697 0.000 0.307) 2.714 20.296 ( -5.729 0.000 0.773) 5.781 20.328 ( -3.860 0.000 2.107) 4.398 20.511 ( -4.370 0.000 0.320) 4.382 20.777 ( 3.553 0.000 2.248) 4.205 20.945 ( -5.001 0.000 11.552) 12.588 20.981 ( -3.200 0.000 -0.281) 3.213 21.226 ( -4.602 0.000 17.524) 18.118 21.839 ( 11.447 0.000 2.908) 11.811 22.170 ( 29.165 0.000 -0.044) 29.165 22.972 ( -7.460 0.000 11.268) 13.514 24.276 ( -5.857 0.000 -19.394) 20.259 26.213 ( 9.820 0.000 6.714) 11.896 26.433 ( 5.416 0.000 21.192) 21.873 26.902 ( 15.759 0.000 -0.211) 15.761 28.533 ( -3.551 0.000 -20.676) 20.979 ======================= Grid point 84 (29/100) ======================= q-point: ( 0.33 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.117 ( 42.996 0.000 25.038) 49.755 3.943 ( 62.999 0.000 -5.172) 63.211 5.551 ( -31.455 0.000 -1.195) 31.478 6.595 ( 79.035 0.000 36.645) 87.117 6.745 ( 3.723 0.000 -49.764) 49.903 6.826 ( 1.025 0.000 -17.965) 17.994 7.107 ( 2.307 0.000 -9.806) 10.074 7.274 ( -9.238 0.000 -7.042) 11.616 7.325 ( -25.971 0.000 -16.271) 30.647 7.503 ( -9.567 0.000 -27.092) 28.732 7.597 ( -12.397 0.000 -8.486) 15.023 8.757 ( 11.193 0.000 21.583) 24.312 8.986 ( -8.236 0.000 3.146) 8.817 9.060 ( -1.370 0.000 -2.292) 2.670 9.091 ( -7.043 0.000 -4.826) 8.538 9.710 ( -0.033 0.000 -8.510) 8.510 9.717 ( 4.651 0.000 17.705) 18.306 9.801 ( 3.446 0.000 4.931) 6.016 10.024 ( 8.898 0.000 -0.155) 8.899 10.037 ( -3.621 0.000 26.952) 27.195 10.464 ( 8.267 0.000 2.862) 8.748 11.091 ( 13.144 0.000 -2.766) 13.432 11.260 ( 26.565 0.000 -7.309) 27.553 11.456 ( 15.510 0.000 -18.575) 24.199 11.581 ( 8.638 0.000 0.329) 8.645 11.738 ( -20.620 0.000 14.142) 25.003 11.748 ( 10.007 0.000 4.647) 11.033 11.867 ( 11.057 0.000 17.492) 20.693 11.921 ( -2.080 0.000 -0.866) 2.253 12.093 ( 13.714 0.000 20.221) 24.433 12.172 ( 3.509 0.000 7.924) 8.667 12.229 ( 13.865 0.000 -3.227) 14.236 12.342 ( 23.221 0.000 -0.229) 23.222 12.485 ( -3.139 0.000 6.350) 7.083 12.535 ( 17.558 0.000 -1.582) 17.629 12.658 ( 24.340 0.000 -10.706) 26.590 12.666 ( 2.783 0.000 10.206) 10.579 12.933 ( 9.926 0.000 -0.798) 9.958 13.091 ( 11.586 0.000 -5.608) 12.872 13.095 ( 6.884 0.000 15.373) 16.844 13.287 ( -0.633 0.000 -0.900) 1.101 13.710 ( -4.924 0.000 3.886) 6.272 13.861 ( -11.177 0.000 11.752) 16.218 13.996 ( -22.106 0.000 -15.580) 27.044 14.570 ( -29.875 0.000 -18.854) 35.327 14.716 ( -8.312 0.000 -15.230) 17.351 14.884 ( -11.420 0.000 16.732) 20.258 15.108 ( -9.671 0.000 -1.494) 9.786 15.258 ( -4.203 0.000 -2.443) 4.861 15.320 ( -21.533 0.000 -0.637) 21.543 15.581 ( 5.054 0.000 9.353) 10.631 15.710 ( 21.899 0.000 1.685) 21.964 16.146 ( 17.748 0.000 7.314) 19.196 16.381 ( -25.172 0.000 -8.846) 26.681 17.008 ( -6.551 0.000 -0.476) 6.569 17.350 ( -4.205 0.000 -0.837) 4.287 17.425 ( -4.548 0.000 3.374) 5.663 17.577 ( 1.431 0.000 -3.235) 3.537 17.614 ( -9.474 0.000 -2.653) 9.838 17.908 ( -0.680 0.000 -4.886) 4.933 18.003 ( 0.528 0.000 -7.182) 7.202 18.161 ( 0.498 0.000 0.885) 1.015 18.195 ( -0.728 0.000 1.661) 1.814 18.270 ( -13.064 0.000 -5.376) 14.127 18.342 ( -0.932 0.000 -1.908) 2.123 18.768 ( -8.835 0.000 -10.366) 13.620 19.188 ( -0.400 0.000 -5.395) 5.410 19.875 ( -16.077 0.000 -11.944) 20.029 20.194 ( -3.815 0.000 0.215) 3.821 20.214 ( -3.352 0.000 -0.064) 3.352 20.271 ( -1.397 0.000 -0.182) 1.409 20.453 ( -3.038 0.000 0.497) 3.078 20.835 ( 2.359 0.000 1.440) 2.764 20.853 ( -3.031 0.000 11.643) 12.031 20.928 ( -2.118 0.000 0.274) 2.135 21.093 ( -7.161 0.000 16.530) 18.014 22.137 ( 15.864 0.000 -1.379) 15.923 22.636 ( 10.939 0.000 -5.755) 12.360 22.916 ( 8.942 0.000 10.744) 13.978 24.066 ( -14.656 0.000 -12.881) 19.512 26.408 ( 9.418 0.000 8.371) 12.601 26.555 ( 5.490 0.000 17.284) 18.135 27.264 ( 20.429 0.000 -3.941) 20.806 28.362 ( -12.816 0.000 -13.392) 18.537 ======================= Grid point 85 (30/100) ======================= q-point: ( 0.44 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.975 ( 44.162 0.000 16.297) 47.073 4.821 ( -41.479 0.000 8.797) 42.401 5.149 ( 59.628 0.000 -12.715) 60.969 6.240 ( -49.768 0.000 -21.684) 54.287 6.906 ( 6.431 0.000 -16.564) 17.768 7.051 ( 5.876 0.000 -38.867) 39.309 7.054 ( -8.035 0.000 -11.410) 13.955 7.204 ( -7.822 0.000 -32.596) 33.521 7.231 ( 5.619 0.000 -13.405) 14.535 7.386 ( -9.546 0.000 -13.737) 16.728 8.295 ( 66.882 0.000 27.499) 72.315 8.896 ( 0.869 0.000 20.773) 20.792 8.910 ( 0.016 0.000 1.447) 1.447 8.966 ( -5.166 0.000 -2.447) 5.716 9.046 ( 2.274 0.000 2.956) 3.730 9.471 ( -26.401 0.000 1.417) 26.439 9.825 ( 6.084 0.000 23.846) 24.610 9.935 ( 9.240 0.000 9.260) 13.081 9.943 ( -5.725 0.000 27.146) 27.743 10.198 ( -6.859 0.000 6.253) 9.282 10.507 ( 0.429 0.000 6.015) 6.031 10.695 ( -19.161 0.000 5.240) 19.864 11.493 ( 6.383 0.000 3.271) 7.172 11.571 ( 2.155 0.000 6.563) 6.908 11.733 ( 6.647 0.000 -2.762) 7.198 11.838 ( -3.797 0.000 -3.114) 4.910 11.977 ( 11.120 0.000 7.313) 13.309 12.009 ( 11.049 0.000 -1.838) 11.201 12.151 ( -3.398 0.000 -1.949) 3.917 12.203 ( -10.369 0.000 3.009) 10.796 12.289 ( 25.638 0.000 -1.898) 25.708 12.554 ( 10.274 0.000 5.583) 11.693 12.597 ( 1.663 0.000 12.199) 12.311 12.629 ( 32.963 0.000 2.078) 33.029 12.769 ( 19.024 0.000 -0.555) 19.032 12.858 ( 13.442 0.000 -0.699) 13.460 12.984 ( 5.592 0.000 -9.537) 11.055 13.159 ( -8.622 0.000 -3.871) 9.451 13.186 ( -17.165 0.000 -1.248) 17.211 13.249 ( 17.473 0.000 2.685) 17.678 13.347 ( 6.463 0.000 -4.862) 8.088 13.473 ( -28.708 0.000 -19.686) 34.809 13.569 ( -5.839 0.000 3.852) 6.995 13.689 ( -9.982 0.000 8.890) 13.367 14.051 ( -1.280 0.000 3.467) 3.696 14.509 ( -30.260 0.000 11.546) 32.388 14.680 ( 10.624 0.000 -21.412) 23.902 14.992 ( -3.109 0.000 1.285) 3.364 14.998 ( -4.648 0.000 2.235) 5.157 15.042 ( -18.622 0.000 -18.450) 26.214 15.729 ( 8.976 0.000 13.277) 16.026 15.954 ( -16.044 0.000 7.908) 17.887 16.178 ( 23.820 0.000 0.610) 23.827 16.502 ( 2.892 0.000 -1.188) 3.126 16.858 ( 3.053 0.000 7.710) 8.292 17.155 ( -14.927 0.000 5.931) 16.062 17.380 ( 0.358 0.000 -0.107) 0.374 17.449 ( -6.567 0.000 -1.910) 6.839 17.689 ( 8.579 0.000 -3.486) 9.260 17.876 ( -6.092 0.000 -8.436) 10.406 18.022 ( -4.221 0.000 -10.686) 11.489 18.041 ( -1.339 0.000 -6.275) 6.417 18.171 ( 0.503 0.000 1.188) 1.290 18.182 ( -0.613 0.000 1.430) 1.556 18.407 ( 6.811 0.000 -6.290) 9.271 18.578 ( -9.918 0.000 -9.536) 13.759 19.281 ( 9.592 0.000 -3.468) 10.200 19.545 ( -16.430 0.000 -7.364) 18.005 20.147 ( -0.875 0.000 -0.148) 0.888 20.159 ( -1.984 0.000 -0.308) 2.007 20.284 ( 2.693 0.000 0.136) 2.697 20.367 ( -5.175 0.000 0.880) 5.249 20.861 ( 3.516 0.000 11.572) 12.094 20.871 ( 1.450 0.000 0.968) 1.743 20.896 ( -1.273 0.000 0.654) 1.431 20.962 ( -6.173 0.000 12.737) 14.154 22.410 ( 11.747 0.000 -1.120) 11.801 22.597 ( -7.356 0.000 -0.425) 7.368 23.307 ( 22.830 0.000 -1.443) 22.875 23.726 ( -19.685 0.000 -7.366) 21.018 26.559 ( 5.597 0.000 10.612) 11.998 26.614 ( 0.159 0.000 13.552) 13.553 27.673 ( 20.761 0.000 -6.326) 21.704 28.056 ( -17.975 0.000 -9.168) 20.178 ======================= Grid point 90 (31/100) ======================= q-point: ( 0.00 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.582 ( 0.000 38.955 38.008) 54.425 1.698 ( 0.000 25.747 55.756) 61.413 3.104 ( 0.000 82.151 69.143) 107.375 6.238 ( 0.000 -1.496 -37.818) 37.848 6.288 ( 0.000 10.915 -41.885) 43.284 7.143 ( 0.000 10.708 2.032) 10.899 7.172 ( 0.000 5.375 0.789) 5.433 7.301 ( 0.000 -5.271 9.568) 10.924 7.439 ( 0.000 -1.384 1.914) 2.362 7.659 ( 0.000 4.625 2.595) 5.303 8.697 ( 0.000 -21.803 -16.096) 27.101 8.932 ( 0.000 -14.442 -4.500) 15.127 9.180 ( 0.000 -4.213 -18.142) 18.625 9.262 ( 0.000 -12.076 -3.295) 12.517 9.304 ( 0.000 -2.007 -24.870) 24.950 9.542 ( 0.000 18.298 -32.758) 37.522 9.679 ( 0.000 -14.580 -6.682) 16.039 9.683 ( 0.000 7.512 -5.683) 9.420 9.934 ( 0.000 -3.823 -1.739) 4.200 9.956 ( 0.000 2.753 3.935) 4.802 10.010 ( 0.000 12.541 14.336) 19.047 10.381 ( 0.000 11.377 6.041) 12.881 10.455 ( 0.000 -14.020 -9.873) 17.147 10.950 ( 0.000 4.018 13.236) 13.832 11.193 ( 0.000 13.823 -1.207) 13.876 11.230 ( 0.000 12.653 -1.584) 12.752 11.331 ( 0.000 11.516 3.299) 11.979 11.373 ( 0.000 20.690 -7.142) 21.888 11.452 ( 0.000 2.543 19.362) 19.528 11.497 ( 0.000 22.475 2.525) 22.617 11.711 ( 0.000 3.914 21.835) 22.183 11.770 ( 0.000 6.811 -5.385) 8.682 11.866 ( 0.000 7.670 20.228) 21.633 11.991 ( 0.000 17.268 11.644) 20.827 12.142 ( 0.000 17.648 2.048) 17.766 12.659 ( 0.000 -0.119 -5.766) 5.767 13.015 ( 0.000 -8.011 5.701) 9.832 13.254 ( 0.000 -1.202 0.499) 1.302 13.282 ( 0.000 -12.095 3.441) 12.575 13.396 ( 0.000 -4.460 0.731) 4.520 13.724 ( 0.000 -11.965 2.833) 12.296 13.762 ( 0.000 -6.877 14.553) 16.096 13.813 ( 0.000 -10.009 7.126) 12.286 13.937 ( 0.000 -0.365 30.216) 30.218 14.579 ( 0.000 1.126 13.089) 13.138 14.608 ( 0.000 7.039 -21.459) 22.584 15.202 ( 0.000 2.286 6.874) 7.244 15.312 ( 0.000 -2.455 -3.997) 4.691 15.391 ( 0.000 -11.426 -14.359) 18.350 15.659 ( 0.000 12.996 -0.977) 13.033 15.714 ( 0.000 6.307 1.077) 6.399 15.917 ( 0.000 5.970 8.236) 10.172 16.357 ( 0.000 -18.704 13.006) 22.782 16.477 ( 0.000 1.280 9.675) 9.759 16.924 ( 0.000 -19.527 -18.027) 26.576 17.309 ( 0.000 -5.412 -18.392) 19.172 17.416 ( 0.000 -20.017 3.799) 20.375 17.825 ( 0.000 -2.105 -7.427) 7.720 17.844 ( 0.000 8.859 -9.536) 13.016 17.964 ( 0.000 -1.398 -4.681) 4.885 18.106 ( 0.000 -0.219 0.059) 0.227 18.156 ( 0.000 -4.650 2.455) 5.258 18.463 ( 0.000 -3.088 -13.541) 13.888 18.492 ( 0.000 -6.366 -2.844) 6.972 18.895 ( 0.000 7.349 -3.973) 8.354 19.570 ( 0.000 5.560 6.542) 8.585 19.580 ( 0.000 -13.217 -8.296) 15.605 20.035 ( 0.000 -10.031 4.396) 10.952 20.303 ( 0.000 -17.479 -1.422) 17.536 20.344 ( 0.000 3.020 -9.291) 9.769 20.440 ( 0.000 0.924 0.722) 1.172 20.604 ( 0.000 -22.820 -2.225) 22.928 20.615 ( 0.000 1.986 -5.867) 6.194 21.013 ( 0.000 4.332 3.295) 5.443 21.050 ( 0.000 2.382 -0.191) 2.389 21.289 ( 0.000 5.232 -5.598) 7.662 21.475 ( 0.000 24.996 19.282) 31.569 22.666 ( 0.000 26.529 -4.984) 26.993 23.216 ( 0.000 2.148 12.188) 12.376 24.378 ( 0.000 31.067 -35.382) 47.085 26.020 ( 0.000 3.094 4.569) 5.518 26.455 ( 0.000 -2.090 -2.912) 3.585 27.088 ( 0.000 -3.691 4.274) 5.647 27.259 ( 0.000 -32.650 26.412) 41.995 ======================= Grid point 91 (32/100) ======================= q-point: ( 0.11 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( 37.143 35.906 16.039) 54.093 2.409 ( 40.356 38.618 39.754) 68.559 3.623 ( 55.037 54.281 65.893) 101.574 6.162 ( -2.708 -0.155 -44.191) 44.274 6.484 ( 12.936 13.207 -33.748) 38.479 7.102 ( -4.234 10.671 1.207) 11.544 7.166 ( -0.262 6.819 -0.996) 6.896 7.400 ( 7.801 -4.604 5.253) 10.471 7.503 ( 5.692 -0.245 5.793) 8.125 7.696 ( 3.768 3.113 -2.493) 5.487 8.446 ( -23.555 -4.298 -10.223) 26.035 8.813 ( -10.481 -17.955 -0.872) 20.809 9.048 ( -6.865 -1.814 -19.875) 21.105 9.192 ( -2.812 -16.406 -15.779) 22.936 9.283 ( 1.123 -0.725 -18.017) 18.067 9.454 ( -12.925 -6.688 -5.281) 15.482 9.695 ( -4.011 4.044 -1.333) 5.850 9.870 ( 5.777 5.137 -3.143) 8.345 9.907 ( 15.822 1.264 -3.829) 16.327 10.052 ( 3.223 6.272 -4.686) 8.467 10.214 ( 12.948 7.422 13.213) 19.933 10.312 ( -1.505 -1.050 -9.982) 10.149 10.507 ( 5.461 5.329 1.445) 7.766 10.987 ( 3.949 -5.353 19.299) 20.413 11.234 ( 4.207 15.232 -16.869) 23.115 11.298 ( 8.233 1.202 2.568) 8.707 11.334 ( 10.417 8.509 2.007) 13.599 11.413 ( 6.347 7.458 6.964) 12.017 11.633 ( 6.062 13.861 8.718) 17.461 11.738 ( 18.741 11.924 13.400) 25.941 11.806 ( 14.500 11.413 5.516) 19.260 11.845 ( 8.951 6.892 -0.590) 11.313 11.956 ( 8.777 9.940 14.411) 19.583 12.083 ( 3.795 14.523 5.405) 15.954 12.177 ( 6.924 16.742 9.830) 20.613 12.714 ( 4.797 0.520 -5.020) 6.963 12.895 ( -8.245 -3.722 6.200) 10.967 13.088 ( -11.365 -11.093 2.305) 16.048 13.290 ( -6.153 -3.128 8.183) 10.706 13.341 ( 1.929 3.736 2.437) 4.860 13.540 ( -25.722 -1.925 16.482) 30.610 13.759 ( 1.534 -0.579 -0.188) 1.650 13.947 ( 6.333 -10.672 12.627) 17.704 14.154 ( 18.607 -10.915 5.358) 22.227 14.470 ( -3.518 -2.399 -0.090) 4.260 14.694 ( 4.859 -2.951 -8.305) 10.064 15.199 ( -3.359 1.381 6.346) 7.312 15.262 ( -1.100 -0.897 1.824) 2.311 15.320 ( -7.084 -3.310 -5.291) 9.441 15.562 ( -6.385 6.223 3.349) 9.524 15.673 ( -1.885 7.173 -3.709) 8.292 15.943 ( 1.736 4.274 1.346) 4.806 16.346 ( -13.654 -1.349 1.188) 13.772 16.652 ( 12.011 -20.978 -8.231) 25.536 16.932 ( 4.591 -15.272 -9.193) 18.408 17.161 ( -2.756 -2.723 -7.541) 8.478 17.463 ( -2.605 -18.927 5.035) 19.757 17.704 ( -11.510 5.654 -4.282) 13.520 17.854 ( -1.093 -4.226 -6.707) 8.002 17.948 ( -0.997 0.560 -4.051) 4.210 18.116 ( -1.011 -3.905 0.668) 4.089 18.157 ( 1.720 -0.590 0.004) 1.818 18.425 ( -7.171 -4.911 -0.619) 8.714 18.506 ( 4.010 -1.703 -15.162) 15.775 18.741 ( -12.933 8.785 -9.061) 18.070 19.312 ( -20.210 9.594 11.238) 25.035 19.381 ( -14.741 -13.812 -7.825) 21.664 20.069 ( 0.884 -10.627 3.257) 11.150 20.242 ( -4.391 -7.271 -5.133) 9.925 20.395 ( -2.752 -0.745 2.283) 3.652 20.456 ( 5.589 2.165 -9.149) 10.937 20.632 ( 0.946 -2.756 -2.757) 4.011 20.644 ( 1.190 -10.724 -4.334) 11.627 20.893 ( -4.525 1.428 5.007) 6.899 21.145 ( 3.484 7.070 2.705) 8.333 21.322 ( 1.744 8.267 4.039) 9.365 21.667 ( 20.188 10.497 9.572) 24.686 22.353 ( -20.951 35.890 5.612) 41.935 23.139 ( -7.132 1.794 11.860) 13.955 24.417 ( -0.218 14.883 -29.523) 33.063 26.077 ( 5.613 2.645 5.121) 8.045 26.419 ( -5.911 -1.374 14.882) 16.072 26.659 ( 1.187 -4.197 13.070) 13.779 28.012 ( 28.044 -30.528 -13.603) 43.629 ======================= Grid point 92 (33/100) ======================= q-point: ( 0.22 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.724 ( 49.382 33.026 3.748) 59.526 3.156 ( 41.145 42.380 25.586) 64.371 5.063 ( 84.024 22.376 50.185) 100.395 6.106 ( -5.197 5.483 -36.506) 37.280 6.639 ( -1.376 13.371 -23.864) 27.389 7.038 ( 1.001 11.790 -11.095) 16.221 7.178 ( 1.872 8.288 -7.097) 11.071 7.488 ( -2.276 3.516 0.474) 4.215 7.541 ( -1.867 1.765 -6.728) 7.202 7.794 ( -0.294 -1.577 -11.529) 11.640 7.990 ( -19.098 4.927 -5.949) 20.601 8.593 ( -7.354 -5.844 4.201) 10.290 8.925 ( -4.221 -11.517 -7.675) 14.470 9.066 ( -9.032 -10.685 -3.446) 14.409 9.308 ( -2.845 -1.345 -12.280) 12.677 9.418 ( 10.849 -8.456 -4.586) 14.500 9.582 ( -6.253 3.831 6.630) 9.886 9.899 ( -2.130 1.167 4.186) 4.839 10.072 ( 5.482 4.042 0.481) 6.828 10.174 ( 2.821 -1.004 4.130) 5.102 10.224 ( 3.659 5.028 3.028) 6.917 10.706 ( 29.401 8.259 -21.234) 37.196 10.739 ( 18.874 11.181 -0.958) 21.958 11.112 ( 9.110 -10.003 16.408) 21.267 11.365 ( 7.883 -3.398 4.403) 9.648 11.514 ( 9.630 -0.421 8.151) 12.623 11.584 ( 17.608 -5.338 -13.127) 22.602 11.715 ( 18.228 8.479 -0.586) 20.112 11.758 ( 8.407 4.761 10.237) 14.076 12.057 ( 0.095 8.143 1.143) 8.223 12.075 ( 16.102 11.939 1.034) 20.071 12.116 ( 15.377 15.651 3.515) 22.220 12.193 ( 17.024 4.481 1.763) 17.692 12.245 ( 20.059 9.672 9.029) 24.030 12.408 ( 13.716 12.050 16.639) 24.702 12.711 ( -6.342 2.218 6.196) 9.139 12.736 ( -20.137 0.326 10.971) 22.934 12.863 ( -10.592 -12.375 3.971) 16.766 13.013 ( -8.525 9.612 -0.432) 12.855 13.172 ( -5.155 -1.160 10.401) 11.667 13.380 ( 1.775 7.560 1.341) 7.880 13.774 ( -0.009 1.683 2.914) 3.365 14.055 ( -1.621 -4.045 11.558) 12.352 14.184 ( -5.332 -1.478 -8.338) 10.007 14.530 ( 1.193 -15.174 -8.148) 17.264 14.846 ( 7.273 -15.169 9.337) 19.240 15.099 ( -11.240 3.181 0.481) 11.692 15.153 ( -1.570 2.309 -7.685) 8.177 15.304 ( 3.758 -2.116 2.377) 4.925 15.439 ( -10.892 3.016 -2.156) 11.505 15.567 ( -7.820 1.907 -4.848) 9.397 15.867 ( -10.818 4.947 -5.744) 13.210 16.093 ( -3.252 3.438 9.414) 10.537 16.593 ( -12.969 -17.873 -18.124) 28.568 17.075 ( -4.007 -5.991 0.995) 7.276 17.245 ( 9.242 -5.917 -1.775) 11.116 17.286 ( -5.198 -11.785 0.488) 12.889 17.598 ( 0.372 -5.989 4.104) 7.270 17.769 ( -5.816 -0.644 -4.376) 7.307 17.929 ( -0.867 2.833 0.373) 2.986 18.043 ( -7.172 -6.614 -0.267) 9.760 18.193 ( 0.226 1.100 -1.697) 2.035 18.228 ( -9.034 0.877 -4.709) 10.226 18.472 ( -13.739 -2.143 -5.543) 14.969 18.575 ( 0.428 5.615 -12.474) 13.686 18.942 ( -14.334 2.399 1.459) 14.607 19.178 ( -5.059 -3.751 -6.318) 8.921 20.035 ( -4.591 -6.305 0.232) 7.803 20.135 ( -5.799 -8.000 -4.088) 10.693 20.343 ( -3.030 0.663 4.499) 5.464 20.502 ( -0.150 9.153 -10.734) 14.108 20.563 ( -5.960 4.853 -1.935) 7.926 20.700 ( 3.535 -5.028 -1.201) 6.263 20.830 ( -1.657 -3.712 3.310) 5.242 21.192 ( -0.667 11.720 9.362) 15.015 21.346 ( -1.009 8.616 11.778) 14.627 22.077 ( -3.018 22.672 2.667) 23.027 22.160 ( 25.829 0.656 0.708) 25.847 22.974 ( -8.682 0.250 11.433) 14.358 24.313 ( -9.953 3.078 -19.739) 22.320 26.226 ( 9.104 1.457 6.313) 11.174 26.417 ( 4.980 -1.479 20.170) 20.829 26.861 ( 15.320 -4.051 -0.156) 15.847 28.278 ( 2.243 -22.821 -15.217) 27.521 ======================= Grid point 93 (34/100) ======================= q-point: ( 0.33 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.597 ( 40.802 42.170 15.185) 60.610 4.126 ( 55.898 19.075 -0.497) 59.065 5.815 ( -26.289 23.109 -6.763) 35.649 6.550 ( 1.198 -4.771 -31.334) 31.718 6.696 ( 70.156 9.785 32.616) 77.983 7.111 ( 4.953 14.432 -14.001) 20.708 7.204 ( -4.615 5.273 -19.354) 20.583 7.314 ( -15.080 6.815 -9.418) 19.040 7.375 ( -14.821 7.933 -14.180) 21.992 7.580 ( -8.224 8.475 -20.321) 23.503 7.746 ( -3.294 11.617 -8.558) 14.800 8.686 ( 10.597 -5.775 16.871) 20.743 8.877 ( -1.208 -8.298 1.114) 8.459 8.957 ( -1.362 -9.989 3.782) 10.767 9.195 ( -8.755 6.344 -3.936) 11.507 9.536 ( 1.717 -6.299 3.885) 7.597 9.615 ( 5.386 -7.850 -0.141) 9.521 9.818 ( -3.281 0.833 1.674) 3.777 10.158 ( 3.735 10.765 14.501) 18.442 10.232 ( 4.769 9.205 8.384) 13.333 10.395 ( 10.309 -5.416 0.091) 11.645 11.124 ( 11.146 3.478 2.301) 11.900 11.193 ( 13.704 -5.814 5.511) 15.873 11.469 ( 21.522 3.598 -23.283) 31.910 11.577 ( 19.093 -11.135 10.037) 24.275 11.655 ( -14.839 -2.520 10.979) 18.630 11.731 ( 5.309 -2.078 7.438) 9.372 11.868 ( 5.625 -0.098 0.443) 5.643 11.946 ( 7.790 -0.718 2.682) 8.270 12.021 ( -8.764 4.056 -1.043) 9.713 12.155 ( 13.835 4.735 5.547) 15.640 12.402 ( 1.380 7.476 -0.204) 7.605 12.424 ( 8.746 5.261 4.543) 11.172 12.493 ( 12.112 2.415 3.058) 12.723 12.628 ( 12.842 4.529 -1.872) 13.746 12.654 ( 7.224 2.279 8.144) 11.122 12.810 ( 12.535 -3.812 9.686) 16.294 12.831 ( 15.977 9.697 0.977) 18.715 13.079 ( 6.898 7.589 -3.340) 10.786 13.219 ( 13.102 3.518 8.371) 15.941 13.410 ( 1.368 8.701 1.037) 8.869 13.743 ( -6.268 3.267 2.657) 7.551 13.791 ( -17.577 -4.856 4.800) 18.857 14.082 ( -10.550 6.589 -2.898) 12.772 14.360 ( -21.332 -10.138 -15.600) 28.305 14.835 ( -7.286 -2.270 0.286) 7.636 14.900 ( -12.679 0.516 -6.168) 14.110 14.981 ( -14.048 -13.106 2.133) 19.331 15.108 ( -7.075 0.656 -0.699) 7.139 15.477 ( -1.925 0.443 -3.617) 4.121 15.501 ( -2.811 1.185 -2.958) 4.249 15.734 ( 8.456 1.257 3.590) 9.272 16.198 ( -10.707 -9.557 -4.867) 15.155 16.233 ( 3.235 -1.689 9.819) 10.476 16.925 ( -8.219 -12.258 0.418) 14.764 17.204 ( -4.712 -6.062 0.358) 7.687 17.414 ( 2.656 -0.356 -0.461) 2.719 17.587 ( -6.475 -1.616 0.555) 6.697 17.706 ( 1.006 4.526 2.204) 5.134 17.828 ( -4.574 -6.107 -6.968) 10.333 17.967 ( 1.916 -1.274 -2.383) 3.313 18.123 ( -3.111 -4.339 -1.989) 5.698 18.172 ( -4.793 -2.680 -6.351) 8.396 18.260 ( -3.794 2.313 -1.742) 4.773 18.520 ( -4.411 11.053 -4.597) 12.757 18.742 ( -8.726 -1.874 -7.348) 11.561 19.183 ( 5.017 1.652 -8.556) 10.055 19.873 ( -11.429 2.094 -8.371) 14.321 20.056 ( -2.236 -9.992 2.967) 10.660 20.252 ( -6.494 4.063 6.769) 10.223 20.449 ( -3.425 12.752 -8.849) 15.895 20.503 ( -0.661 3.555 -2.088) 4.176 20.765 ( 3.113 -3.914 0.207) 5.006 20.832 ( 1.632 -2.810 3.000) 4.423 21.125 ( -5.694 14.942 8.088) 17.919 21.219 ( -9.585 11.226 17.454) 22.859 22.175 ( 10.670 4.638 -2.457) 11.891 22.619 ( 12.272 -1.701 -5.316) 13.481 22.879 ( 6.240 -3.375 11.167) 13.230 24.051 ( -16.244 -1.603 -12.754) 20.715 26.407 ( 8.736 0.117 7.812) 11.720 26.533 ( 5.340 -2.060 16.183) 17.165 27.207 ( 19.316 -5.568 -3.578) 20.418 28.192 ( -9.613 -16.074 -11.515) 21.986 ======================= Grid point 94 (35/100) ======================= q-point: ( 0.44 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.385 ( 40.144 37.964 14.252) 57.061 5.148 ( -28.695 28.836 6.195) 41.150 5.251 ( 46.858 11.935 -9.882) 49.354 6.252 ( -42.120 1.642 -22.249) 47.663 6.839 ( 1.370 -3.062 -27.632) 27.835 7.015 ( -11.846 -4.261 -23.385) 26.558 7.169 ( 4.124 12.856 -11.227) 17.559 7.266 ( -5.242 10.900 -12.769) 17.588 7.490 ( 5.262 18.253 -21.655) 28.806 7.579 ( -2.965 15.167 -16.736) 22.780 8.395 ( 61.417 10.276 24.624) 66.962 8.846 ( 5.141 -2.472 15.499) 16.516 8.902 ( 3.879 -6.627 4.820) 9.067 8.939 ( -1.119 -2.470 6.753) 7.277 9.028 ( -5.959 0.794 3.924) 7.179 9.436 ( -21.885 -3.631 3.448) 22.451 9.651 ( 6.366 -6.852 -0.263) 9.357 9.801 ( -4.362 -2.202 9.797) 10.948 10.201 ( 2.482 9.644 18.225) 20.768 10.366 ( -2.943 10.549 10.738) 15.338 10.493 ( 0.488 -0.047 5.665) 5.686 10.664 ( -21.578 -2.433 7.830) 23.083 11.432 ( 5.656 -6.786 7.330) 11.479 11.462 ( 3.631 -6.544 9.934) 12.437 11.742 ( 4.293 -3.194 1.627) 5.592 11.819 ( -2.964 -7.388 0.998) 8.023 11.961 ( 8.426 4.196 1.432) 9.521 12.042 ( 1.089 -0.449 1.167) 1.659 12.108 ( 11.116 2.661 -2.378) 11.675 12.212 ( 0.039 -2.553 -1.120) 2.788 12.306 ( 18.529 0.616 -4.271) 19.025 12.467 ( 15.877 -6.270 -3.259) 17.379 12.542 ( -5.457 -1.093 6.373) 8.461 12.626 ( 22.663 1.488 9.465) 24.605 12.885 ( 10.077 5.317 -4.438) 12.227 12.940 ( 13.081 -0.469 -2.553) 13.336 12.990 ( -1.637 0.249 7.107) 7.298 13.080 ( 2.537 3.166 -6.282) 7.478 13.229 ( -19.868 2.307 -8.555) 21.754 13.285 ( 10.374 3.822 1.211) 11.122 13.436 ( 0.144 6.513 -7.443) 9.891 13.505 ( -3.194 7.368 0.259) 8.035 13.702 ( -9.876 8.968 -0.424) 13.347 13.760 ( -13.963 3.851 0.201) 14.485 14.004 ( 7.592 -0.121 7.037) 10.352 14.464 ( -28.386 -3.313 6.503) 29.309 14.729 ( 1.292 1.861 -14.350) 14.528 14.843 ( -4.734 -7.529 -9.032) 12.676 15.045 ( -0.458 4.791 -0.376) 4.827 15.189 ( -16.201 7.042 -2.127) 17.793 15.600 ( 9.992 -10.752 9.394) 17.427 15.816 ( -11.889 -11.989 5.076) 17.631 16.155 ( 20.165 -4.023 1.130) 20.593 16.450 ( -1.137 -6.398 -3.870) 7.563 16.795 ( 2.231 -7.948 7.645) 11.251 17.020 ( -13.540 -8.737 3.471) 16.484 17.398 ( -1.724 -1.113 1.948) 2.829 17.423 ( -5.485 -2.460 2.933) 6.689 17.764 ( 5.658 3.517 -2.295) 7.046 17.872 ( -1.304 1.372 -5.160) 5.496 17.976 ( 1.205 -1.951 -6.047) 6.467 18.032 ( -2.414 1.369 -4.374) 5.180 18.189 ( 3.899 -0.058 -6.346) 7.449 18.239 ( -0.844 6.253 -3.256) 7.100 18.464 ( 0.129 5.101 -3.742) 6.328 18.562 ( -8.851 -2.147 -7.710) 11.933 19.353 ( 11.811 6.041 -9.363) 16.237 19.616 ( -14.160 6.028 -10.630) 18.704 20.047 ( 1.521 -4.418 5.213) 7.001 20.120 ( -5.861 2.607 6.102) 8.853 20.429 ( 1.185 8.454 -4.054) 9.451 20.473 ( -2.490 5.788 -1.829) 6.561 20.829 ( 3.441 -2.202 2.149) 4.616 20.872 ( 0.804 -1.575 1.859) 2.565 21.011 ( -2.907 12.231 11.107) 16.775 21.063 ( -6.077 9.348 11.882) 16.294 22.395 ( 10.621 -1.372 -1.312) 10.789 22.575 ( -7.715 -1.994 0.210) 7.972 23.260 ( 23.153 -4.676 -1.538) 23.671 23.690 ( -20.430 -3.707 -7.302) 22.010 26.547 ( 5.049 -1.071 9.893) 11.158 26.593 ( 0.441 -1.892 12.644) 12.793 27.590 ( 19.168 -8.137 -5.841) 21.627 27.937 ( -15.864 -11.528 -8.337) 21.309 ======================= Grid point 99 (36/100) ======================= q-point: ( 0.00 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.354 ( 0.000 38.837 37.653) 54.093 2.636 ( 0.000 60.695 3.863) 60.818 4.838 ( 0.000 89.906 52.343) 104.033 6.153 ( 0.000 -9.088 -27.861) 29.305 6.454 ( 0.000 4.809 -49.031) 49.266 7.130 ( 0.000 -9.534 1.864) 9.715 7.248 ( 0.000 0.180 -3.045) 3.051 7.307 ( 0.000 1.606 -5.621) 5.846 7.563 ( 0.000 11.060 -0.997) 11.105 7.707 ( 0.000 -1.245 -1.501) 1.951 8.194 ( 0.000 -23.874 -9.986) 25.878 8.630 ( 0.000 -11.035 7.755) 13.488 9.071 ( 0.000 -6.437 2.359) 6.856 9.173 ( 0.000 -0.500 -28.770) 28.774 9.194 ( 0.000 -11.267 -5.062) 12.352 9.377 ( 0.000 -5.943 -0.388) 5.956 9.841 ( 0.000 0.319 1.591) 1.623 9.882 ( 0.000 12.391 -4.904) 13.326 9.958 ( 0.000 -0.896 6.251) 6.315 10.009 ( 0.000 10.069 -21.219) 23.486 10.244 ( 0.000 6.596 13.868) 15.357 10.393 ( 0.000 16.347 -36.552) 40.041 10.575 ( 0.000 15.525 9.645) 18.277 11.078 ( 0.000 8.963 16.310) 18.611 11.435 ( 0.000 11.133 2.284) 11.365 11.439 ( 0.000 11.973 2.437) 12.219 11.485 ( 0.000 2.070 18.078) 18.196 11.536 ( 0.000 6.065 12.420) 13.822 11.776 ( 0.000 9.311 0.975) 9.362 11.870 ( 0.000 10.408 12.865) 16.548 11.945 ( 0.000 14.699 2.501) 14.910 12.059 ( 0.000 15.515 9.822) 18.363 12.167 ( 0.000 29.980 -12.341) 32.421 12.331 ( 0.000 7.145 5.652) 9.110 12.590 ( 0.000 26.212 2.956) 26.378 12.665 ( 0.000 -3.775 0.731) 3.845 12.901 ( 0.000 -1.908 6.286) 6.569 13.063 ( 0.000 1.743 10.424) 10.569 13.159 ( 0.000 -17.362 4.760) 18.003 13.195 ( 0.000 -2.766 0.085) 2.767 13.433 ( 0.000 -5.846 0.737) 5.892 13.748 ( 0.000 1.742 7.660) 7.856 13.805 ( 0.000 2.926 1.592) 3.331 14.003 ( 0.000 7.684 22.791) 24.051 14.580 ( 0.000 -1.045 6.947) 7.025 14.675 ( 0.000 1.832 -14.375) 14.492 15.036 ( 0.000 -24.261 -12.418) 27.255 15.172 ( 0.000 -9.397 -8.592) 12.733 15.295 ( 0.000 2.495 1.967) 3.177 15.798 ( 0.000 -0.003 11.279) 11.279 15.836 ( 0.000 1.503 -4.974) 5.196 16.039 ( 0.000 8.097 4.693) 9.359 16.081 ( 0.000 -11.276 4.608) 12.182 16.535 ( 0.000 -17.110 -14.321) 22.312 16.541 ( 0.000 4.555 -2.876) 5.387 17.000 ( 0.000 -18.909 0.465) 18.914 17.184 ( 0.000 -5.640 -15.472) 16.468 17.718 ( 0.000 -6.621 -1.556) 6.801 17.933 ( 0.000 -0.088 -6.411) 6.411 17.956 ( 0.000 0.729 -1.811) 1.952 18.087 ( 0.000 -2.033 3.284) 3.862 18.108 ( 0.000 -2.673 -4.550) 5.277 18.253 ( 0.000 -17.079 6.093) 18.134 18.278 ( 0.000 -11.762 0.108) 11.763 19.052 ( 0.000 6.478 -13.129) 14.641 19.262 ( 0.000 -17.041 -3.995) 17.503 19.707 ( 0.000 7.458 10.781) 13.109 19.817 ( 0.000 -11.642 0.142) 11.643 19.875 ( 0.000 -24.557 -0.585) 24.564 20.207 ( 0.000 -14.185 1.515) 14.266 20.354 ( 0.000 -1.523 -0.836) 1.738 20.440 ( 0.000 -1.455 4.512) 4.741 20.741 ( 0.000 8.163 -12.736) 15.127 21.076 ( 0.000 -0.269 1.276) 1.304 21.083 ( 0.000 4.445 -1.236) 4.614 21.380 ( 0.000 4.220 -10.955) 11.740 21.996 ( 0.000 26.191 16.692) 31.057 23.216 ( 0.000 13.299 2.943) 13.621 23.298 ( 0.000 19.350 2.021) 19.455 24.803 ( 0.000 12.273 -39.724) 41.577 26.110 ( 0.000 5.885 3.986) 7.107 26.399 ( 0.000 -3.338 -0.618) 3.395 26.749 ( 0.000 -19.299 30.976) 36.496 26.984 ( 0.000 -6.753 3.336) 7.531 ======================= Grid point 100 (37/100) ======================= q-point: ( 0.11 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.735 ( 31.529 51.208 0.193) 60.136 3.118 ( 45.569 37.920 26.870) 65.089 5.052 ( 23.279 82.278 51.211) 99.670 6.110 ( -1.886 -4.794 -42.393) 42.705 6.692 ( 20.766 2.671 -31.479) 37.806 7.250 ( 5.985 -1.152 -2.217) 6.486 7.271 ( 6.617 -5.428 1.081) 8.626 7.341 ( 1.465 6.051 -2.830) 6.839 7.564 ( 0.277 9.194 -0.303) 9.203 7.750 ( 4.043 0.442 -3.033) 5.074 8.184 ( -3.164 -18.328 -13.837) 23.181 8.583 ( -6.948 -4.403 6.296) 10.359 8.856 ( -8.719 -11.795 0.384) 14.673 9.010 ( -8.210 -3.632 -13.811) 16.473 9.277 ( 0.159 -2.473 -18.903) 19.064 9.390 ( -5.819 1.602 -2.328) 6.469 9.764 ( -1.860 1.119 0.533) 2.235 9.888 ( 3.468 0.558 -0.942) 3.636 9.936 ( -1.053 2.205 6.226) 6.688 10.173 ( 4.706 2.370 5.567) 7.665 10.301 ( 2.734 0.692 -6.488) 7.074 10.509 ( 17.115 21.439 -36.663) 45.790 10.626 ( 6.757 14.477 11.714) 19.811 10.974 ( -8.470 5.392 24.956) 26.901 11.352 ( -0.096 3.595 7.164) 8.016 11.470 ( 2.180 5.226 4.938) 7.514 11.538 ( 9.855 10.781 0.391) 14.611 11.705 ( -1.418 16.057 -5.840) 17.145 11.880 ( 11.109 5.504 6.222) 13.871 11.945 ( 10.089 7.742 1.753) 12.837 12.015 ( 9.627 18.323 16.757) 26.631 12.153 ( 8.330 15.950 -0.277) 17.996 12.208 ( 7.316 11.249 8.784) 16.038 12.377 ( -3.684 12.019 -7.073) 14.424 12.501 ( 2.408 8.843 11.576) 14.765 12.753 ( -2.942 1.264 4.973) 5.915 12.818 ( -3.020 -3.858 4.092) 6.384 12.931 ( -4.462 -5.373 4.730) 8.435 13.090 ( 0.069 0.877 10.525) 10.562 13.421 ( 8.313 1.498 0.920) 8.497 13.535 ( -5.064 6.807 4.736) 9.716 13.720 ( 7.233 -2.699 1.749) 7.916 13.864 ( -2.107 0.607 12.453) 12.645 14.069 ( 13.985 4.373 10.096) 17.794 14.453 ( -9.090 0.121 -2.876) 9.535 14.606 ( -6.189 -5.281 -10.940) 13.633 15.039 ( 0.380 -18.553 -9.970) 21.066 15.198 ( 0.579 -7.408 0.367) 7.439 15.293 ( -1.079 1.533 1.563) 2.441 15.668 ( -6.831 3.492 6.118) 9.812 15.734 ( -7.892 -3.750 -1.016) 8.797 15.988 ( -7.208 -0.831 -2.615) 7.713 16.260 ( 5.263 -9.081 -3.769) 11.152 16.395 ( -8.010 -4.366 -17.119) 19.398 16.683 ( 11.633 -8.123 3.579) 14.633 17.012 ( 2.838 -13.193 -0.824) 13.520 17.158 ( -2.015 -5.970 -7.098) 9.492 17.704 ( -8.179 -6.183 -0.325) 10.258 17.760 ( -9.688 -3.724 3.327) 10.899 17.958 ( 0.304 0.887 -2.331) 2.512 18.053 ( -2.460 -1.870 1.392) 3.389 18.112 ( 2.333 -5.755 -0.573) 6.237 18.306 ( 2.132 -7.545 -3.166) 8.455 18.330 ( 4.171 -12.447 -3.124) 13.495 18.813 ( -22.496 -5.386 -7.439) 24.298 19.137 ( -6.230 -2.966 -11.931) 13.782 19.538 ( -13.015 8.135 5.963) 16.466 19.876 ( 2.333 -6.556 7.813) 10.463 19.994 ( 5.438 -18.410 -2.790) 19.398 20.272 ( 4.495 -10.326 0.987) 11.305 20.412 ( 6.826 -5.337 -0.143) 8.666 20.453 ( 1.978 -3.241 4.348) 5.773 20.720 ( -2.221 7.196 -10.323) 12.778 20.998 ( -3.308 6.361 -2.407) 7.563 21.217 ( 7.178 0.650 -1.368) 7.336 21.409 ( 3.941 2.659 -5.328) 7.141 22.027 ( 3.985 22.417 14.251) 26.861 23.043 ( -16.943 26.853 -1.294) 31.778 23.198 ( -8.523 9.004 9.145) 15.406 24.667 ( -12.633 8.627 -31.418) 34.944 26.156 ( 4.585 5.436 4.283) 8.302 26.381 ( -4.610 -2.376 15.672) 16.507 26.550 ( 3.821 -6.366 10.100) 12.535 27.456 ( 24.078 -24.191 -1.720) 34.175 ======================= Grid point 101 (38/100) ======================= q-point: ( 0.22 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.490 ( 44.431 43.871 -11.071) 63.414 4.043 ( 42.290 40.332 24.249) 63.270 5.819 ( 53.824 52.490 40.587) 85.437 6.122 ( 4.333 0.553 -44.040) 44.256 7.079 ( 5.694 17.497 -10.649) 21.260 7.229 ( -3.657 7.790 -1.082) 8.673 7.345 ( 4.607 8.098 -6.376) 11.290 7.475 ( 7.859 -3.468 -1.270) 8.684 7.582 ( 0.504 -0.807 6.230) 6.302 7.825 ( 2.003 6.477 -15.781) 17.176 8.032 ( -8.539 -3.209 -16.116) 18.518 8.472 ( -3.976 -2.132 1.703) 4.823 8.690 ( -7.661 -10.291 -3.515) 13.302 8.921 ( -3.161 -3.132 -7.467) 8.693 9.242 ( -1.362 -2.309 -22.691) 22.848 9.353 ( 6.535 3.160 14.589) 16.295 9.763 ( -2.664 8.696 2.139) 9.343 9.848 ( -4.510 -2.821 -0.874) 5.391 10.010 ( 6.612 -8.349 1.715) 10.787 10.223 ( 5.069 5.785 3.035) 8.269 10.331 ( 0.707 4.035 -5.490) 6.850 10.803 ( 9.112 -4.604 24.121) 26.192 10.943 ( 9.331 4.765 24.169) 26.342 11.018 ( 30.403 14.595 -35.593) 49.033 11.401 ( 3.320 -0.594 3.910) 5.164 11.522 ( 1.933 5.070 3.510) 6.463 11.578 ( -0.967 8.124 -14.206) 16.394 11.856 ( 13.199 9.430 0.707) 16.237 12.044 ( 5.222 8.247 0.966) 9.809 12.195 ( 0.185 1.984 0.762) 2.133 12.200 ( 1.105 1.683 5.380) 5.744 12.247 ( 17.240 7.221 0.796) 18.708 12.436 ( 14.700 9.239 6.767) 18.634 12.453 ( 9.928 8.642 6.835) 14.832 12.567 ( -0.230 1.424 9.941) 10.046 12.650 ( -12.993 -3.975 11.360) 17.711 12.671 ( 3.835 1.768 4.042) 5.846 12.958 ( -0.536 1.346 17.082) 17.143 13.083 ( -0.589 7.415 10.277) 12.687 13.275 ( -4.288 18.261 0.763) 18.773 13.568 ( 3.552 11.572 -0.909) 12.139 13.815 ( 0.878 2.139 4.931) 5.446 13.967 ( 7.019 -2.258 3.224) 8.048 14.150 ( -8.592 -2.225 0.432) 8.885 14.379 ( 2.416 1.070 -8.493) 8.894 14.594 ( 4.408 -9.761 5.552) 12.063 14.989 ( -6.141 -15.446 -14.877) 22.307 15.192 ( -10.236 2.340 3.788) 11.162 15.229 ( 4.772 -4.461 -1.522) 6.707 15.411 ( -21.386 -6.531 -6.638) 23.325 15.665 ( 0.125 4.368 -8.128) 9.228 15.795 ( -7.183 -9.887 0.031) 12.221 16.211 ( -4.184 5.378 8.169) 10.637 16.263 ( -11.109 -13.904 -17.709) 25.107 16.767 ( -11.724 -20.906 7.906) 25.239 17.112 ( 10.656 -0.352 -4.217) 11.466 17.213 ( 8.407 -4.173 -1.809) 9.558 17.461 ( -6.125 -7.423 7.016) 11.910 17.739 ( 1.479 -2.059 1.477) 2.934 17.961 ( -3.910 -0.845 -3.370) 5.230 17.973 ( -3.856 0.614 0.906) 4.009 18.124 ( -2.532 -5.097 0.229) 5.696 18.284 ( -1.132 -0.143 -1.268) 1.706 18.316 ( -16.139 -6.959 -2.986) 17.827 18.491 ( 2.437 -11.268 -13.456) 17.719 19.033 ( -6.250 6.858 -12.822) 15.827 19.300 ( -8.365 10.186 1.093) 13.225 19.906 ( 1.185 -4.309 9.476) 10.477 20.002 ( -3.405 -8.411 -5.836) 10.789 20.322 ( 1.156 -2.907 5.678) 6.482 20.527 ( 4.865 -6.008 1.265) 7.833 20.571 ( 6.025 -3.401 -2.736) 7.440 20.675 ( -0.611 5.078 -5.064) 7.198 20.916 ( -5.660 8.919 -6.161) 12.229 21.333 ( 5.061 2.786 1.049) 5.872 21.498 ( 2.097 4.761 6.610) 8.412 22.208 ( 15.476 7.506 5.740) 18.132 22.653 ( -20.140 28.638 -1.088) 35.027 22.998 ( -11.148 3.892 11.209) 16.281 24.363 ( -17.563 1.175 -19.356) 26.163 26.277 ( 7.349 3.900 5.275) 9.851 26.383 ( 4.411 -1.646 17.173) 17.807 26.751 ( 13.988 -6.680 0.259) 15.503 27.765 ( 7.711 -26.631 -7.463) 28.712 ======================= Grid point 102 (39/100) ======================= q-point: ( 0.33 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.419 ( 48.791 35.971 -10.244) 61.477 4.762 ( 33.982 43.371 18.675) 58.177 6.152 ( -0.110 5.843 -36.168) 36.637 6.750 ( -21.835 25.367 2.107) 33.536 7.014 ( 41.769 20.145 18.943) 50.093 7.195 ( -6.515 2.255 -6.885) 9.743 7.436 ( -7.238 8.858 -1.307) 11.513 7.479 ( 0.541 13.055 -9.364) 16.075 7.581 ( 3.588 6.884 0.248) 7.767 7.834 ( 8.079 16.743 -24.844) 31.029 7.966 ( 3.173 9.312 -7.486) 12.363 8.516 ( 10.864 -14.465 3.986) 18.524 8.699 ( 5.599 -1.037 4.532) 7.278 8.862 ( -1.925 2.178 -2.777) 4.020 9.212 ( -3.285 -3.825 -16.589) 17.338 9.494 ( 2.336 -2.785 5.838) 6.877 9.633 ( -7.415 13.181 9.989) 18.125 9.832 ( 4.333 0.237 -1.713) 4.665 10.191 ( 8.854 -6.804 -2.315) 11.404 10.342 ( 5.316 3.963 4.093) 7.792 10.366 ( 5.050 -0.316 -1.582) 5.301 11.027 ( 13.216 -9.790 25.135) 30.038 11.215 ( 10.802 3.442 14.089) 18.084 11.419 ( 0.854 -0.677 4.451) 4.583 11.576 ( -0.916 -3.816 -1.775) 4.307 11.630 ( 3.727 -3.294 4.277) 6.560 11.666 ( 30.698 10.508 -27.698) 42.661 11.727 ( -18.991 -3.404 8.390) 21.039 11.994 ( -5.373 -5.236 -0.337) 7.510 12.179 ( 3.459 11.238 -1.661) 11.875 12.270 ( -2.961 -3.996 4.346) 6.604 12.383 ( -2.927 -7.751 0.374) 8.293 12.478 ( 8.396 10.266 6.721) 14.868 12.571 ( 3.280 -1.645 5.513) 6.622 12.668 ( 16.801 4.906 0.751) 17.518 12.792 ( 11.379 9.973 6.886) 16.624 12.897 ( 11.710 8.751 3.944) 15.141 13.054 ( 8.169 3.292 9.661) 13.073 13.167 ( 12.384 0.642 10.630) 16.333 13.330 ( 7.045 15.509 -1.648) 17.113 13.604 ( -0.314 10.863 -1.704) 11.000 13.743 ( -15.337 -0.025 3.621) 15.759 13.846 ( -3.115 7.919 2.684) 8.923 14.114 ( -4.041 -3.163 -8.383) 9.829 14.376 ( -9.569 11.950 -3.355) 15.672 14.628 ( 0.110 -11.752 4.089) 12.444 14.800 ( -14.218 -6.691 -12.930) 20.349 14.812 ( -13.704 -10.903 -0.419) 17.517 15.134 ( -4.992 0.939 1.145) 5.207 15.468 ( 10.868 -6.041 -8.373) 14.990 15.566 ( -11.817 7.959 -9.788) 17.286 15.679 ( -6.193 -8.590 2.397) 10.858 15.901 ( -16.579 -13.338 -0.719) 21.290 16.210 ( 2.491 -6.904 6.546) 9.835 16.560 ( -6.342 -19.020 6.710) 21.143 17.149 ( -6.564 -3.334 0.636) 7.390 17.319 ( -0.893 -7.678 0.492) 7.745 17.588 ( -14.234 -5.754 -1.836) 15.462 17.600 ( 13.001 -4.421 -0.083) 13.732 17.877 ( 4.879 10.039 2.553) 11.450 17.975 ( 0.267 2.737 -1.995) 3.397 18.080 ( 0.011 0.050 -0.267) 0.272 18.133 ( -3.567 -0.085 -7.002) 7.859 18.309 ( 3.416 1.419 -0.408) 3.722 18.527 ( -1.168 -9.181 -12.847) 15.834 18.845 ( -11.771 10.916 -2.684) 16.276 19.283 ( 5.516 7.213 -11.430) 14.598 19.859 ( -7.707 -6.413 -7.266) 12.383 19.981 ( 3.906 3.548 7.449) 9.129 20.336 ( 0.248 3.658 8.691) 9.433 20.558 ( -1.127 3.598 -2.788) 4.689 20.669 ( 5.678 -4.085 -1.637) 7.184 20.694 ( -2.739 7.947 -11.400) 14.164 20.813 ( -1.126 2.617 1.920) 3.435 21.378 ( -1.729 8.529 8.616) 12.246 21.444 ( -7.386 9.546 13.649) 18.220 22.362 ( -7.038 14.269 -3.725) 16.341 22.574 ( 15.829 -2.575 -3.355) 16.384 22.812 ( -3.317 -2.109 11.575) 12.224 23.993 ( -20.178 -4.589 -12.011) 23.927 26.424 ( 7.020 1.880 6.352) 9.652 26.489 ( 5.182 -1.817 13.065) 14.172 27.057 ( 16.508 -9.233 -2.504) 19.079 27.792 ( -4.047 -22.751 -7.730) 24.367 ======================= Grid point 103 (40/100) ======================= q-point: ( 0.44 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.276 ( 35.712 46.758 9.276) 59.562 5.513 ( 44.959 18.896 -7.101) 49.283 5.889 ( -26.165 35.706 2.777) 44.353 6.345 ( -31.148 10.171 -17.013) 36.920 6.844 ( -6.654 3.430 -19.293) 20.695 6.981 ( -13.154 1.056 -18.217) 22.494 7.447 ( 2.760 10.940 -1.627) 11.400 7.496 ( -2.187 9.287 -4.270) 10.453 7.852 ( 6.795 17.169 -16.009) 24.439 7.922 ( -0.976 18.511 -18.983) 26.532 8.649 ( 35.261 4.100 15.568) 38.762 8.760 ( 23.287 -3.602 9.558) 25.429 8.789 ( 4.183 5.941 0.551) 7.286 8.900 ( 8.367 4.438 6.943) 11.744 9.079 ( -9.442 1.482 -2.992) 10.015 9.404 ( -14.449 1.642 5.286) 15.473 9.601 ( 8.590 1.781 -4.485) 9.853 9.875 ( -6.986 8.661 -0.796) 11.156 10.288 ( 3.803 1.440 9.978) 10.775 10.442 ( 4.091 -3.161 -0.850) 5.239 10.493 ( 3.267 -6.538 -1.923) 7.558 10.648 ( -36.712 4.265 17.081) 40.715 11.302 ( 10.322 -1.584 21.355) 23.772 11.424 ( -2.050 1.451 10.572) 10.867 11.632 ( 1.979 -6.361 4.302) 7.930 11.652 ( -1.368 -8.747 1.044) 8.915 11.840 ( 18.107 -11.197 6.959) 22.398 11.941 ( 3.199 -9.572 7.148) 12.367 12.147 ( -1.093 -11.280 8.767) 14.328 12.253 ( 10.472 8.057 -7.460) 15.173 12.303 ( -3.864 1.122 0.047) 4.024 12.412 ( 4.154 -3.907 -9.476) 11.059 12.489 ( 10.345 -2.591 -6.210) 12.341 12.721 ( 12.958 6.751 6.725) 16.084 12.858 ( 1.737 0.631 4.002) 4.408 12.917 ( -10.299 -1.963 -0.760) 10.512 13.065 ( 6.540 4.231 -1.572) 7.946 13.152 ( -1.277 5.092 -5.187) 7.380 13.366 ( 9.155 5.429 -2.915) 11.035 13.435 ( 2.812 11.437 -4.606) 12.647 13.549 ( -6.350 5.289 -1.915) 8.483 13.685 ( -1.777 8.834 0.818) 9.048 13.726 ( -1.608 -2.737 -3.481) 4.711 13.907 ( -2.687 10.344 2.319) 10.936 14.183 ( -1.683 14.389 5.123) 15.366 14.399 ( -21.530 -1.827 -1.882) 21.689 14.685 ( 3.511 -5.524 -8.581) 10.792 14.758 ( -1.717 -1.272 -4.033) 4.564 15.133 ( 2.362 1.280 5.138) 5.798 15.255 ( -13.023 -0.338 3.727) 13.550 15.461 ( -0.874 -0.590 1.657) 1.964 15.556 ( -7.456 -11.695 3.026) 14.196 15.981 ( 14.503 -13.569 -3.731) 20.209 16.194 ( -6.001 -19.423 -9.194) 22.312 16.559 ( 7.727 -14.032 9.534) 18.642 16.853 ( -19.773 -10.076 6.715) 23.186 17.311 ( 1.170 -3.424 0.688) 3.683 17.371 ( -5.230 -2.246 -0.939) 5.769 17.843 ( 6.149 4.402 0.032) 7.563 17.908 ( -1.933 2.449 0.354) 3.139 18.044 ( 5.024 6.823 -1.969) 8.699 18.093 ( -0.743 4.638 -1.778) 5.022 18.177 ( 10.213 -2.203 -9.153) 13.890 18.385 ( -2.943 6.463 -5.793) 9.165 18.458 ( 1.021 -5.259 -4.691) 7.120 18.617 ( -10.739 9.659 -0.968) 14.476 19.457 ( 10.988 3.560 -15.151) 19.051 19.674 ( -10.639 -1.480 -12.750) 16.672 20.111 ( 9.073 9.655 6.888) 14.933 20.290 ( -6.761 12.960 6.020) 15.809 20.536 ( 0.531 3.434 -4.192) 5.445 20.593 ( -4.468 6.714 -5.343) 9.674 20.779 ( 5.560 -2.628 2.383) 6.596 20.847 ( 0.359 0.302 4.903) 4.925 21.278 ( -5.684 12.141 13.531) 19.048 21.292 ( -5.105 12.498 9.645) 16.592 22.375 ( 6.150 0.069 -2.017) 6.472 22.532 ( -8.857 -1.722 1.726) 9.186 23.124 ( 23.370 -9.048 -1.632) 25.113 23.576 ( -22.391 -7.987 -6.906) 24.756 26.532 ( 3.635 0.055 7.902) 8.699 26.556 ( 1.228 -1.292 10.096) 10.252 27.373 ( 15.311 -13.073 -4.493) 20.629 27.637 ( -11.180 -17.755 -6.299) 21.907 ======================= Grid point 108 (41/100) ======================= q-point: ( 0.00 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.186 ( 0.000 44.586 24.460) 50.855 3.856 ( 0.000 61.468 -9.613) 62.215 5.753 ( 0.000 -29.172 -5.234) 29.638 6.478 ( 0.000 -3.716 -48.110) 48.253 6.536 ( 0.000 67.927 36.228) 76.984 7.012 ( 0.000 1.840 -12.134) 12.272 7.239 ( 0.000 -15.448 -10.938) 18.928 7.268 ( 0.000 9.921 -11.384) 15.100 7.449 ( 0.000 -13.392 -11.115) 17.404 7.618 ( 0.000 -5.080 -8.281) 9.715 7.842 ( 0.000 -11.545 -9.291) 14.819 8.708 ( 0.000 11.001 19.359) 22.267 8.948 ( 0.000 -5.836 2.278) 6.265 8.984 ( 0.000 -6.687 4.933) 8.310 9.148 ( 0.000 -2.545 -16.768) 16.960 9.430 ( 0.000 10.759 -4.309) 11.590 9.865 ( 0.000 2.476 2.476) 3.501 9.901 ( 0.000 -1.995 3.441) 3.977 10.057 ( 0.000 1.163 -3.747) 3.923 10.157 ( 0.000 9.933 -1.802) 10.095 10.268 ( 0.000 -1.157 13.103) 13.154 10.987 ( 0.000 28.950 -31.361) 42.680 11.039 ( 0.000 27.086 6.762) 27.917 11.235 ( 0.000 -14.659 13.732) 20.086 11.405 ( 0.000 -3.929 11.270) 11.935 11.502 ( 0.000 2.120 15.968) 16.109 11.642 ( 0.000 9.707 2.330) 9.982 11.693 ( 0.000 11.943 -1.493) 12.036 11.849 ( 0.000 -9.365 25.148) 26.835 11.910 ( 0.000 5.065 -0.292) 5.073 12.127 ( 0.000 12.796 9.459) 15.913 12.289 ( 0.000 6.842 -0.662) 6.874 12.440 ( 0.000 0.890 10.885) 10.921 12.462 ( 0.000 9.190 -4.620) 10.286 12.694 ( 0.000 11.216 -4.291) 12.009 12.873 ( 0.000 4.677 10.271) 11.286 12.936 ( 0.000 -4.654 7.770) 9.057 13.162 ( 0.000 1.920 1.069) 2.198 13.226 ( 0.000 -0.887 2.484) 2.638 13.306 ( 0.000 31.286 -9.767) 32.776 13.570 ( 0.000 18.300 5.756) 19.184 13.798 ( 0.000 2.883 -0.501) 2.927 13.923 ( 0.000 10.998 3.878) 11.662 14.181 ( 0.000 1.332 4.263) 4.466 14.467 ( 0.000 -18.718 -8.714) 20.647 14.561 ( 0.000 -0.209 8.357) 8.360 14.723 ( 0.000 -3.532 -2.581) 4.375 14.826 ( 0.000 -22.683 -12.736) 26.014 15.341 ( 0.000 0.701 -6.836) 6.872 15.629 ( 0.000 -17.662 -14.952) 23.141 15.806 ( 0.000 1.791 14.944) 15.051 15.861 ( 0.000 -11.821 1.124) 11.874 16.162 ( 0.000 1.551 -5.789) 5.993 16.341 ( 0.000 -4.081 -3.415) 5.321 16.627 ( 0.000 5.645 -9.481) 11.034 16.777 ( 0.000 -2.758 -5.831) 6.450 17.170 ( 0.000 5.469 -8.353) 9.984 17.628 ( 0.000 -1.925 5.762) 6.075 17.809 ( 0.000 -19.308 -5.437) 20.059 17.826 ( 0.000 -23.492 10.136) 25.586 17.894 ( 0.000 -6.333 -4.144) 7.568 17.971 ( 0.000 -0.681 -0.960) 1.177 18.100 ( 0.000 2.329 5.738) 6.193 18.187 ( 0.000 -1.323 7.164) 7.285 18.944 ( 0.000 -14.345 -3.516) 14.770 19.103 ( 0.000 -2.696 -14.310) 14.562 19.372 ( 0.000 -21.784 -1.052) 21.809 19.586 ( 0.000 -11.433 -5.035) 12.493 19.870 ( 0.000 8.058 14.315) 16.427 20.097 ( 0.000 1.885 2.829) 3.399 20.291 ( 0.000 -4.755 3.336) 5.808 20.395 ( 0.000 -3.057 6.028) 6.759 20.861 ( 0.000 4.015 -4.187) 5.801 21.045 ( 0.000 -2.563 1.239) 2.847 21.219 ( 0.000 8.530 -10.307) 13.379 21.448 ( 0.000 2.219 -13.262) 13.447 22.477 ( 0.000 22.037 14.282) 26.260 23.229 ( 0.000 -3.145 11.203) 11.636 23.873 ( 0.000 28.856 -10.232) 30.616 24.902 ( 0.000 -1.613 -33.283) 33.322 26.246 ( 0.000 7.389 3.506) 8.179 26.332 ( 0.000 -3.151 3.040) 4.378 26.465 ( 0.000 -9.612 24.770) 26.569 26.828 ( 0.000 -8.848 2.619) 9.227 ======================= Grid point 109 (42/100) ======================= q-point: ( 0.11 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.651 ( 41.371 41.685 14.961) 60.605 4.042 ( 19.557 54.159 -4.157) 57.732 5.871 ( 9.348 -19.950 -16.790) 27.700 6.540 ( 10.215 -2.109 -22.890) 25.155 6.673 ( 13.604 54.607 26.071) 62.021 7.174 ( 9.101 1.876 -11.932) 15.124 7.231 ( 4.344 -5.862 -8.698) 11.353 7.326 ( 5.359 -9.322 -14.027) 17.674 7.525 ( 7.115 0.044 -6.502) 9.638 7.735 ( 10.314 -1.257 -7.017) 12.538 7.919 ( 5.741 -8.539 -11.247) 15.243 8.686 ( -2.883 10.007 11.776) 15.720 8.808 ( -9.805 5.553 8.507) 14.119 8.922 ( -3.606 -3.497 -1.479) 5.237 9.212 ( 3.610 -4.812 -17.187) 18.210 9.432 ( -1.229 3.043 -0.738) 3.364 9.763 ( -5.794 0.953 -0.359) 5.883 9.896 ( -0.436 4.501 6.040) 7.545 10.044 ( -6.487 0.459 2.115) 6.839 10.198 ( 2.077 -2.160 -5.198) 6.000 10.283 ( 6.990 4.858 2.744) 8.943 11.019 ( 3.639 23.797 -8.241) 25.446 11.084 ( 0.447 25.529 -1.568) 25.581 11.201 ( -9.755 18.048 15.043) 25.440 11.283 ( 2.384 -27.392 12.735) 30.302 11.493 ( -0.736 0.215 8.335) 8.370 11.666 ( 0.825 1.808 4.550) 4.965 11.783 ( 12.011 5.511 2.614) 13.471 11.980 ( 7.381 -4.736 10.125) 13.395 12.037 ( 11.703 2.023 5.505) 13.090 12.140 ( -0.569 8.533 1.137) 8.627 12.323 ( -4.308 2.542 6.736) 8.390 12.358 ( 5.804 7.934 1.922) 10.016 12.560 ( 0.667 -0.155 0.023) 0.685 12.627 ( -5.349 10.522 -3.401) 12.284 12.718 ( -3.210 8.696 4.501) 10.305 12.876 ( -6.326 4.887 11.563) 14.057 13.170 ( 1.409 16.367 1.163) 16.469 13.295 ( 0.667 12.385 2.744) 12.703 13.498 ( 15.503 6.772 -1.725) 17.006 13.700 ( 6.692 2.017 -1.288) 7.107 13.783 ( 1.141 8.648 6.494) 10.875 13.918 ( 0.729 8.993 1.302) 9.116 14.188 ( 0.635 2.274 14.533) 14.724 14.364 ( -6.054 -21.951 -12.592) 26.021 14.550 ( -1.825 11.553 -3.865) 12.318 14.702 ( -2.956 -10.697 -11.454) 15.949 14.940 ( 10.820 -15.159 4.044) 19.058 15.283 ( -3.376 -4.488 -5.705) 8.006 15.541 ( -11.715 -11.341 -7.472) 17.936 15.711 ( -4.121 2.674 10.055) 11.191 15.909 ( -16.292 -5.211 -11.642) 20.691 16.098 ( 12.636 -11.132 2.363) 17.006 16.228 ( -12.238 -11.465 -19.105) 25.420 16.657 ( 0.346 4.894 1.837) 5.239 16.898 ( 10.922 2.504 -2.414) 11.463 17.140 ( -2.566 2.636 -3.823) 5.306 17.538 ( -16.529 -14.039 7.316) 22.887 17.655 ( 0.827 -3.375 5.422) 6.440 17.923 ( 6.367 -9.503 -8.521) 14.264 17.971 ( 3.737 -11.129 -0.512) 11.751 18.006 ( 2.268 -4.073 0.848) 4.739 18.071 ( -0.238 1.270 4.010) 4.214 18.225 ( 1.217 -3.649 3.820) 5.421 18.657 ( -17.983 -5.912 -3.002) 19.167 19.167 ( 1.551 2.707 -16.775) 17.062 19.539 ( 9.496 -22.653 -1.341) 24.600 19.570 ( -1.581 -7.596 -3.333) 8.444 19.889 ( 1.767 6.226 13.985) 15.410 20.144 ( 5.681 -1.174 2.565) 6.342 20.306 ( 2.305 -5.854 3.066) 6.999 20.396 ( 0.544 -3.206 7.666) 8.327 20.840 ( -1.714 5.006 -3.314) 6.244 21.077 ( 1.951 -0.428 -2.864) 3.491 21.254 ( 3.996 5.287 -7.775) 10.217 21.455 ( 0.880 1.513 -11.448) 11.581 22.460 ( -1.599 20.317 13.516) 24.454 23.138 ( -8.924 -2.341 10.981) 14.342 23.727 ( -14.414 29.044 -8.103) 33.421 24.733 ( -16.245 -2.118 -27.179) 31.735 26.285 ( 3.914 6.174 3.853) 8.263 26.341 ( -2.287 -0.017 15.308) 15.478 26.427 ( 5.787 -5.646 6.932) 10.650 27.049 ( 14.742 -17.591 0.909) 22.970 ======================= Grid point 110 (43/100) ======================= q-point: ( 0.22 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.419 ( 33.981 49.051 -12.345) 60.935 4.724 ( 46.576 30.873 19.042) 59.034 6.036 ( 7.815 -5.334 -33.880) 35.177 6.909 ( 23.866 -5.125 0.925) 24.427 7.066 ( 23.650 27.759 15.336) 39.561 7.250 ( 4.440 -2.487 -4.764) 6.971 7.328 ( 2.322 -14.381 -4.525) 15.253 7.526 ( 8.032 5.992 -5.424) 11.395 7.664 ( 6.414 19.560 12.001) 23.828 7.920 ( 5.340 0.953 -16.659) 17.520 8.021 ( 8.815 5.819 -15.068) 18.402 8.568 ( -15.979 11.901 -10.091) 22.334 8.685 ( 5.102 8.893 11.395) 15.328 8.906 ( 1.692 0.827 -8.355) 8.564 9.224 ( -1.648 -0.597 -23.440) 23.505 9.465 ( 8.350 3.510 14.284) 16.914 9.760 ( -1.981 -8.964 5.026) 10.466 9.793 ( -5.689 2.517 7.687) 9.889 9.955 ( 3.279 2.878 -8.100) 9.201 10.265 ( 3.504 -6.124 -10.480) 12.634 10.430 ( 5.944 5.125 -1.785) 8.049 10.841 ( -11.965 16.048 23.852) 31.139 11.129 ( 6.737 12.309 12.803) 18.995 11.311 ( 6.967 -0.562 6.349) 9.442 11.399 ( 12.472 -7.409 -2.985) 14.811 11.491 ( 1.184 3.255 3.669) 5.046 11.694 ( 3.056 -6.710 2.478) 7.779 11.970 ( -6.448 -5.435 -1.361) 8.542 12.054 ( 3.191 3.336 7.314) 8.649 12.110 ( -0.490 12.831 -7.209) 14.726 12.225 ( -2.544 -8.051 5.933) 10.319 12.315 ( 12.531 -4.401 8.515) 15.777 12.446 ( 7.863 3.231 -1.657) 8.660 12.531 ( -0.817 11.115 -0.266) 11.148 12.627 ( -7.704 -0.509 12.844) 14.985 12.745 ( 8.196 11.540 4.010) 14.712 12.839 ( 9.259 9.291 5.477) 14.215 13.124 ( -5.213 14.896 4.661) 16.456 13.300 ( -0.909 9.832 2.250) 10.127 13.655 ( 0.113 12.051 -4.297) 12.795 13.767 ( 4.218 5.136 3.134) 7.348 13.833 ( 1.080 0.784 2.102) 2.490 14.019 ( 5.352 2.936 0.777) 6.153 14.121 ( -6.657 3.398 3.938) 8.448 14.370 ( 9.015 -5.249 0.172) 10.434 14.562 ( 2.468 -1.564 -5.592) 6.309 14.669 ( -2.073 -4.514 -5.229) 7.212 15.084 ( -3.982 -6.613 -1.741) 7.913 15.168 ( -12.163 -11.821 -5.779) 17.919 15.244 ( -7.135 -3.365 -3.025) 8.449 15.529 ( -11.600 -10.574 -6.176) 16.868 15.749 ( 0.083 -0.455 1.783) 1.842 16.006 ( -10.380 -12.672 -16.061) 22.941 16.127 ( -11.913 -12.949 -4.628) 18.193 16.591 ( -7.549 4.727 10.712) 13.931 17.107 ( -0.870 -3.158 -2.454) 4.093 17.139 ( 12.408 -1.183 0.491) 12.474 17.305 ( -3.496 -8.662 6.465) 11.360 17.625 ( -5.590 -8.115 0.965) 9.901 18.000 ( 1.065 0.672 -1.808) 2.203 18.012 ( 4.163 4.008 3.560) 6.788 18.072 ( 2.219 0.284 0.278) 2.255 18.134 ( 2.874 -10.514 -4.837) 11.925 18.244 ( 4.223 -3.712 -4.055) 6.932 18.381 ( -8.585 4.594 -1.964) 9.933 19.178 ( -1.334 7.361 -15.687) 17.380 19.444 ( -6.394 3.475 -2.508) 7.697 19.701 ( 3.675 -19.527 -4.286) 20.327 19.936 ( 3.515 4.216 11.679) 12.904 20.257 ( 4.649 -2.975 3.170) 6.365 20.420 ( 5.901 -5.509 5.839) 9.963 20.464 ( 9.484 -5.335 4.605) 11.815 20.816 ( -0.120 7.801 -1.479) 7.941 21.064 ( -3.847 4.851 -10.482) 12.174 21.357 ( 4.767 0.771 -5.132) 7.047 21.509 ( 5.243 -2.224 -0.711) 5.739 22.435 ( 0.221 13.483 9.868) 16.710 22.898 ( -14.962 0.055 8.875) 17.396 23.351 ( -22.482 26.636 -2.888) 34.975 24.332 ( -23.150 -4.790 -16.922) 29.073 26.362 ( 4.511 0.318 13.377) 14.121 26.390 ( 6.027 7.083 3.069) 9.793 26.612 ( 11.792 -6.995 1.663) 13.811 27.276 ( 7.614 -22.457 -2.912) 23.891 ======================= Grid point 111 (44/100) ======================= q-point: ( 0.33 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.130 ( 39.141 37.384 -10.308) 55.098 5.542 ( 34.861 32.511 17.512) 50.783 6.204 ( 9.220 1.579 -31.861) 33.206 7.151 ( -8.895 5.750 2.007) 10.780 7.223 ( -3.006 -1.191 -0.915) 3.360 7.281 ( -6.609 6.366 0.877) 9.218 7.442 ( 5.882 -16.195 9.328) 19.593 7.499 ( -7.235 -1.763 3.505) 8.230 7.973 ( 6.923 13.592 -13.771) 20.550 8.158 ( 39.281 35.302 19.120) 56.168 8.226 ( 10.623 17.048 -22.119) 29.879 8.398 ( 5.768 8.212 -21.879) 24.071 8.796 ( 4.234 3.967 -7.565) 9.534 8.985 ( 6.389 9.490 -3.759) 12.042 9.193 ( -1.848 4.948 -13.050) 14.078 9.527 ( -8.322 4.425 -0.186) 9.427 9.736 ( 10.441 -3.226 13.870) 17.658 9.892 ( 7.673 -0.193 8.603) 11.529 10.051 ( 5.875 -2.688 -9.296) 11.321 10.272 ( -3.479 -7.292 -1.247) 8.175 10.500 ( 0.893 11.037 -8.500) 13.959 10.871 ( 17.126 -1.373 19.224) 25.783 11.256 ( 6.054 -1.351 13.024) 14.426 11.425 ( 4.492 -2.595 13.909) 14.845 11.501 ( -0.419 -5.882 5.343) 7.957 11.587 ( -0.045 3.986 3.832) 5.529 11.713 ( -21.429 1.867 9.679) 23.587 11.816 ( -7.295 -8.148 -0.254) 10.940 11.966 ( 16.741 -8.098 -3.375) 18.901 12.043 ( -10.603 -11.009 8.960) 17.718 12.190 ( 1.318 12.669 -7.363) 14.713 12.361 ( -3.410 -8.723 17.235) 19.616 12.414 ( -2.957 -0.666 -0.021) 3.031 12.723 ( 12.493 10.936 0.970) 16.632 12.809 ( 19.545 6.617 -2.536) 20.790 12.925 ( 1.912 6.156 4.954) 8.129 12.997 ( 2.646 -2.480 2.042) 4.162 13.097 ( 8.392 10.067 -1.451) 13.186 13.311 ( 5.452 7.555 -0.585) 9.335 13.611 ( -4.546 5.507 -5.615) 9.084 13.734 ( -9.193 -0.167 4.905) 10.421 13.847 ( 0.988 15.623 2.195) 15.808 13.987 ( 0.034 -1.685 -7.150) 7.346 14.133 ( -1.744 9.100 -0.526) 9.280 14.446 ( -9.240 -6.885 -0.644) 11.541 14.579 ( -3.713 -4.906 -2.692) 6.716 14.647 ( -14.816 -0.931 -9.846) 17.814 14.711 ( 11.322 7.571 6.193) 14.962 15.078 ( -6.841 -8.552 1.450) 11.048 15.304 ( 7.656 -9.812 -9.961) 15.941 15.395 ( -6.581 -14.434 -1.225) 15.911 15.674 ( -17.086 -4.655 2.158) 17.840 15.749 ( -0.937 1.681 -6.031) 6.330 15.924 ( -7.206 -15.240 -8.568) 18.911 16.371 ( -12.609 -1.490 18.147) 22.148 16.974 ( -14.344 -13.466 3.831) 20.044 17.248 ( 3.456 0.586 -0.107) 3.507 17.410 ( 1.262 -4.184 -6.207) 7.591 17.636 ( 14.135 0.661 2.183) 14.318 17.990 ( -0.377 2.672 -0.213) 2.707 18.053 ( -0.742 2.260 0.907) 2.546 18.097 ( -0.095 -0.475 -3.472) 3.506 18.180 ( 1.758 -6.150 -4.539) 7.843 18.268 ( -1.014 -3.270 -0.346) 3.441 18.449 ( 11.657 13.213 -4.961) 18.305 19.065 ( -9.453 10.986 -4.821) 15.274 19.402 ( 1.958 3.492 -10.663) 11.390 19.694 ( -3.583 -11.367 -4.888) 12.881 20.052 ( 8.780 3.947 6.368) 11.542 20.367 ( 7.046 -1.314 1.393) 7.301 20.556 ( 9.068 -2.059 7.833) 12.158 20.621 ( 2.908 -0.896 -5.506) 6.291 20.867 ( 5.261 10.171 1.373) 11.533 20.930 ( -8.668 6.913 -8.868) 14.198 21.433 ( 3.383 -0.839 2.372) 4.216 21.570 ( -1.933 2.050 10.673) 11.039 22.528 ( 6.753 -0.147 0.180) 6.757 22.600 ( -10.103 3.543 4.071) 11.454 22.917 ( -20.103 15.794 3.047) 25.746 23.860 ( -24.753 -9.116 -10.201) 28.282 26.471 ( 5.733 1.440 8.975) 10.747 26.504 ( 5.045 5.463 4.050) 8.467 26.861 ( 13.036 -10.113 -0.682) 16.513 27.345 ( -0.322 -21.606 -4.220) 22.016 ======================= Grid point 112 (45/100) ======================= q-point: ( 0.44 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.919 ( 39.175 24.498 -7.453) 46.802 6.112 ( 25.199 32.424 12.839) 43.025 6.325 ( -1.486 12.111 -14.438) 18.904 6.754 ( -34.677 23.858 6.567) 42.601 6.954 ( -8.578 7.155 -6.682) 13.016 7.039 ( -12.075 3.956 -7.744) 14.880 7.468 ( 3.628 -8.774 6.964) 11.775 7.512 ( -0.184 -8.733 8.994) 12.537 8.124 ( 8.917 9.753 -19.892) 23.882 8.270 ( -4.564 16.679 -23.067) 28.829 8.638 ( 12.765 3.554 -18.145) 22.468 8.744 ( 4.374 0.643 -15.109) 15.743 9.050 ( 2.395 8.896 -3.417) 9.826 9.092 ( -3.388 3.764 -9.910) 11.129 9.236 ( 33.703 26.953 8.129) 43.914 9.519 ( 4.285 12.005 5.832) 14.018 9.766 ( 3.522 13.297 15.685) 20.862 10.042 ( 3.338 0.848 3.139) 4.660 10.172 ( -3.501 -12.925 -5.344) 14.417 10.247 ( 5.759 -6.452 -2.694) 9.058 10.496 ( 0.539 8.260 -6.026) 10.239 10.834 ( -38.365 13.854 16.431) 43.975 11.305 ( 14.855 -4.567 14.792) 21.455 11.390 ( 4.759 -5.187 11.786) 13.728 11.520 ( -1.199 -3.223 6.297) 7.175 11.536 ( 0.518 -2.517 13.873) 14.109 11.688 ( 8.132 -2.134 8.634) 12.051 11.748 ( 0.841 -8.709 4.994) 10.074 11.908 ( -1.780 -10.818 11.180) 15.659 12.129 ( -3.880 -21.974 11.793) 25.238 12.173 ( -6.697 -11.465 15.960) 20.761 12.310 ( -6.678 -8.760 2.064) 11.207 12.539 ( 21.829 8.521 -17.586) 29.298 12.808 ( -4.350 4.002 -1.845) 6.192 12.917 ( 1.791 5.602 -1.883) 6.175 12.975 ( -3.179 2.821 0.706) 4.308 13.145 ( 11.987 5.612 -9.472) 16.275 13.303 ( 6.324 7.313 -4.825) 10.805 13.405 ( -1.149 -0.333 -6.900) 7.002 13.503 ( -6.351 -2.096 -5.856) 8.889 13.673 ( 6.416 5.635 2.218) 8.822 13.818 ( -5.531 6.731 -4.325) 9.727 13.860 ( -7.766 12.275 -3.069) 14.846 13.978 ( -5.219 -2.955 -2.537) 6.512 14.382 ( 0.258 2.075 1.597) 2.631 14.442 ( -4.686 1.259 -0.841) 4.925 14.654 ( 7.251 7.326 -3.654) 10.936 14.813 ( -4.352 7.795 -0.377) 8.936 15.036 ( 3.060 -11.531 4.880) 12.889 15.169 ( -11.326 -9.205 3.420) 14.990 15.373 ( 6.625 -4.090 -0.749) 7.822 15.587 ( -7.590 6.223 -0.088) 9.815 15.700 ( 1.475 -10.327 -3.710) 11.071 15.802 ( -5.025 -13.434 -7.453) 16.164 16.286 ( 8.065 -12.948 13.634) 20.460 16.605 ( -20.504 -14.280 9.512) 26.736 17.331 ( 4.145 5.089 -2.127) 6.899 17.392 ( -1.961 4.844 -4.298) 6.766 17.913 ( 7.960 1.838 -0.346) 8.177 17.980 ( -1.496 4.628 -0.125) 4.866 18.064 ( 5.185 -7.753 -6.334) 11.274 18.131 ( 3.772 1.594 0.375) 4.112 18.154 ( -2.977 -5.103 -5.236) 7.894 18.239 ( -4.190 -7.506 -3.836) 9.414 18.668 ( 10.224 17.800 0.722) 20.540 18.865 ( -10.263 14.652 0.341) 17.892 19.478 ( 5.267 -1.719 -11.125) 12.429 19.593 ( -6.045 -6.461 -7.301) 11.471 20.279 ( 13.752 6.005 -2.263) 15.176 20.499 ( 0.163 4.823 -5.863) 7.594 20.570 ( -1.547 -0.180 -9.881) 10.003 20.695 ( -5.687 -0.766 -8.141) 9.961 20.817 ( 9.173 11.848 11.437) 18.850 20.969 ( -0.238 12.777 12.225) 17.685 21.449 ( -2.601 3.177 10.851) 11.602 21.468 ( -4.003 5.402 11.627) 13.431 22.414 ( -0.350 3.253 -1.453) 3.580 22.556 ( -12.828 6.014 1.253) 14.223 22.913 ( 21.202 -11.820 -1.297) 24.309 23.373 ( -24.694 -12.449 -5.850) 28.267 26.559 ( 2.796 2.490 6.515) 7.514 26.571 ( 1.544 3.870 5.122) 6.603 27.100 ( 10.973 -13.934 -2.486) 17.909 27.275 ( -6.542 -18.083 -3.779) 19.598 ======================= Grid point 117 (46/100) ======================= q-point: ( 0.00 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.087 ( 0.000 46.000 14.692) 48.289 4.889 ( 0.000 -4.141 -6.315) 7.552 5.157 ( 0.000 18.143 -4.421) 18.673 6.075 ( 0.000 -40.860 -29.937) 50.653 6.902 ( 0.000 -5.518 -19.748) 20.505 6.903 ( 0.000 -1.175 -16.000) 16.043 7.145 ( 0.000 7.084 -16.198) 17.679 7.312 ( 0.000 -7.906 -13.557) 15.694 7.549 ( 0.000 0.518 -14.569) 14.578 7.620 ( 0.000 -5.055 -13.082) 14.024 8.413 ( 0.000 69.124 23.597) 73.040 8.798 ( 0.000 0.837 10.907) 10.939 8.854 ( 0.000 -2.754 5.717) 6.345 8.959 ( 0.000 1.509 9.318) 9.439 9.092 ( 0.000 -0.998 -0.441) 1.091 9.555 ( 0.000 -14.249 -2.909) 14.543 9.898 ( 0.000 2.731 -8.286) 8.724 9.977 ( 0.000 9.938 4.341) 10.844 10.145 ( 0.000 7.299 10.046) 12.418 10.148 ( 0.000 -6.203 9.823) 11.617 10.260 ( 0.000 -45.830 10.993) 47.130 10.290 ( 0.000 -2.206 8.014) 8.312 11.302 ( 0.000 3.027 11.481) 11.873 11.310 ( 0.000 1.369 13.970) 14.037 11.748 ( 0.000 14.734 5.298) 15.658 11.791 ( 0.000 5.581 3.284) 6.475 11.835 ( 0.000 13.897 1.957) 14.034 11.888 ( 0.000 7.482 -4.207) 8.584 11.894 ( 0.000 14.626 2.272) 14.801 12.011 ( 0.000 5.465 -1.550) 5.680 12.139 ( 0.000 -6.483 1.967) 6.775 12.245 ( 0.000 -7.797 -8.343) 11.420 12.601 ( 0.000 13.307 25.648) 28.895 12.665 ( 0.000 9.112 7.315) 11.685 12.847 ( 0.000 3.468 -4.941) 6.037 12.913 ( 0.000 -0.905 8.770) 8.816 13.000 ( 0.000 5.664 5.058) 7.594 13.133 ( 0.000 -4.450 3.157) 5.456 13.221 ( 0.000 5.377 -4.593) 7.072 13.550 ( 0.000 -28.507 -23.149) 36.722 13.754 ( 0.000 4.605 1.077) 4.729 13.791 ( 0.000 10.124 -7.265) 12.461 13.996 ( 0.000 5.151 -5.876) 7.814 14.170 ( 0.000 7.288 17.387) 18.853 14.294 ( 0.000 -19.474 -9.688) 21.751 14.388 ( 0.000 -14.481 5.651) 15.545 14.796 ( 0.000 20.876 5.305) 21.540 14.822 ( 0.000 19.065 -1.712) 19.142 15.260 ( 0.000 -10.677 -8.524) 13.663 15.315 ( 0.000 -16.895 -10.612) 19.951 15.693 ( 0.000 -1.747 -15.560) 15.657 15.763 ( 0.000 -6.446 -13.666) 15.110 16.186 ( 0.000 4.281 7.952) 9.031 16.276 ( 0.000 -3.556 8.003) 8.757 16.807 ( 0.000 10.123 -10.325) 14.460 16.836 ( 0.000 5.894 -7.763) 9.747 17.348 ( 0.000 4.133 -0.767) 4.204 17.408 ( 0.000 -16.587 4.197) 17.110 17.411 ( 0.000 -7.791 7.288) 10.668 17.587 ( 0.000 -6.694 -2.423) 7.119 17.826 ( 0.000 1.762 -1.088) 2.071 17.919 ( 0.000 -4.592 -2.193) 5.088 18.157 ( 0.000 2.078 8.165) 8.426 18.169 ( 0.000 -0.197 8.363) 8.365 18.744 ( 0.000 -4.331 -1.122) 4.474 18.842 ( 0.000 -14.642 0.224) 14.644 19.248 ( 0.000 3.736 -11.769) 12.348 19.380 ( 0.000 -8.982 -9.031) 12.737 20.029 ( 0.000 7.872 10.555) 13.167 20.175 ( 0.000 -6.813 6.442) 9.376 20.196 ( 0.000 6.465 5.892) 8.747 20.315 ( 0.000 -5.134 7.192) 8.837 20.926 ( 0.000 3.036 -1.054) 3.214 20.987 ( 0.000 -3.094 0.206) 3.101 21.373 ( 0.000 6.306 -13.423) 14.830 21.454 ( 0.000 -1.795 -13.867) 13.983 22.855 ( 0.000 16.031 12.550) 20.359 23.106 ( 0.000 -9.402 11.564) 14.903 24.388 ( 0.000 22.745 -16.281) 27.972 24.751 ( 0.000 -13.430 -24.601) 28.028 26.287 ( 0.000 -1.144 8.309) 8.387 26.299 ( 0.000 -2.205 13.897) 14.071 26.455 ( 0.000 8.305 5.380) 9.895 26.642 ( 0.000 -9.769 2.733) 10.144 ======================= Grid point 118 (47/100) ======================= q-point: ( 0.11 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.461 ( 35.171 40.739 13.331) 55.447 5.072 ( 14.857 29.253 -13.373) 35.430 5.329 ( 19.165 -12.755 1.773) 23.089 6.108 ( 4.503 -38.424 -26.703) 47.008 6.900 ( 2.646 -4.092 -18.075) 18.720 6.959 ( 3.929 -6.953 -15.735) 17.645 7.310 ( 13.996 5.002 -13.248) 19.910 7.385 ( 6.310 -1.217 -9.248) 11.261 7.681 ( 12.615 0.567 -15.125) 19.703 7.735 ( 10.554 -4.429 -14.734) 18.658 8.514 ( 9.917 66.043 23.449) 70.780 8.799 ( -0.226 4.067 8.047) 9.019 8.859 ( 1.951 -1.256 10.865) 11.110 8.955 ( -1.612 5.043 7.386) 9.087 9.085 ( 0.558 -5.830 -1.421) 6.027 9.483 ( -6.361 -6.895 -0.459) 9.392 9.810 ( -7.692 3.861 -11.913) 14.697 10.004 ( -5.101 -0.251 2.995) 5.920 10.038 ( 3.966 -0.753 -4.640) 6.150 10.138 ( -4.437 -5.776 7.156) 10.210 10.291 ( 2.077 -29.350 14.131) 32.640 10.372 ( 5.680 -10.952 9.819) 15.768 11.299 ( 0.640 6.787 21.092) 22.166 11.362 ( 3.808 0.757 12.658) 13.240 11.645 ( -10.527 20.965 5.105) 24.008 11.727 ( -4.813 10.810 3.206) 12.260 11.797 ( -2.095 7.991 2.972) 8.779 11.895 ( 2.030 -3.557 0.253) 4.103 11.948 ( 0.977 6.211 4.258) 7.593 12.073 ( -1.090 -6.584 7.040) 9.701 12.137 ( 7.671 6.710 -3.807) 10.879 12.302 ( 4.251 -6.410 -6.400) 10.006 12.515 ( -2.915 12.007 8.295) 14.882 12.640 ( -0.443 0.787 9.366) 9.410 12.837 ( -4.521 6.364 -7.038) 10.511 12.854 ( 1.339 3.692 6.000) 7.171 12.989 ( -2.733 12.013 -0.325) 12.325 13.351 ( 11.162 0.356 1.151) 11.227 13.423 ( 16.810 0.267 4.197) 17.328 13.515 ( -2.112 -19.764 -16.606) 25.901 13.715 ( -3.471 5.993 -4.898) 8.482 13.843 ( 5.397 10.341 -2.845) 12.007 13.927 ( -7.505 -6.371 -2.945) 10.275 14.157 ( -0.530 -5.373 8.495) 10.066 14.245 ( 2.818 3.059 -0.465) 4.185 14.370 ( -3.664 -16.551 3.290) 17.268 14.734 ( 0.159 11.013 4.873) 12.044 14.994 ( 3.407 -0.098 1.616) 3.772 15.154 ( 4.466 10.343 -13.237) 17.382 15.540 ( -2.225 3.656 -11.184) 11.975 15.622 ( -5.024 -16.204 -10.689) 20.052 15.741 ( -0.096 -4.827 -10.549) 11.602 15.967 ( -13.148 -0.448 7.481) 15.135 16.031 ( -18.326 -7.123 -4.094) 20.084 16.808 ( 1.053 9.394 -2.424) 9.759 16.969 ( 5.640 -1.790 -3.428) 6.839 17.222 ( -9.437 4.557 1.684) 10.614 17.269 ( -7.191 -5.929 9.853) 13.563 17.555 ( -1.982 -6.553 -0.829) 6.896 17.615 ( 11.007 -13.966 -2.800) 18.001 17.908 ( 7.145 2.974 -2.203) 8.047 17.975 ( 4.738 -2.703 -3.412) 6.435 18.141 ( 0.184 4.412 7.311) 8.541 18.193 ( 0.780 -0.593 6.953) 7.022 18.658 ( -3.618 7.991 -0.753) 8.804 18.993 ( 10.260 -22.957 -1.957) 25.221 19.290 ( 3.824 4.600 -11.992) 13.402 19.425 ( 3.240 -7.920 -8.860) 12.317 20.030 ( 0.315 7.317 9.627) 12.096 20.164 ( -0.344 -4.557 5.346) 7.033 20.216 ( 2.637 3.009 7.828) 8.791 20.316 ( 0.710 -4.944 9.344) 10.595 20.932 ( 0.807 4.471 -1.131) 4.682 21.018 ( 3.042 -4.144 -0.684) 5.186 21.378 ( 0.398 5.677 -12.806) 14.013 21.454 ( -0.173 -1.865 -13.245) 13.376 22.808 ( -4.692 14.680 12.349) 19.749 23.035 ( -7.130 -8.271 11.549) 15.894 24.237 ( -15.087 22.065 -13.726) 30.048 24.584 ( -16.280 -12.801 -20.433) 29.093 26.302 ( 2.114 0.232 11.347) 11.544 26.336 ( 4.420 -3.211 7.968) 9.661 26.495 ( 4.231 11.026 3.166) 12.227 26.741 ( 7.813 -13.896 1.897) 16.054 ======================= Grid point 119 (48/100) ======================= q-point: ( 0.22 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.289 ( 44.294 29.469 12.209) 54.584 5.404 ( 20.323 45.011 -14.123) 51.366 5.807 ( 23.657 -17.438 -6.142) 30.024 6.323 ( 18.967 -40.396 -10.655) 45.882 7.010 ( 8.156 -4.629 -13.268) 16.248 7.069 ( 7.013 -8.308 -11.607) 15.904 7.485 ( 2.445 5.944 -0.161) 6.429 7.551 ( 6.392 -1.285 -3.177) 7.253 7.957 ( 12.003 2.399 -16.965) 20.920 7.998 ( 16.641 -0.954 -18.339) 24.782 8.721 ( 8.520 45.682 21.792) 51.326 8.804 ( -4.813 9.167 -0.319) 10.359 8.908 ( 4.500 17.089 -0.347) 17.675 8.953 ( 7.138 5.794 -3.801) 9.948 9.159 ( 8.445 -4.839 -2.106) 9.959 9.431 ( 3.943 -5.229 3.753) 7.548 9.622 ( -9.356 0.595 -1.999) 9.586 9.946 ( -6.984 -3.579 -4.517) 9.055 10.018 ( 4.627 0.665 -6.368) 7.900 10.159 ( 1.593 7.893 0.439) 8.064 10.372 ( 3.513 -14.943 4.476) 15.990 10.463 ( 8.084 -42.347 17.447) 46.509 11.313 ( -1.046 20.448 28.699) 35.254 11.438 ( 2.211 7.515 10.119) 12.797 11.465 ( -3.888 12.887 2.946) 13.780 11.632 ( -3.898 3.110 2.911) 5.774 11.725 ( -4.382 1.626 6.470) 7.982 11.822 ( -6.823 -6.176 3.096) 9.709 11.968 ( -0.222 -10.206 18.672) 21.280 11.991 ( -6.034 -9.136 9.154) 14.271 12.398 ( 7.834 8.128 -3.005) 11.682 12.489 ( 8.847 7.944 -3.837) 12.494 12.512 ( 10.292 4.704 -1.687) 11.442 12.588 ( -6.075 -1.367 6.875) 9.276 12.744 ( -4.115 12.724 -10.494) 16.999 12.882 ( 3.170 1.434 -0.658) 3.541 12.997 ( 4.560 9.855 -2.098) 11.060 13.341 ( -6.676 -11.893 -13.204) 18.983 13.474 ( -5.634 12.723 -1.676) 14.015 13.616 ( -5.470 -0.755 -9.418) 10.917 13.705 ( 7.620 -2.133 2.835) 8.406 13.888 ( 3.384 -11.366 2.247) 12.070 14.006 ( 10.362 8.978 2.465) 13.931 14.198 ( 3.199 -2.054 4.545) 5.925 14.313 ( 3.816 -8.087 3.494) 9.600 14.375 ( 6.699 -3.463 3.237) 8.206 14.812 ( 7.511 9.974 2.026) 12.649 14.974 ( -17.215 -1.673 -7.676) 18.923 15.075 ( -5.711 -0.394 -0.189) 5.728 15.237 ( -25.790 -7.640 -2.475) 27.012 15.387 ( -3.807 10.491 -11.791) 16.235 15.704 ( -12.335 -10.188 -2.884) 16.256 15.811 ( 0.436 -2.641 -4.472) 5.212 15.889 ( -3.058 -8.796 -4.476) 10.332 16.765 ( -9.482 11.121 3.375) 15.000 16.994 ( -9.721 -10.377 0.173) 14.220 17.108 ( 6.615 -0.188 1.058) 6.702 17.154 ( 0.984 -4.877 4.375) 6.626 17.579 ( 4.018 5.142 0.316) 6.533 17.795 ( 7.004 -14.979 -3.177) 16.838 18.012 ( 2.038 1.385 -1.671) 2.977 18.054 ( 2.318 -2.305 -2.592) 4.173 18.150 ( -0.129 4.435 3.477) 5.637 18.223 ( 1.974 -2.251 2.473) 3.883 18.677 ( 6.860 23.988 -2.001) 25.029 19.186 ( 8.366 -22.240 -7.277) 24.851 19.359 ( 1.913 2.253 -8.407) 8.911 19.448 ( -1.087 -3.280 -7.209) 7.995 20.054 ( 2.595 6.805 7.324) 10.328 20.184 ( 2.814 -5.574 3.053) 6.950 20.341 ( 9.779 -0.554 9.386) 13.566 20.380 ( 7.325 -3.464 10.904) 13.585 20.966 ( 2.725 7.128 -1.874) 7.858 21.077 ( 1.479 -3.307 -5.916) 6.937 21.394 ( 1.453 2.895 -8.344) 8.951 21.454 ( 1.217 -2.990 -7.396) 8.070 22.681 ( -7.776 10.596 10.792) 17.006 22.840 ( -12.187 -5.526 10.553) 17.042 23.830 ( -25.362 20.862 -8.494) 33.921 24.162 ( -25.547 -12.665 -12.968) 31.325 26.389 ( 6.508 2.810 8.326) 10.935 26.470 ( 8.809 -4.759 3.802) 10.710 26.597 ( 5.474 11.334 2.033) 12.750 26.884 ( 5.958 -17.249 -0.235) 18.250 ======================= Grid point 120 (49/100) ======================= q-point: ( 0.33 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.855 ( 26.561 31.565 -7.368) 41.906 6.077 ( 33.057 24.732 10.100) 42.503 6.191 ( 17.579 -3.807 -12.957) 22.168 6.748 ( 19.513 -35.585 4.860) 40.874 7.149 ( 2.814 -1.296 -3.936) 5.009 7.208 ( 5.805 -7.068 -1.957) 9.353 7.421 ( -8.873 5.932 5.624) 12.064 7.502 ( -11.146 -1.404 8.559) 14.124 8.127 ( 6.025 8.555 -21.184) 23.627 8.291 ( 12.600 -5.609 -22.802) 26.649 8.716 ( 0.394 16.572 -18.712) 24.999 8.851 ( -3.341 2.321 -20.644) 21.041 9.053 ( 17.738 28.313 -2.250) 33.486 9.148 ( 9.608 4.825 -5.194) 11.941 9.355 ( 5.512 9.770 -9.946) 14.992 9.498 ( 0.176 -6.732 -12.012) 13.771 9.684 ( 20.740 8.891 25.312) 33.910 9.957 ( 11.192 7.741 19.677) 23.924 10.063 ( -4.002 -2.868 6.273) 7.974 10.170 ( -0.523 3.259 -8.616) 9.227 10.441 ( 7.556 -10.670 -5.096) 14.032 10.734 ( 16.630 -41.844 15.404) 47.589 11.235 ( -2.330 27.462 10.189) 29.383 11.446 ( 1.018 6.772 16.203) 17.591 11.498 ( 0.186 1.200 9.351) 9.430 11.619 ( 3.233 -3.713 7.619) 9.072 11.644 ( -4.615 -6.280 5.617) 9.607 11.710 ( -3.044 -0.297 6.263) 6.970 11.862 ( -5.998 -7.030 11.935) 15.095 11.929 ( -8.792 -4.184 18.460) 20.870 12.097 ( -21.293 -0.855 16.556) 26.985 12.317 ( -16.342 -11.318 5.443) 20.611 12.689 ( 3.385 24.914 -16.209) 29.915 12.896 ( 16.869 1.685 -3.496) 17.309 12.901 ( 16.439 7.047 -3.014) 18.138 12.965 ( 4.558 -0.525 -5.486) 7.152 13.038 ( -1.676 3.849 -2.377) 4.825 13.230 ( -1.946 -3.962 -9.335) 10.326 13.388 ( -0.127 2.259 -6.519) 6.900 13.519 ( -4.060 -8.391 -13.776) 16.634 13.769 ( -0.795 5.288 6.756) 8.616 13.894 ( -1.256 -5.012 -0.675) 5.211 14.150 ( 1.974 11.230 1.577) 11.511 14.291 ( 7.676 2.779 -0.376) 8.173 14.392 ( -20.925 2.330 -7.559) 22.370 14.476 ( -3.449 -0.548 5.354) 6.392 14.520 ( 6.333 -8.908 2.349) 11.179 14.749 ( -15.505 -19.832 4.914) 25.649 14.965 ( 4.793 11.813 -5.803) 14.007 15.146 ( 2.612 -6.148 -7.582) 10.105 15.336 ( -1.292 7.541 -8.372) 11.341 15.527 ( -3.746 -9.065 1.981) 10.007 15.760 ( -6.476 -1.879 0.889) 6.802 15.772 ( -3.903 -1.304 1.730) 4.463 16.447 ( -19.984 8.909 9.807) 23.977 16.688 ( -18.412 -14.356 5.387) 23.961 17.303 ( 11.123 4.382 -1.415) 12.039 17.380 ( 14.959 -1.848 -6.996) 16.617 17.665 ( 4.353 5.309 0.902) 6.925 17.886 ( 2.170 -15.235 -5.027) 16.189 18.030 ( 0.485 1.821 -0.783) 2.040 18.068 ( 0.616 -1.804 -0.837) 2.082 18.136 ( -1.511 4.406 1.336) 4.846 18.220 ( -1.611 -3.661 0.085) 4.000 18.881 ( 11.012 24.708 -3.163) 27.235 19.250 ( -2.785 2.824 -8.178) 9.089 19.358 ( -0.149 -9.766 -2.837) 10.171 19.435 ( -0.130 -8.183 -4.195) 9.196 20.156 ( 8.414 6.426 1.671) 10.718 20.285 ( 7.591 -6.065 -2.663) 10.075 20.553 ( 11.923 1.277 8.793) 14.869 20.590 ( 9.158 -2.084 2.153) 9.635 21.038 ( 5.089 5.040 -1.933) 7.419 21.041 ( -3.429 3.719 -8.007) 9.471 21.431 ( 2.481 2.305 1.104) 3.562 21.525 ( 3.629 -5.370 6.462) 9.152 22.552 ( -3.486 2.312 5.143) 6.629 22.598 ( -10.427 -1.861 7.082) 12.741 23.293 ( -28.137 19.122 -3.979) 34.252 23.628 ( -28.135 -14.432 -7.463) 32.490 26.532 ( 7.363 4.994 5.175) 10.292 26.647 ( 7.510 0.323 0.860) 7.566 26.698 ( 5.656 2.597 2.161) 6.588 26.960 ( 1.690 -17.021 -1.283) 17.153 ======================= Grid point 121 (50/100) ======================= q-point: ( 0.44 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.403 ( 27.014 20.977 -1.558) 34.237 6.512 ( 13.523 6.555 -5.613) 16.042 6.568 ( 16.914 15.501 10.361) 25.174 6.930 ( -9.908 -12.120 8.299) 17.718 7.101 ( -5.766 5.922 4.318) 9.325 7.129 ( -11.528 5.667 2.951) 13.180 7.223 ( -3.441 -6.571 3.706) 8.291 7.298 ( -4.451 -10.422 5.699) 12.685 8.311 ( 13.127 10.651 -25.350) 30.470 8.513 ( 7.347 -1.547 -25.904) 26.970 8.616 ( -9.369 2.128 -26.741) 28.415 8.738 ( -6.427 -1.946 -25.241) 26.119 9.255 ( 4.548 13.523 -11.593) 18.384 9.327 ( -0.319 15.568 -6.743) 16.969 9.566 ( 19.513 -5.938 -17.274) 26.729 9.632 ( 9.397 -8.982 -0.140) 13.000 9.936 ( -5.358 10.085 12.835) 17.180 10.026 ( -8.554 13.273 -4.970) 16.554 10.140 ( 18.102 0.616 8.317) 19.930 10.305 ( 8.613 2.322 9.807) 13.257 10.581 ( 15.519 9.336 2.481) 18.280 11.103 ( 14.578 -17.584 12.939) 26.251 11.230 ( -25.174 10.344 14.693) 30.929 11.332 ( 6.696 10.061 12.309) 17.250 11.460 ( -7.149 3.391 10.676) 13.289 11.491 ( -3.174 -2.146 15.548) 16.014 11.666 ( 0.936 -4.971 8.646) 10.017 11.702 ( 2.901 -5.213 13.737) 14.977 11.726 ( 3.270 -0.200 8.795) 9.385 11.767 ( -3.586 -3.886 13.471) 14.471 11.918 ( -8.952 -15.705 22.002) 28.476 11.941 ( -16.391 -22.073 11.097) 29.648 12.793 ( 6.554 14.222 -11.101) 19.195 12.909 ( -4.690 5.128 -5.128) 8.637 12.982 ( -2.021 -1.214 -6.031) 6.476 12.993 ( -1.778 -1.615 -4.215) 4.852 13.231 ( 11.792 3.724 -9.696) 15.714 13.337 ( 7.234 -3.408 -10.053) 12.845 13.419 ( -5.072 -2.548 -8.258) 10.021 13.439 ( -1.693 0.100 -7.810) 7.992 13.788 ( 6.042 6.072 1.196) 8.649 13.905 ( 3.875 -4.497 -3.397) 6.840 13.969 ( -13.666 10.538 -3.258) 17.562 14.069 ( -9.383 4.911 -4.263) 11.417 14.407 ( 1.371 2.661 -0.955) 3.142 14.415 ( 0.127 2.327 1.062) 2.562 14.643 ( 1.961 -16.454 0.534) 16.579 14.655 ( 0.099 -15.358 -0.017) 15.359 15.026 ( 5.422 11.482 -7.843) 14.925 15.179 ( -2.297 5.279 -3.509) 6.742 15.266 ( -0.137 -1.715 -5.130) 5.411 15.463 ( -10.497 -12.290 -2.169) 16.308 15.716 ( 9.460 10.595 10.573) 17.707 15.872 ( 7.505 3.189 4.971) 9.550 16.092 ( -10.454 -1.125 14.185) 17.657 16.310 ( -19.405 -15.256 9.790) 26.554 17.493 ( 7.212 10.858 -3.572) 13.516 17.558 ( 1.732 10.937 -6.871) 13.032 17.772 ( 6.763 -12.004 -2.956) 14.092 17.876 ( -3.105 -16.102 -6.636) 17.691 18.046 ( 1.527 3.931 -0.953) 4.324 18.085 ( -1.676 4.912 -0.828) 5.256 18.120 ( 2.618 -2.126 0.221) 3.380 18.180 ( -2.598 -3.488 -0.330) 4.362 19.049 ( 6.391 19.062 -0.518) 20.112 19.158 ( -5.263 14.014 -0.224) 14.972 19.367 ( 1.351 -10.564 -4.592) 11.598 19.410 ( -2.429 -11.396 -2.404) 11.897 20.377 ( 13.004 4.623 -7.121) 15.530 20.470 ( 10.509 -4.532 -8.920) 14.510 20.600 ( -7.556 2.389 -10.329) 13.019 20.651 ( -5.371 -2.684 -8.241) 10.197 21.097 ( 12.158 13.247 9.701) 20.430 21.215 ( 8.829 6.409 11.061) 15.536 21.427 ( -4.321 -1.327 11.181) 12.061 21.494 ( -6.214 -3.036 12.508) 14.292 22.500 ( 4.642 6.372 0.211) 7.886 22.674 ( 14.594 -10.236 -1.033) 17.856 22.785 ( -21.739 14.082 -1.475) 25.943 23.093 ( -25.609 -15.558 -4.097) 30.243 26.654 ( 4.688 7.269 3.138) 9.201 26.704 ( -0.298 9.463 1.782) 9.634 26.844 ( 7.193 -11.524 0.099) 13.585 26.947 ( -3.060 -14.698 -1.067) 15.051 ======================= Grid point 162 (51/100) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.754 ( 0.000 0.000 64.107) 64.107 2.810 ( 0.000 0.000 65.010) 65.010 3.919 ( 0.000 0.000 92.713) 92.713 5.215 ( 0.000 0.000 -51.952) 51.952 5.284 ( 0.000 0.000 -52.031) 52.031 7.080 ( 0.000 0.000 2.520) 2.520 7.122 ( 0.000 0.000 1.033) 1.033 7.492 ( 0.000 0.000 3.232) 3.232 7.498 ( 0.000 0.000 -22.939) 22.939 7.658 ( 0.000 0.000 -61.277) 61.277 7.733 ( 0.000 0.000 14.237) 14.237 8.483 ( 0.000 0.000 -20.302) 20.302 8.748 ( 0.000 0.000 -18.425) 18.425 8.773 ( 0.000 0.000 -20.236) 20.236 9.505 ( 0.000 0.000 13.903) 13.903 9.643 ( 0.000 0.000 5.098) 5.098 9.784 ( 0.000 0.000 9.438) 9.438 9.892 ( 0.000 0.000 5.749) 5.749 9.954 ( 0.000 0.000 3.992) 3.992 9.969 ( 0.000 0.000 0.531) 0.531 10.180 ( 0.000 0.000 14.563) 14.563 10.319 ( 0.000 0.000 10.939) 10.939 10.501 ( 0.000 0.000 -23.242) 23.242 10.555 ( 0.000 0.000 -24.246) 24.246 10.751 ( 0.000 0.000 -9.966) 9.966 10.772 ( 0.000 0.000 -6.099) 6.099 11.371 ( 0.000 0.000 6.194) 6.194 11.532 ( 0.000 0.000 15.105) 15.105 11.587 ( 0.000 0.000 25.050) 25.050 11.607 ( 0.000 0.000 -4.842) 4.842 11.801 ( 0.000 0.000 1.126) 1.126 11.805 ( 0.000 0.000 20.162) 20.162 12.000 ( 0.000 0.000 3.174) 3.174 12.202 ( 0.000 0.000 13.273) 13.273 12.348 ( 0.000 0.000 10.663) 10.663 12.448 ( 0.000 0.000 -13.697) 13.697 13.195 ( 0.000 0.000 3.674) 3.674 13.269 ( 0.000 0.000 4.617) 4.617 13.401 ( 0.000 0.000 -3.210) 3.210 13.425 ( 0.000 0.000 -0.399) 0.399 13.775 ( 0.000 0.000 2.163) 2.163 14.081 ( 0.000 0.000 -9.650) 9.650 14.088 ( 0.000 0.000 2.869) 2.869 14.212 ( 0.000 0.000 2.768) 2.768 14.718 ( 0.000 0.000 40.213) 40.213 15.113 ( 0.000 0.000 27.424) 27.424 15.147 ( 0.000 0.000 -16.296) 16.296 15.205 ( 0.000 0.000 -9.808) 9.808 15.497 ( 0.000 0.000 0.688) 0.688 15.553 ( 0.000 0.000 26.390) 26.390 15.694 ( 0.000 0.000 5.067) 5.067 16.069 ( 0.000 0.000 8.666) 8.666 16.608 ( 0.000 0.000 -1.045) 1.045 16.632 ( 0.000 0.000 -28.377) 28.377 16.796 ( 0.000 0.000 -0.528) 0.528 17.104 ( 0.000 0.000 0.753) 0.753 17.265 ( 0.000 0.000 -26.344) 26.344 17.483 ( 0.000 0.000 -13.051) 13.051 17.808 ( 0.000 0.000 0.525) 0.525 17.872 ( 0.000 0.000 -4.215) 4.215 18.123 ( 0.000 0.000 -12.746) 12.746 18.166 ( 0.000 0.000 2.885) 2.885 18.179 ( 0.000 0.000 -16.873) 16.873 18.250 ( 0.000 0.000 -0.032) 0.032 18.963 ( 0.000 0.000 7.520) 7.520 19.363 ( 0.000 0.000 -14.289) 14.289 19.644 ( 0.000 0.000 7.171) 7.171 19.980 ( 0.000 0.000 -8.304) 8.304 20.350 ( 0.000 0.000 2.260) 2.260 20.444 ( 0.000 0.000 1.770) 1.770 20.457 ( 0.000 0.000 -2.369) 2.369 20.672 ( 0.000 0.000 -9.514) 9.514 20.785 ( 0.000 0.000 7.704) 7.704 21.028 ( 0.000 0.000 -3.188) 3.188 21.107 ( 0.000 0.000 8.066) 8.066 21.230 ( 0.000 0.000 2.004) 2.004 21.584 ( 0.000 0.000 19.580) 19.580 22.207 ( 0.000 0.000 -9.815) 9.815 23.468 ( 0.000 0.000 12.722) 12.722 23.819 ( 0.000 0.000 -4.414) 4.414 26.117 ( 0.000 0.000 6.932) 6.932 26.381 ( 0.000 0.000 -5.247) 5.247 27.254 ( 0.000 0.000 7.466) 7.466 27.615 ( 0.000 0.000 -8.432) 8.432 ======================= Grid point 163 (52/100) ======================= q-point: ( 0.11 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.786 ( 7.864 0.000 62.486) 62.979 2.887 ( 13.347 0.000 60.096) 61.561 4.658 ( 62.649 0.000 78.094) 100.117 5.247 ( 3.068 0.000 -50.000) 50.094 5.328 ( 4.432 0.000 -55.196) 55.373 7.024 ( -6.010 0.000 2.884) 6.667 7.090 ( -2.918 0.000 0.726) 3.007 7.482 ( -1.308 0.000 -3.591) 3.821 7.562 ( 5.133 0.000 -11.069) 12.201 7.647 ( -8.757 0.000 8.919) 12.500 7.994 ( 29.711 0.000 -62.139) 68.877 8.209 ( -23.875 0.000 -16.248) 28.880 8.663 ( -6.791 0.000 -14.555) 16.061 8.729 ( -1.508 0.000 -18.556) 18.617 9.392 ( -8.211 0.000 8.615) 11.901 9.559 ( -11.551 0.000 1.113) 11.604 9.814 ( -4.430 0.000 0.463) 4.454 9.863 ( 1.668 0.000 11.924) 12.040 9.906 ( 10.916 0.000 7.789) 13.410 10.060 ( 1.705 0.000 -2.079) 2.689 10.210 ( -11.610 0.000 -13.028) 17.450 10.381 ( 5.193 0.000 9.178) 10.546 10.501 ( 22.552 0.000 16.331) 27.845 10.802 ( 28.263 0.000 -16.336) 32.644 11.061 ( 25.878 0.000 -9.865) 27.694 11.140 ( 19.012 0.000 -4.683) 19.580 11.473 ( 9.760 0.000 4.644) 10.808 11.537 ( 0.712 0.000 11.987) 12.008 11.632 ( 5.918 0.000 16.442) 17.474 11.695 ( 9.371 0.000 -3.227) 9.911 11.850 ( 4.283 0.000 -0.515) 4.314 11.859 ( 5.733 0.000 19.608) 20.429 12.050 ( 5.402 0.000 5.038) 7.386 12.185 ( -0.406 0.000 12.322) 12.329 12.405 ( 5.698 0.000 7.633) 9.525 12.502 ( 5.526 0.000 -12.665) 13.818 13.076 ( -9.280 0.000 7.864) 12.164 13.233 ( -4.049 0.000 2.629) 4.827 13.349 ( -6.106 0.000 -0.486) 6.125 13.386 ( -2.036 0.000 -0.285) 2.056 13.800 ( 2.577 0.000 4.529) 5.211 13.859 ( -19.000 0.000 10.838) 21.874 14.147 ( 4.756 0.000 -8.574) 9.805 14.326 ( -5.276 0.000 9.624) 10.975 14.706 ( 10.679 0.000 18.754) 21.581 15.041 ( -10.393 0.000 -14.372) 17.736 15.042 ( -7.230 0.000 23.066) 24.172 15.208 ( 0.191 0.000 -8.419) 8.421 15.454 ( -4.298 0.000 0.158) 4.301 15.618 ( 3.975 0.000 24.091) 24.417 15.685 ( -0.587 0.000 6.671) 6.697 15.841 ( -19.192 0.000 -6.882) 20.389 16.419 ( -13.574 0.000 7.199) 15.365 16.564 ( -6.760 0.000 -27.291) 28.116 16.998 ( 15.184 0.000 -0.511) 15.193 17.075 ( -0.676 0.000 -4.559) 4.609 17.328 ( 3.882 0.000 -11.637) 12.268 17.676 ( 13.596 0.000 -12.599) 18.536 17.760 ( -4.680 0.000 1.196) 4.830 17.832 ( -3.989 0.000 -3.785) 5.498 18.099 ( -1.345 0.000 -15.408) 15.467 18.153 ( -2.243 0.000 -17.499) 17.642 18.172 ( 0.473 0.000 2.619) 2.662 18.246 ( -0.400 0.000 0.087) 0.409 18.728 ( -20.888 0.000 8.916) 22.712 19.239 ( -13.744 0.000 -15.477) 20.699 19.475 ( -13.161 0.000 12.013) 17.819 19.931 ( -4.085 0.000 -11.169) 11.893 20.333 ( -1.731 0.000 1.822) 2.513 20.410 ( -4.410 0.000 -1.162) 4.560 20.436 ( -0.877 0.000 2.360) 2.518 20.613 ( -5.789 0.000 -5.191) 7.775 20.804 ( 1.715 0.000 6.049) 6.287 21.007 ( -1.928 0.000 -2.713) 3.328 21.214 ( 10.097 0.000 6.586) 12.055 21.280 ( 0.675 0.000 5.681) 5.721 21.748 ( 17.068 0.000 10.146) 19.856 22.084 ( -9.321 0.000 0.089) 9.322 23.395 ( -6.680 0.000 13.280) 14.866 23.875 ( 3.324 0.000 -12.252) 12.695 26.194 ( 7.586 0.000 7.748) 10.844 26.462 ( 8.390 0.000 -3.751) 9.191 27.102 ( -6.409 0.000 18.518) 19.596 27.870 ( 14.757 0.000 -21.279) 25.895 ======================= Grid point 164 (53/100) ======================= q-point: ( 0.22 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.227 ( 35.014 0.000 40.330) 53.409 3.258 ( 23.913 0.000 50.298) 55.693 5.321 ( 3.798 0.000 -42.923) 43.090 5.453 ( 8.311 0.000 -57.307) 57.906 6.076 ( 78.416 0.000 62.973) 100.571 6.833 ( -13.638 0.000 3.945) 14.197 7.024 ( -3.396 0.000 -1.220) 3.608 7.319 ( -15.296 0.000 -6.656) 16.681 7.400 ( -15.719 0.000 -1.567) 15.797 7.525 ( -15.360 0.000 -14.197) 20.916 7.715 ( -23.630 0.000 -13.717) 27.323 8.584 ( 15.875 0.000 -26.542) 30.927 8.736 ( 10.583 0.000 -12.638) 16.484 8.822 ( 28.681 0.000 -34.625) 44.960 9.219 ( -9.244 0.000 3.588) 9.916 9.290 ( -13.216 0.000 1.789) 13.336 9.829 ( -0.960 0.000 -2.175) 2.377 9.923 ( 6.497 0.000 -5.469) 8.493 9.979 ( 8.798 0.000 19.340) 21.247 10.163 ( 14.833 0.000 2.628) 15.064 10.331 ( 9.969 0.000 -0.718) 9.995 10.476 ( 3.810 0.000 10.736) 11.392 10.955 ( 22.893 0.000 18.736) 29.583 11.354 ( 4.268 0.000 9.282) 10.216 11.414 ( 27.572 0.000 -7.391) 28.545 11.574 ( 6.495 0.000 5.979) 8.828 11.637 ( 29.324 0.000 -10.154) 31.032 11.724 ( 15.029 0.000 -1.186) 15.076 11.858 ( 14.590 0.000 -2.669) 14.832 11.903 ( 7.947 0.000 -0.585) 7.968 12.009 ( 16.541 0.000 -2.107) 16.675 12.022 ( 7.984 0.000 13.780) 15.926 12.212 ( 4.942 0.000 8.639) 9.952 12.236 ( 14.229 0.000 6.239) 15.536 12.568 ( 10.567 0.000 3.692) 11.193 12.654 ( 9.513 0.000 -10.500) 14.168 12.933 ( -3.799 0.000 16.685) 17.112 13.105 ( -7.699 0.000 2.574) 8.118 13.252 ( -38.539 0.000 25.057) 45.969 13.254 ( -3.420 0.000 -3.621) 4.981 13.343 ( -4.203 0.000 6.915) 8.092 13.853 ( 1.909 0.000 7.365) 7.609 14.130 ( -13.318 0.000 1.136) 13.366 14.190 ( -1.639 0.000 -3.264) 3.653 14.697 ( -21.041 0.000 -14.843) 25.749 14.833 ( -14.074 0.000 11.816) 18.376 15.042 ( 12.373 0.000 1.384) 12.451 15.172 ( -6.289 0.000 -9.354) 11.272 15.325 ( -9.368 0.000 -4.650) 10.458 15.464 ( -13.056 0.000 -11.533) 17.420 15.696 ( 3.728 0.000 19.528) 19.880 15.699 ( 2.965 0.000 10.192) 10.615 16.209 ( -5.386 0.000 9.706) 11.100 16.384 ( -10.848 0.000 -21.737) 24.294 17.069 ( -0.560 0.000 -1.795) 1.881 17.268 ( 10.545 0.000 -5.068) 11.699 17.388 ( 2.339 0.000 3.052) 3.845 17.636 ( -7.654 0.000 2.261) 7.980 17.719 ( -7.418 0.000 -3.149) 8.058 17.836 ( 1.631 0.000 -8.003) 8.167 18.078 ( -2.630 0.000 -17.524) 17.720 18.152 ( 2.917 0.000 -22.012) 22.204 18.182 ( 0.562 0.000 2.179) 2.251 18.236 ( -0.616 0.000 0.419) 0.744 18.288 ( -20.271 0.000 11.320) 23.218 18.853 ( -22.000 0.000 -12.010) 25.064 19.279 ( -6.619 0.000 10.691) 12.574 19.817 ( -7.814 0.000 -13.806) 15.863 20.281 ( -3.543 0.000 0.811) 3.634 20.306 ( -5.627 0.000 0.048) 5.628 20.394 ( -3.801 0.000 3.101) 4.906 20.501 ( -4.203 0.000 -1.594) 4.495 20.841 ( 1.853 0.000 3.635) 4.080 20.964 ( -2.193 0.000 -1.528) 2.673 21.201 ( -5.023 0.000 11.704) 12.737 21.416 ( 4.010 0.000 2.515) 4.733 21.977 ( 2.347 0.000 7.730) 8.078 22.150 ( 20.445 0.000 -1.688) 20.514 23.250 ( -6.930 0.000 14.340) 15.927 23.882 ( -3.047 0.000 -17.432) 17.696 26.392 ( 11.906 0.000 9.693) 15.353 26.700 ( 15.120 0.000 -0.481) 15.127 27.063 ( 1.418 0.000 19.502) 19.553 28.043 ( 2.674 0.000 -24.681) 24.826 ======================= Grid point 165 (54/100) ======================= q-point: ( 0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.797 ( 30.562 0.000 38.295) 48.996 4.050 ( 46.827 0.000 17.661) 50.047 5.330 ( -5.682 0.000 -23.837) 24.505 5.648 ( 10.969 0.000 -51.506) 52.661 6.540 ( -12.627 0.000 -2.801) 12.933 6.908 ( -26.303 0.000 -12.645) 29.185 6.955 ( -5.497 0.000 -8.349) 9.996 7.001 ( -29.927 0.000 -18.032) 34.940 7.094 ( -12.740 0.000 -6.687) 14.388 7.335 ( -15.044 0.000 -13.666) 20.324 7.651 ( 77.682 0.000 50.474) 92.639 8.766 ( 3.922 0.000 -11.940) 12.568 8.842 ( 3.502 0.000 -12.074) 12.572 9.049 ( -7.334 0.000 2.794) 7.848 9.082 ( -8.007 0.000 1.542) 8.154 9.568 ( 32.272 0.000 -20.092) 38.015 9.924 ( 12.810 0.000 10.634) 16.649 10.170 ( 9.957 0.000 23.207) 25.253 10.192 ( 13.514 0.000 6.545) 15.016 10.452 ( 11.304 0.000 -1.384) 11.388 10.514 ( -0.104 0.000 15.388) 15.389 10.639 ( 28.985 0.000 -20.022) 35.228 11.353 ( 11.372 0.000 12.055) 16.572 11.422 ( 8.352 0.000 6.263) 10.439 11.614 ( 4.430 0.000 2.818) 5.250 11.781 ( 3.161 0.000 -2.275) 3.895 11.952 ( 10.932 0.000 3.059) 11.352 11.999 ( -4.984 0.000 -4.617) 6.794 12.075 ( -0.771 0.000 5.294) 5.350 12.146 ( 19.104 0.000 -3.867) 19.491 12.270 ( 24.707 0.000 -5.760) 25.370 12.361 ( -34.853 0.000 19.990) 40.179 12.409 ( 21.669 0.000 -6.389) 22.591 12.476 ( 10.693 0.000 16.860) 19.964 12.603 ( 21.199 0.000 3.209) 21.441 12.776 ( 8.328 0.000 6.192) 10.378 12.866 ( 12.963 0.000 -6.734) 14.608 12.920 ( 2.005 0.000 22.879) 22.967 13.025 ( 2.413 0.000 0.812) 2.546 13.207 ( -0.922 0.000 -5.784) 5.857 13.402 ( 8.989 0.000 9.436) 13.032 13.651 ( -36.461 0.000 -21.674) 42.417 13.831 ( -5.099 0.000 7.294) 8.900 14.084 ( -7.571 0.000 4.830) 8.981 14.275 ( -18.892 0.000 -0.254) 18.893 14.499 ( -19.417 0.000 -1.062) 19.446 14.986 ( -7.496 0.000 -12.718) 14.763 15.059 ( -18.494 0.000 -14.599) 23.562 15.119 ( -8.832 0.000 2.909) 9.299 15.187 ( -17.181 0.000 -7.886) 18.904 15.812 ( 7.946 0.000 10.850) 13.449 15.895 ( 17.339 0.000 16.053) 23.629 16.188 ( -7.962 0.000 -8.859) 11.912 16.317 ( 15.152 0.000 5.349) 16.068 17.025 ( -4.434 0.000 4.548) 6.352 17.352 ( -0.778 0.000 -3.868) 3.945 17.479 ( 6.792 0.000 2.807) 7.349 17.481 ( -7.497 0.000 1.799) 7.710 17.554 ( -8.885 0.000 -2.673) 9.278 17.748 ( -8.471 0.000 -9.046) 12.393 18.006 ( -5.058 0.000 -7.953) 9.425 18.051 ( -5.600 0.000 -3.287) 6.493 18.147 ( -3.893 0.000 -13.626) 14.171 18.193 ( 0.503 0.000 1.825) 1.893 18.224 ( -0.625 0.000 0.834) 1.042 18.493 ( -13.019 0.000 -14.241) 19.295 19.214 ( 0.035 0.000 7.512) 7.512 19.630 ( -10.788 0.000 -10.989) 15.399 20.199 ( -4.176 0.000 0.318) 4.188 20.212 ( -3.965 0.000 -0.196) 3.970 20.318 ( -2.712 0.000 3.320) 4.287 20.440 ( -3.052 0.000 -1.693) 3.490 20.873 ( 1.376 0.000 2.031) 2.454 20.929 ( -1.326 0.000 -0.319) 1.364 21.118 ( -2.484 0.000 13.111) 13.345 21.361 ( -6.841 0.000 6.650) 9.540 22.153 ( 12.418 0.000 3.595) 12.928 22.474 ( 10.423 0.000 -9.073) 13.819 23.179 ( 1.295 0.000 13.502) 13.564 23.763 ( -8.713 0.000 -15.003) 17.350 26.633 ( 12.164 0.000 12.426) 17.389 26.963 ( 7.110 0.000 16.070) 17.573 27.167 ( 11.896 0.000 -0.999) 11.938 27.994 ( -7.081 0.000 -20.954) 22.118 ======================= Grid point 166 (55/100) ======================= q-point: ( 0.44 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.424 ( 32.517 0.000 25.114) 41.086 4.988 ( 47.247 0.000 0.189) 47.247 5.015 ( -25.687 0.000 6.481) 26.492 5.724 ( -16.042 0.000 -26.874) 31.298 6.352 ( -12.096 0.000 -23.165) 26.133 6.476 ( 6.301 0.000 -18.887) 19.910 6.537 ( -19.690 0.000 -27.102) 33.499 6.708 ( -15.222 0.000 -20.262) 25.343 7.024 ( 2.047 0.000 -5.909) 6.254 7.118 ( -7.598 0.000 -10.081) 12.623 8.813 ( 1.846 0.000 -13.246) 13.374 8.844 ( -0.280 0.000 -13.483) 13.486 8.956 ( -1.988 0.000 2.315) 3.052 8.970 ( -3.367 0.000 1.470) 3.674 9.081 ( 61.410 0.000 40.273) 73.437 9.798 ( -8.906 0.000 17.785) 19.890 10.263 ( 15.754 0.000 13.592) 20.807 10.349 ( 7.946 0.000 23.115) 24.443 10.409 ( 9.001 0.000 11.841) 14.873 10.470 ( -4.335 0.000 20.043) 20.506 10.610 ( 4.917 0.000 4.285) 6.522 11.009 ( -33.720 0.000 20.233) 39.324 11.377 ( 21.689 0.000 -15.860) 26.869 11.592 ( -3.827 0.000 -4.045) 5.568 11.698 ( 4.133 0.000 -0.535) 4.167 11.760 ( 19.774 0.000 -13.651) 24.029 11.768 ( -2.696 0.000 -3.328) 4.283 12.077 ( 11.912 0.000 1.061) 11.959 12.151 ( 9.193 0.000 9.404) 13.151 12.189 ( -4.918 0.000 -4.261) 6.507 12.289 ( -3.234 0.000 5.533) 6.409 12.634 ( -28.786 0.000 -17.103) 33.483 12.652 ( 13.633 0.000 -10.291) 17.081 12.717 ( 2.979 0.000 7.914) 8.456 12.745 ( 7.498 0.000 -12.202) 14.322 12.888 ( -18.563 0.000 -6.111) 19.543 12.902 ( 11.997 0.000 3.910) 12.618 13.103 ( -1.343 0.000 -2.534) 2.868 13.155 ( 20.039 0.000 28.619) 34.937 13.240 ( 15.474 0.000 -2.197) 15.629 13.289 ( 12.611 0.000 -0.678) 12.630 13.544 ( -10.743 0.000 19.186) 21.989 13.680 ( -5.439 0.000 7.197) 9.021 13.910 ( -16.528 0.000 12.273) 20.586 14.098 ( 12.331 0.000 1.120) 12.382 14.237 ( 4.460 0.000 -19.800) 20.296 14.599 ( -30.133 0.000 -4.453) 30.460 14.612 ( -25.347 0.000 -21.048) 32.947 14.957 ( 0.015 0.000 -3.984) 3.984 15.014 ( -5.514 0.000 -2.779) 6.175 15.971 ( 7.243 0.000 8.992) 11.546 16.078 ( -4.318 0.000 3.506) 5.562 16.281 ( 19.721 0.000 10.334) 22.264 16.553 ( -1.718 0.000 3.888) 4.251 16.988 ( 8.647 0.000 5.961) 10.503 17.255 ( -10.746 0.000 0.700) 10.769 17.375 ( -2.486 0.000 -0.312) 2.505 17.405 ( -5.389 0.000 -2.025) 5.757 17.636 ( 5.940 0.000 -0.389) 5.953 17.672 ( 5.005 0.000 -11.014) 12.098 17.804 ( -11.298 0.000 -7.436) 13.525 17.896 ( -10.005 0.000 -3.086) 10.470 18.178 ( 5.659 0.000 -14.598) 15.657 18.202 ( 0.486 0.000 1.526) 1.602 18.212 ( -0.545 0.000 1.210) 1.327 18.311 ( -7.493 0.000 -15.650) 17.352 19.273 ( 5.615 0.000 2.910) 6.324 19.423 ( -9.566 0.000 -3.950) 10.350 20.144 ( -1.287 0.000 -0.081) 1.289 20.151 ( -1.943 0.000 -0.389) 1.981 20.308 ( 1.627 0.000 1.724) 2.371 20.368 ( -3.970 0.000 -0.595) 4.014 20.895 ( 0.879 0.000 1.117) 1.422 20.910 ( -0.762 0.000 0.485) 0.903 21.123 ( 2.984 0.000 12.117) 12.479 21.221 ( -6.599 0.000 9.754) 11.776 22.382 ( 10.126 0.000 -1.080) 10.183 22.526 ( -3.773 0.000 -6.007) 7.094 23.318 ( 11.397 0.000 2.878) 11.755 23.557 ( -11.949 0.000 -7.975) 14.366 26.846 ( 9.056 0.000 15.879) 18.280 26.974 ( -3.724 0.000 19.714) 20.062 27.482 ( 17.148 0.000 -11.797) 20.814 27.788 ( -13.540 0.000 -16.171) 21.091 ======================= Grid point 171 (56/100) ======================= q-point: ( 0.00 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.702 ( 0.000 5.380 62.103) 62.336 2.938 ( 0.000 12.769 60.874) 62.199 4.657 ( 0.000 61.950 77.830) 99.475 5.253 ( 0.000 3.001 -55.825) 55.906 5.310 ( 0.000 2.683 -50.311) 50.383 7.157 ( 0.000 8.499 -2.439) 8.842 7.195 ( 0.000 4.243 1.411) 4.471 7.442 ( 0.000 -4.834 4.436) 6.561 7.444 ( 0.000 -3.579 -2.778) 4.530 7.753 ( 0.000 -0.125 4.054) 4.056 8.001 ( 0.000 31.072 -61.861) 69.226 8.320 ( 0.000 -16.506 -18.370) 24.697 8.678 ( 0.000 -4.948 -18.799) 19.439 8.682 ( 0.000 -7.937 -19.704) 21.242 9.432 ( 0.000 -17.769 8.972) 19.906 9.518 ( 0.000 -2.536 8.823) 9.180 9.608 ( 0.000 -0.470 -0.394) 0.613 9.703 ( 0.000 -14.998 1.388) 15.062 9.971 ( 0.000 1.909 5.452) 5.777 10.021 ( 0.000 5.118 1.453) 5.321 10.164 ( 0.000 -18.250 -14.525) 23.324 10.315 ( 0.000 9.021 7.832) 11.947 10.496 ( 0.000 13.585 6.897) 15.235 10.971 ( 0.000 35.320 -7.841) 36.180 11.069 ( 0.000 23.984 -4.028) 24.320 11.159 ( 0.000 21.154 -6.881) 22.245 11.479 ( 0.000 11.043 6.243) 12.686 11.532 ( 0.000 0.648 13.685) 13.700 11.618 ( 0.000 5.094 17.441) 18.170 11.659 ( 0.000 4.892 -2.895) 5.684 11.840 ( 0.000 4.096 16.491) 16.992 11.989 ( 0.000 16.482 0.092) 16.483 12.142 ( 0.000 7.589 3.065) 8.185 12.231 ( 0.000 -6.052 -1.381) 6.207 12.272 ( 0.000 13.592 15.817) 20.855 12.586 ( 0.000 9.791 0.499) 9.804 13.082 ( 0.000 -7.606 3.813) 8.508 13.290 ( 0.000 -1.228 2.572) 2.850 13.316 ( 0.000 -8.537 -1.073) 8.604 13.388 ( 0.000 -2.682 -1.592) 3.119 13.755 ( 0.000 -2.373 2.051) 3.136 13.965 ( 0.000 -5.161 3.321) 6.137 14.016 ( 0.000 -8.173 9.321) 12.397 14.296 ( 0.000 3.677 -6.817) 7.745 14.684 ( 0.000 -2.248 37.744) 37.811 14.894 ( 0.000 -17.710 18.921) 25.916 15.038 ( 0.000 -10.644 -16.142) 19.336 15.156 ( 0.000 -3.176 -9.010) 9.553 15.557 ( 0.000 -3.138 23.256) 23.467 15.633 ( 0.000 9.179 -1.805) 9.355 15.753 ( 0.000 8.037 1.157) 8.120 16.215 ( 0.000 9.940 10.370) 14.365 16.253 ( 0.000 -23.462 -22.952) 32.822 16.516 ( 0.000 -8.398 -0.233) 8.402 16.712 ( 0.000 -13.476 -0.559) 13.487 17.043 ( 0.000 -4.941 -1.707) 5.227 17.220 ( 0.000 -12.208 -22.916) 25.964 17.562 ( 0.000 10.221 -15.528) 18.590 17.755 ( 0.000 -4.026 0.581) 4.068 17.890 ( 0.000 1.657 -2.466) 2.971 18.069 ( 0.000 -2.078 -4.847) 5.274 18.137 ( 0.000 -2.081 -6.937) 7.242 18.251 ( 0.000 3.757 -4.184) 5.623 18.295 ( 0.000 1.719 -7.751) 7.940 18.972 ( 0.000 -0.154 7.912) 7.913 19.372 ( 0.000 -3.529 -10.905) 11.462 19.712 ( 0.000 6.942 7.070) 9.909 20.028 ( 0.000 3.081 -6.098) 6.832 20.194 ( 0.000 -9.366 -1.467) 9.480 20.263 ( 0.000 -16.775 -2.272) 16.928 20.448 ( 0.000 -0.870 0.739) 1.142 20.546 ( 0.000 -14.766 -3.179) 15.104 20.656 ( 0.000 -6.736 6.096) 9.085 20.961 ( 0.000 0.154 -7.246) 7.248 21.129 ( 0.000 0.686 6.240) 6.278 21.244 ( 0.000 -0.321 0.220) 0.389 21.880 ( 0.000 23.763 18.904) 30.366 22.508 ( 0.000 25.330 -10.262) 27.330 23.492 ( 0.000 2.116 13.066) 13.236 23.959 ( 0.000 11.884 -12.166) 17.007 26.141 ( 0.000 2.487 6.546) 7.002 26.379 ( 0.000 -0.196 -4.327) 4.331 27.204 ( 0.000 -4.864 6.623) 8.218 27.449 ( 0.000 -14.707 -1.160) 14.753 ======================= Grid point 172 (57/100) ======================= q-point: ( 0.11 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.624 ( 8.991 6.349 54.522) 55.622 3.408 ( 28.635 27.871 53.146) 66.493 5.081 ( 23.681 22.199 20.004) 38.128 5.104 ( 15.864 15.883 -3.638) 22.741 5.611 ( 17.641 16.878 -48.128) 53.966 7.124 ( -3.740 9.648 -0.275) 10.351 7.171 ( -2.246 5.436 1.161) 5.995 7.445 ( -0.510 -2.972 1.654) 3.439 7.535 ( 6.809 -1.483 -4.956) 8.551 7.722 ( -5.295 3.911 4.090) 7.750 8.097 ( -9.247 -2.339 -28.739) 30.280 8.274 ( 13.708 16.634 -45.350) 50.212 8.593 ( -5.155 -5.176 -14.076) 15.859 8.662 ( -0.937 -4.747 -18.926) 19.535 9.195 ( -8.366 -14.770 7.060) 18.385 9.367 ( -11.954 -14.628 -2.698) 19.083 9.700 ( -2.469 -3.488 2.514) 4.958 9.865 ( 11.490 0.481 7.124) 13.528 9.996 ( 8.030 -1.712 4.463) 9.345 10.068 ( 1.355 2.796 0.283) 3.120 10.145 ( -5.118 -3.588 -10.512) 12.230 10.374 ( 5.485 -4.423 -3.852) 8.030 10.713 ( 21.831 15.719 18.118) 32.434 10.941 ( 8.057 21.598 -1.362) 23.092 11.233 ( 13.490 16.315 -4.012) 21.547 11.376 ( 9.958 11.965 3.171) 15.886 11.503 ( 3.557 2.100 11.909) 12.605 11.585 ( 4.554 4.522 11.765) 13.401 11.709 ( 9.675 9.751 -2.003) 13.882 11.783 ( 14.034 9.372 1.645) 16.955 11.902 ( 6.240 5.930 12.006) 14.773 12.009 ( 1.319 13.143 -3.029) 13.551 12.125 ( 0.422 4.815 3.899) 6.210 12.254 ( 4.486 3.678 10.229) 11.760 12.383 ( 9.272 9.594 2.831) 13.639 12.650 ( 5.929 10.551 -0.732) 12.125 12.963 ( -8.788 -7.246 4.375) 12.201 13.138 ( -9.478 -10.603 1.518) 14.303 13.373 ( 0.283 3.542 0.464) 3.584 13.403 ( -0.651 -0.971 1.272) 1.728 13.791 ( -3.194 -2.920 5.789) 7.228 13.807 ( -5.257 -2.530 7.652) 9.622 14.174 ( 5.946 1.640 -0.626) 6.200 14.354 ( -6.661 2.494 5.143) 8.777 14.507 ( 0.939 -17.093 21.243) 27.282 14.822 ( -5.734 -12.123 12.331) 18.218 15.027 ( -2.398 -10.241 -9.875) 14.427 15.190 ( 1.483 -0.597 -6.600) 6.791 15.541 ( -4.897 2.980 13.210) 14.400 15.621 ( -2.438 1.117 -0.030) 2.682 15.667 ( -8.034 2.142 3.641) 9.077 15.931 ( -16.500 2.646 -2.412) 16.884 16.226 ( -8.309 -18.598 -22.620) 30.441 16.477 ( -0.324 -0.337 10.217) 10.227 16.876 ( 12.431 -10.717 1.084) 16.449 17.102 ( 6.401 -2.382 0.258) 6.834 17.266 ( -1.569 -10.260 -20.745) 23.197 17.628 ( 6.919 0.442 -6.242) 9.329 17.739 ( -1.272 -1.539 -2.302) 3.047 17.866 ( -2.228 2.606 -2.720) 4.377 18.053 ( -1.230 -1.855 -7.174) 7.511 18.124 ( -1.042 -1.302 -7.762) 7.939 18.255 ( 0.376 3.992 -5.324) 6.665 18.279 ( -1.869 0.863 -6.561) 6.877 18.735 ( -20.484 -0.058 7.152) 21.696 19.164 ( -18.530 -8.792 -11.004) 23.276 19.554 ( -13.026 7.121 10.718) 18.310 19.998 ( -4.344 4.683 -10.155) 11.997 20.185 ( -0.477 -11.372 1.713) 11.510 20.305 ( 1.827 -3.551 -4.196) 5.793 20.449 ( 0.531 -1.970 2.296) 3.072 20.570 ( 0.476 -9.057 -3.370) 9.675 20.682 ( 2.497 -7.336 5.205) 9.335 20.917 ( -3.336 -1.223 -3.482) 4.974 21.215 ( 9.196 -0.670 5.634) 10.805 21.368 ( 8.074 1.890 0.132) 8.294 21.933 ( 6.896 18.184 14.651) 24.349 22.384 ( -10.832 25.674 -3.460) 28.079 23.414 ( -7.274 1.718 13.441) 15.379 23.963 ( -0.631 7.691 -15.972) 17.738 26.212 ( 6.923 1.827 7.264) 10.200 26.456 ( 7.937 -0.562 -3.192) 8.574 27.047 ( -6.236 -5.404 17.814) 19.632 27.707 ( 14.697 -14.685 -15.103) 25.686 ======================= Grid point 173 (58/100) ======================= q-point: ( 0.22 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.091 ( 35.717 8.508 32.922) 49.315 3.932 ( 26.137 41.889 44.824) 66.686 5.111 ( 5.588 -7.224 -53.372) 54.147 5.911 ( 12.056 30.593 -43.555) 54.575 6.244 ( 68.401 18.162 58.956) 92.110 6.978 ( -11.771 13.259 3.503) 18.073 7.124 ( -2.317 7.622 -0.394) 7.976 7.345 ( -11.400 2.520 -6.242) 13.239 7.488 ( -16.777 6.063 -2.284) 17.984 7.547 ( -10.570 5.105 -10.167) 15.529 7.747 ( -18.977 2.247 -14.022) 23.702 8.529 ( 9.771 -5.750 -14.325) 18.268 8.668 ( 3.935 -6.540 -12.007) 14.228 8.881 ( 24.448 5.307 -30.955) 39.800 9.121 ( 5.086 -5.215 -2.979) 7.870 9.215 ( -3.642 -10.143 -0.979) 10.821 9.720 ( 4.156 -6.351 6.242) 9.827 9.908 ( -6.050 0.350 -4.000) 7.261 10.020 ( 6.604 4.545 0.677) 8.045 10.170 ( 13.026 -3.564 -1.327) 13.570 10.290 ( 10.271 0.448 5.181) 11.513 10.495 ( 5.037 -1.883 0.852) 5.445 11.134 ( 19.563 12.333 19.171) 30.039 11.267 ( 18.600 0.617 1.338) 18.658 11.467 ( 5.145 1.591 10.685) 11.966 11.541 ( 14.014 -10.749 1.465) 17.722 11.656 ( 8.824 5.460 7.574) 12.847 11.715 ( 12.393 11.066 1.321) 16.667 11.919 ( 9.286 1.353 4.128) 10.252 12.015 ( 3.487 4.867 -3.476) 6.923 12.119 ( 16.330 9.391 3.131) 19.096 12.167 ( 15.283 12.227 -3.120) 19.819 12.197 ( 9.815 8.216 0.388) 12.806 12.440 ( 13.422 9.076 6.731) 17.545 12.583 ( 9.977 7.600 -0.358) 12.547 12.786 ( 6.334 9.139 -4.641) 12.049 12.834 ( -2.470 -5.439 10.196) 11.817 12.966 ( -6.191 -9.763 3.886) 12.196 13.280 ( -26.763 3.578 18.646) 32.813 13.352 ( -8.762 7.571 4.363) 12.374 13.393 ( -3.460 1.513 4.505) 5.878 13.883 ( 2.733 2.554 6.942) 7.885 14.119 ( -11.017 -0.424 3.534) 11.578 14.262 ( -0.002 6.118 -1.317) 6.258 14.429 ( -13.843 -19.547 -1.008) 23.974 14.900 ( -8.950 -5.312 -3.380) 10.943 14.970 ( 12.983 -6.448 2.811) 14.766 15.141 ( -7.195 -0.932 -8.797) 11.403 15.256 ( -20.821 -2.720 -5.326) 21.663 15.462 ( -4.217 -4.219 3.029) 6.690 15.526 ( -8.645 -8.043 4.759) 12.731 15.781 ( -3.439 4.953 -1.671) 6.257 16.117 ( -1.723 -13.223 -10.951) 17.255 16.453 ( -1.820 7.708 8.499) 11.617 17.067 ( 0.456 -2.194 -0.861) 2.401 17.131 ( 1.932 -12.055 -7.282) 14.215 17.310 ( 7.413 -5.877 3.761) 10.180 17.658 ( -2.889 0.986 1.430) 3.371 17.744 ( -2.308 0.378 1.586) 2.826 17.832 ( -0.166 0.578 -8.270) 8.292 18.021 ( -2.197 -3.226 -9.010) 9.819 18.107 ( -1.767 -0.426 -11.090) 11.238 18.152 ( -12.054 -2.941 -0.095) 12.408 18.288 ( 1.898 2.481 -9.482) 9.984 18.367 ( -11.649 2.328 2.395) 12.118 18.769 ( -18.641 -6.995 -11.944) 23.218 19.309 ( -10.416 4.268 12.359) 16.717 19.857 ( -9.483 2.361 -12.825) 16.124 20.167 ( -1.439 -7.261 3.567) 8.216 20.316 ( -0.082 4.296 -4.396) 6.147 20.448 ( -1.432 1.248 2.455) 3.104 20.527 ( -3.978 0.346 -1.693) 4.337 20.743 ( 3.436 -6.744 3.976) 8.549 20.870 ( -0.992 -3.812 -0.059) 3.940 21.378 ( 1.552 7.502 7.414) 10.661 21.475 ( 5.361 5.182 2.416) 7.838 22.167 ( 1.805 13.679 2.778) 14.075 22.190 ( 7.174 9.959 3.084) 12.655 23.250 ( -8.309 0.050 14.257) 16.502 23.903 ( -5.646 1.920 -18.359) 19.304 26.393 ( 11.022 0.310 9.047) 14.263 26.678 ( 13.931 -2.118 -0.168) 14.092 27.010 ( 1.599 -5.125 18.336) 19.106 27.892 ( 3.810 -14.151 -20.635) 25.309 ======================= Grid point 174 (59/100) ======================= q-point: ( 0.33 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.901 ( 44.461 13.180 17.221) 49.468 4.477 ( 30.304 37.181 31.818) 57.560 5.280 ( 9.843 -1.619 -40.258) 41.476 6.009 ( -4.741 32.487 -27.704) 42.958 6.724 ( -9.230 16.513 -5.983) 19.842 6.938 ( -24.415 3.513 -9.658) 26.490 6.985 ( -24.569 3.201 -14.253) 28.584 7.122 ( -3.905 11.411 -4.465) 12.861 7.203 ( -10.850 9.749 -10.315) 17.865 7.396 ( -7.692 5.712 -10.930) 14.535 7.810 ( 63.249 15.630 41.082) 77.022 8.695 ( 4.284 -5.299 -9.594) 11.768 8.764 ( 4.701 -6.158 -10.311) 12.897 9.035 ( 2.250 -5.388 2.070) 6.195 9.125 ( -5.060 1.289 1.256) 5.370 9.598 ( 24.497 4.097 -14.242) 28.631 9.830 ( 7.944 -11.203 17.402) 22.169 9.889 ( 3.993 -7.839 11.678) 14.621 10.296 ( 17.915 -5.013 -4.556) 19.153 10.408 ( 7.804 -4.091 5.758) 10.526 10.473 ( 4.791 -1.490 5.193) 7.221 10.701 ( 26.310 5.819 -21.102) 34.225 11.408 ( 0.865 3.663 9.490) 10.209 11.466 ( 13.013 6.031 13.574) 19.748 11.727 ( 14.880 -13.535 -1.875) 20.202 11.741 ( 6.137 7.838 2.685) 10.311 11.784 ( 5.011 -8.997 -0.455) 10.309 11.950 ( 3.840 6.188 -0.533) 7.302 12.016 ( 5.447 -1.209 5.989) 8.185 12.212 ( -11.220 -5.865 14.376) 19.156 12.242 ( 4.477 2.562 2.641) 5.795 12.388 ( 3.685 6.633 4.783) 8.970 12.499 ( 6.523 9.003 4.143) 11.865 12.598 ( 16.645 7.221 2.124) 18.268 12.650 ( 2.711 -3.231 3.281) 5.344 12.799 ( 1.203 1.710 3.880) 4.407 12.844 ( 7.284 -6.653 0.683) 9.889 13.002 ( 12.646 14.556 4.566) 19.815 13.045 ( 10.919 8.559 4.625) 14.624 13.305 ( 0.227 9.430 -0.235) 9.435 13.458 ( 8.856 1.034 2.954) 9.393 13.619 ( -34.527 -0.603 -16.104) 38.103 13.918 ( -4.293 6.733 7.310) 10.826 14.133 ( -17.685 -7.986 1.238) 19.444 14.225 ( -3.617 10.564 7.518) 13.461 14.576 ( -19.186 2.180 -2.588) 19.483 14.792 ( -16.521 -14.120 -15.778) 26.857 15.041 ( -7.347 1.596 -4.922) 8.986 15.140 ( -11.594 1.868 4.244) 12.487 15.352 ( -6.063 5.529 -6.815) 10.667 15.516 ( 8.273 -18.347 3.597) 20.445 15.694 ( 0.894 -15.621 -6.628) 16.993 16.142 ( 3.960 -5.712 5.088) 8.614 16.467 ( 2.576 3.053 5.633) 6.905 16.988 ( -3.388 -6.822 7.846) 10.935 17.213 ( 1.187 -1.994 1.540) 2.785 17.413 ( 2.317 -2.124 0.780) 3.239 17.577 ( -8.314 -2.527 -3.648) 9.424 17.659 ( 0.024 8.179 -0.788) 8.217 17.770 ( -6.128 0.900 -1.816) 6.455 17.956 ( -8.293 -3.716 -10.189) 13.653 17.982 ( -1.683 -3.202 -2.030) 4.148 18.020 ( -2.172 -4.724 -6.671) 8.458 18.245 ( -3.018 0.782 -0.606) 3.176 18.316 ( -0.150 3.523 -8.840) 9.518 18.515 ( -8.331 3.765 -13.220) 16.073 19.185 ( -1.693 -0.504 7.729) 7.928 19.646 ( -11.671 1.216 -12.049) 16.819 20.139 ( -0.999 -3.008 4.242) 5.296 20.304 ( -2.624 7.852 -4.342) 9.348 20.373 ( -3.232 4.707 4.060) 7.006 20.480 ( -1.379 1.987 -1.339) 2.765 20.812 ( 3.514 -4.354 3.346) 6.519 20.877 ( 1.470 -2.771 1.104) 3.325 21.312 ( -5.368 14.636 9.204) 18.104 21.474 ( -6.583 9.174 5.870) 12.726 22.182 ( 7.722 3.818 3.597) 9.335 22.473 ( 10.288 0.080 -8.027) 13.049 23.145 ( -0.474 -3.139 13.618) 13.983 23.746 ( -10.172 -1.742 -15.381) 18.523 26.618 ( 11.297 -1.375 11.606) 16.254 26.914 ( 6.368 -4.588 15.224) 17.128 27.119 ( 11.610 -4.642 -0.977) 12.542 27.869 ( -5.644 -11.953 -18.727) 22.922 ======================= Grid point 175 (60/100) ======================= q-point: ( 0.44 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.734 ( 38.149 26.806 15.875) 49.254 5.133 ( 35.342 17.047 6.318) 39.744 5.307 ( -13.861 24.557 0.346) 28.201 5.754 ( -19.445 6.581 -20.944) 29.328 6.373 ( -16.899 6.052 -12.396) 21.815 6.503 ( -20.824 1.664 -20.869) 29.529 6.755 ( 7.848 22.076 -24.565) 33.947 6.960 ( -11.619 19.442 -20.132) 30.303 7.142 ( 2.330 11.229 -7.978) 13.970 7.229 ( -6.705 10.705 -12.114) 17.502 8.764 ( 3.219 -4.317 -12.059) 13.206 8.801 ( 0.454 -3.832 -13.506) 14.046 9.009 ( 4.012 3.850 6.604) 8.633 9.034 ( 0.330 3.678 2.134) 4.265 9.131 ( 47.813 5.792 33.879) 58.884 9.756 ( -9.330 -4.218 20.012) 22.479 10.008 ( 9.384 -17.560 24.211) 31.346 10.058 ( 7.945 -15.449 12.473) 21.386 10.505 ( 3.000 -0.430 7.302) 7.906 10.558 ( 4.858 0.520 3.786) 6.181 10.567 ( 10.169 -5.209 3.487) 11.945 11.025 ( -34.550 1.855 21.026) 40.488 11.397 ( 18.540 2.541 -13.975) 23.356 11.585 ( -5.207 0.114 -0.111) 5.209 11.704 ( 12.958 0.344 -3.736) 13.490 11.870 ( 11.957 8.236 -7.921) 16.540 11.872 ( -0.611 2.359 1.057) 2.656 11.976 ( 6.156 0.542 -0.880) 6.242 12.050 ( 5.394 -2.616 1.876) 6.281 12.176 ( 8.125 -4.023 7.270) 11.622 12.288 ( -2.792 -3.471 5.389) 6.992 12.558 ( -10.847 -5.563 -4.761) 13.087 12.657 ( -1.997 -2.982 0.848) 3.687 12.686 ( -0.705 0.706 -7.011) 7.082 12.727 ( -4.257 -3.471 -14.972) 15.948 12.878 ( -11.276 1.774 -11.231) 16.014 13.002 ( 18.890 2.915 8.173) 20.788 13.070 ( 10.270 5.018 3.233) 11.879 13.231 ( 3.861 4.339 14.004) 15.160 13.310 ( 13.580 4.910 0.581) 14.452 13.386 ( 4.129 8.404 -1.542) 9.489 13.549 ( -18.211 1.685 13.401) 22.673 13.779 ( 3.271 6.485 8.694) 11.329 13.951 ( 3.353 0.011 9.119) 9.716 14.061 ( -9.740 6.118 2.605) 11.793 14.313 ( -9.686 -2.109 -11.726) 15.354 14.495 ( -6.512 3.085 -13.369) 15.187 14.743 ( -21.232 4.622 -5.351) 22.379 15.005 ( 0.582 5.135 -2.938) 5.945 15.111 ( -10.702 8.414 -5.779) 14.789 15.747 ( 11.160 -18.293 4.635) 21.924 15.826 ( 4.507 -18.492 -1.265) 19.075 16.262 ( 8.099 -8.303 7.200) 13.652 16.432 ( -7.193 -12.610 0.332) 14.521 16.979 ( 3.231 -5.593 11.420) 13.120 17.118 ( -9.333 -2.740 6.960) 11.961 17.437 ( 0.971 -0.647 1.019) 1.549 17.460 ( -2.437 -2.457 -2.486) 4.261 17.670 ( 2.174 3.643 -7.254) 8.404 17.768 ( -2.391 9.457 -6.607) 11.782 17.808 ( 1.669 4.897 -4.708) 6.995 17.929 ( -4.787 2.861 -1.807) 5.862 18.068 ( 5.124 -5.067 -6.656) 9.810 18.176 ( -4.815 -0.041 -3.686) 6.064 18.313 ( 0.904 4.636 -6.934) 8.390 18.377 ( -5.698 5.477 -9.828) 12.611 19.240 ( 6.669 -1.844 -0.607) 6.946 19.419 ( -10.948 -0.183 -7.767) 13.425 20.143 ( 1.610 1.553 4.018) 4.598 20.207 ( -4.885 5.599 2.163) 7.739 20.385 ( 2.556 5.973 -0.361) 6.507 20.441 ( -2.696 4.482 -1.675) 5.492 20.877 ( 2.893 -0.991 2.263) 3.805 20.906 ( 0.436 0.142 1.148) 1.236 21.238 ( -0.534 10.804 10.365) 14.982 21.315 ( -7.495 8.722 9.269) 14.770 22.372 ( 9.792 -0.886 -0.388) 9.840 22.521 ( -4.281 -0.440 -5.234) 6.776 23.268 ( 11.488 -5.042 2.713) 12.836 23.517 ( -12.825 -3.976 -8.373) 15.824 26.814 ( 8.286 -2.957 14.844) 17.256 26.929 ( -3.158 -4.262 18.367) 19.117 27.413 ( 15.768 -6.694 -10.879) 20.292 27.691 ( -12.108 -9.338 -14.883) 21.338 ======================= Grid point 180 (61/100) ======================= q-point: ( 0.00 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.096 ( 0.000 32.662 38.963) 50.842 3.303 ( 0.000 23.739 50.522) 55.821 5.320 ( 0.000 4.137 -57.838) 57.986 5.377 ( 0.000 3.754 -44.053) 44.213 6.073 ( 0.000 77.368 62.509) 99.464 7.154 ( 0.000 -8.940 -0.378) 8.948 7.214 ( 0.000 -4.389 -3.311) 5.498 7.272 ( 0.000 -14.599 6.754) 16.086 7.471 ( 0.000 -0.953 -6.243) 6.315 7.643 ( 0.000 -10.972 -3.961) 11.665 7.908 ( 0.000 -21.326 -14.793) 25.954 8.532 ( 0.000 7.306 -10.512) 12.802 8.652 ( 0.000 2.936 -18.754) 18.982 8.810 ( 0.000 37.730 -50.102) 62.720 9.179 ( 0.000 -8.734 6.256) 10.743 9.295 ( 0.000 -11.574 -1.041) 11.621 9.606 ( 0.000 0.150 -0.041) 0.156 9.711 ( 0.000 11.453 -8.034) 13.989 9.957 ( 0.000 -0.675 -1.256) 1.426 10.061 ( 0.000 6.435 7.866) 10.163 10.101 ( 0.000 2.027 3.538) 4.078 10.419 ( 0.000 3.455 -0.474) 3.487 10.865 ( 0.000 20.866 18.518) 27.898 11.377 ( 0.000 8.627 5.647) 10.311 11.524 ( 0.000 14.103 3.432) 14.515 11.558 ( 0.000 10.893 6.765) 12.823 11.640 ( 0.000 12.534 0.778) 12.558 11.742 ( 0.000 8.534 13.396) 15.883 11.817 ( 0.000 16.539 -5.151) 17.323 11.889 ( 0.000 23.502 -5.187) 24.067 11.930 ( 0.000 4.243 14.707) 15.306 12.160 ( 0.000 3.545 -10.766) 11.335 12.323 ( 0.000 10.451 4.602) 11.419 12.347 ( 0.000 18.187 5.514) 19.004 12.713 ( 0.000 25.073 12.954) 28.221 12.821 ( 0.000 8.633 8.178) 11.892 12.971 ( 0.000 -1.166 1.821) 2.162 13.182 ( 0.000 -0.115 1.152) 1.158 13.221 ( 0.000 -4.412 2.116) 4.893 13.296 ( 0.000 -8.550 2.454) 8.895 13.551 ( 0.000 -15.516 12.753) 20.084 13.881 ( 0.000 -0.859 7.012) 7.064 13.921 ( 0.000 -1.300 5.496) 5.647 14.313 ( 0.000 -1.839 -4.773) 5.115 14.606 ( 0.000 -10.126 -1.474) 10.233 14.621 ( 0.000 -12.258 10.777) 16.322 14.766 ( 0.000 -8.361 -0.235) 8.364 15.080 ( 0.000 -5.646 -6.041) 8.269 15.423 ( 0.000 -9.512 15.680) 18.340 15.581 ( 0.000 -18.069 -21.642) 28.194 15.885 ( 0.000 0.392 -7.820) 7.830 15.990 ( 0.000 -1.665 -5.908) 6.139 16.348 ( 0.000 -5.522 13.247) 14.352 16.367 ( 0.000 5.803 -1.161) 5.918 16.435 ( 0.000 -10.769 1.206) 10.836 16.859 ( 0.000 -20.157 -14.414) 24.780 16.972 ( 0.000 -0.994 -1.618) 1.899 17.665 ( 0.000 -2.443 -10.059) 10.351 17.748 ( 0.000 4.087 -4.306) 5.937 17.926 ( 0.000 1.285 -1.826) 2.233 18.012 ( 0.000 -4.817 -2.369) 5.368 18.114 ( 0.000 -0.766 -2.623) 2.733 18.276 ( 0.000 -3.721 -2.000) 4.224 18.292 ( 0.000 1.158 0.158) 1.169 18.916 ( 0.000 -5.270 1.154) 5.395 19.156 ( 0.000 -16.124 -6.063) 17.227 19.820 ( 0.000 -17.051 0.370) 17.055 19.854 ( 0.000 -21.663 -0.627) 21.673 19.913 ( 0.000 10.515 8.516) 13.531 20.260 ( 0.000 -10.259 3.556) 10.858 20.272 ( 0.000 7.040 -7.242) 10.100 20.487 ( 0.000 7.340 -8.254) 11.045 20.584 ( 0.000 -1.640 7.434) 7.612 21.014 ( 0.000 3.384 -9.544) 10.126 21.114 ( 0.000 -1.864 3.298) 3.788 21.209 ( 0.000 -3.020 -2.591) 3.979 22.374 ( 0.000 24.658 18.675) 30.932 23.056 ( 0.000 28.203 -12.334) 30.782 23.531 ( 0.000 1.188 13.622) 13.674 24.186 ( 0.000 9.348 -21.557) 23.496 26.213 ( 0.000 4.757 5.461) 7.242 26.377 ( 0.000 0.135 -1.772) 1.777 27.072 ( 0.000 -8.163 4.811) 9.475 27.126 ( 0.000 -16.353 7.581) 18.025 ======================= Grid point 181 (62/100) ======================= q-point: ( 0.11 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.052 ( 10.603 34.221 31.678) 47.823 3.909 ( 42.649 24.352 45.102) 66.679 5.068 ( -6.633 2.682 -53.970) 54.443 5.884 ( 31.268 10.011 -43.868) 54.793 6.248 ( 18.683 67.939 58.902) 91.838 7.188 ( 2.013 -4.964 -2.468) 5.898 7.234 ( 2.195 -2.266 -4.137) 5.203 7.353 ( 6.014 -11.569 3.694) 13.552 7.524 ( 6.112 -0.785 -2.803) 6.770 7.710 ( 3.343 -6.867 -2.495) 8.035 7.888 ( -2.161 -12.346 -11.169) 16.788 8.469 ( -6.232 3.708 -9.809) 12.199 8.589 ( -4.286 2.338 -17.466) 18.136 8.934 ( 8.523 30.735 -36.646) 48.582 8.978 ( -7.916 -4.636 2.531) 9.517 9.154 ( -11.500 -3.010 -8.392) 14.551 9.734 ( -3.007 7.664 -1.376) 8.347 9.897 ( 3.159 -4.706 -4.056) 6.970 9.919 ( 20.250 -0.641 -0.155) 20.261 9.957 ( 1.459 1.367 -0.433) 2.046 10.249 ( 0.916 4.463 3.412) 5.692 10.323 ( -6.150 -0.176 -1.794) 6.409 11.018 ( 13.947 13.675 20.050) 27.992 11.347 ( -3.404 14.248 2.134) 14.804 11.545 ( -2.814 13.421 12.468) 18.534 11.597 ( 2.781 10.398 7.903) 13.353 11.618 ( 5.922 9.668 10.536) 15.478 11.691 ( -2.248 8.685 6.057) 10.825 11.882 ( 8.613 5.501 -1.105) 10.279 11.997 ( 10.667 5.926 -3.674) 12.744 12.115 ( 8.344 14.368 -1.088) 16.651 12.202 ( 3.499 11.181 -3.718) 12.292 12.323 ( 3.778 11.931 5.341) 13.606 12.420 ( 7.338 15.000 4.351) 17.256 12.727 ( 0.284 12.938 11.981) 17.636 12.843 ( -1.496 10.460 3.738) 11.208 12.907 ( -3.883 -5.682 2.903) 7.469 12.982 ( -3.127 6.254 -0.142) 6.994 13.299 ( 0.568 -7.395 7.151) 10.303 13.433 ( 6.851 0.421 -0.011) 6.864 13.671 ( 2.033 -4.449 9.540) 10.721 13.775 ( 3.614 -2.763 4.671) 6.520 14.059 ( 1.599 -10.788 3.145) 11.350 14.317 ( -0.237 -0.773 2.798) 2.913 14.413 ( -9.732 3.376 8.625) 13.434 14.628 ( -2.581 -6.948 13.759) 15.629 14.731 ( -0.378 -18.780 -15.386) 24.281 15.148 ( 4.611 -4.004 -6.952) 9.254 15.410 ( -6.622 -11.766 -0.445) 13.509 15.552 ( -3.008 -13.557 -5.878) 15.080 15.744 ( -10.819 1.555 -3.611) 11.511 15.876 ( -7.763 -4.245 -2.181) 9.112 15.981 ( -20.693 -6.008 -14.242) 25.828 16.460 ( 6.811 -4.501 14.176) 16.359 16.740 ( 16.851 -0.543 1.285) 16.909 16.913 ( 1.442 -17.435 -10.429) 20.367 17.028 ( 5.297 -3.682 -0.903) 6.514 17.687 ( -0.706 1.398 -10.320) 10.438 17.714 ( 0.401 -1.082 0.891) 1.458 17.918 ( -1.392 2.121 -1.489) 2.941 18.003 ( -0.841 -4.832 -3.771) 6.187 18.102 ( -1.216 -0.755 -2.934) 3.264 18.234 ( -4.006 -5.273 -1.311) 6.751 18.301 ( 0.236 0.910 -1.395) 1.682 18.692 ( -19.562 -4.716 -1.048) 20.150 18.929 ( -15.979 -11.376 -8.485) 21.371 19.662 ( -11.343 -0.238 6.236) 12.946 19.911 ( 0.071 -15.265 -4.763) 15.991 20.047 ( 6.517 1.750 7.859) 10.358 20.298 ( 4.487 -9.234 1.470) 10.371 20.361 ( 8.423 0.676 -4.669) 9.654 20.476 ( -0.820 7.492 -8.402) 11.287 20.596 ( 1.164 -1.782 7.036) 7.351 20.963 ( -4.132 3.511 -5.876) 7.995 21.176 ( 6.427 -3.064 1.630) 7.304 21.329 ( 10.774 -4.492 -2.798) 12.004 22.363 ( -0.807 22.942 16.922) 28.519 22.942 ( -11.270 28.554 -8.453) 31.841 23.448 ( -7.942 1.267 13.564) 15.769 24.118 ( -6.641 6.757 -21.334) 23.343 26.268 ( 5.398 3.908 5.899) 8.900 26.443 ( 6.735 -0.519 -1.458) 6.911 26.904 ( -5.432 -8.568 16.103) 19.032 27.373 ( 12.497 -17.554 -6.500) 22.507 ======================= Grid point 182 (63/100) ======================= q-point: ( 0.22 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.518 ( 34.574 32.437 15.852) 49.988 4.717 ( 36.425 34.441 38.144) 62.991 5.081 ( 7.636 4.078 -48.687) 49.450 6.485 ( 27.475 23.492 -37.814) 52.312 6.822 ( 37.390 38.017 43.168) 68.607 7.211 ( -1.875 2.638 -1.990) 3.799 7.243 ( -1.921 4.988 -4.777) 7.169 7.406 ( -1.513 2.346 -1.789) 3.315 7.595 ( -7.819 5.606 -8.371) 12.753 7.650 ( -7.670 1.533 -4.189) 8.873 7.842 ( 0.159 8.948 7.232) 11.506 8.363 ( 0.357 -9.023 -6.558) 11.160 8.561 ( 1.494 -1.990 -10.741) 11.026 8.857 ( -2.327 -3.136 -0.054) 3.905 8.943 ( -0.400 -9.053 -6.817) 11.339 9.333 ( 22.111 20.093 -23.813) 38.206 9.703 ( 1.720 3.708 -2.064) 4.579 9.871 ( -4.997 -2.123 -5.008) 7.386 10.065 ( 7.177 -5.206 -3.484) 9.526 10.146 ( -0.601 2.529 6.437) 6.942 10.288 ( 7.303 0.907 2.401) 7.741 10.457 ( 20.220 1.559 -13.966) 24.623 11.256 ( 8.529 -5.318 13.255) 16.635 11.301 ( 1.990 5.589 1.842) 6.212 11.529 ( 3.830 12.057 16.640) 20.903 11.571 ( -3.045 8.490 10.782) 14.057 11.742 ( 4.913 1.790 13.305) 14.296 11.893 ( 16.832 8.402 2.872) 19.030 12.029 ( 3.974 3.742 0.294) 5.467 12.151 ( 6.531 10.296 -4.471) 12.986 12.264 ( 4.949 -0.709 -1.633) 5.260 12.320 ( 12.104 11.329 5.088) 17.342 12.473 ( 8.509 12.118 1.937) 14.934 12.573 ( 3.263 2.809 1.336) 4.508 12.710 ( -3.565 -1.138 1.853) 4.176 12.775 ( 4.150 5.309 5.134) 8.472 12.873 ( -0.791 7.988 8.526) 11.710 13.099 ( 7.151 13.401 -4.010) 15.710 13.284 ( -0.717 -6.192 11.385) 12.980 13.485 ( -7.971 5.755 8.348) 12.898 13.510 ( -4.058 15.060 4.014) 16.105 13.933 ( 3.827 2.285 3.862) 5.898 13.984 ( -2.058 -19.425 2.837) 19.739 14.158 ( -14.577 2.477 2.687) 15.028 14.381 ( 5.210 3.747 -0.791) 6.466 14.684 ( -4.193 -12.216 -10.618) 16.720 14.784 ( 11.700 -10.979 8.651) 18.228 15.066 ( -24.887 -12.054 -15.332) 31.619 15.169 ( -2.458 -0.765 -3.859) 4.639 15.385 ( -11.879 -4.216 9.856) 16.001 15.500 ( -12.015 4.019 -5.378) 13.763 15.767 ( -2.349 -11.861 -21.690) 24.832 15.835 ( 0.289 -9.776 3.280) 10.316 16.448 ( -8.913 -13.301 -0.100) 16.012 16.895 ( -0.185 -4.723 9.678) 10.770 17.060 ( 14.008 1.767 0.576) 14.131 17.179 ( 9.721 -6.500 -0.158) 11.695 17.617 ( -5.833 -5.472 7.493) 10.960 17.744 ( -1.527 -2.659 -5.009) 5.873 17.875 ( -1.673 3.964 -2.923) 5.201 17.969 ( -2.798 -3.111 -5.460) 6.879 18.045 ( -6.203 -2.958 -8.128) 10.644 18.145 ( -3.159 -1.551 -4.769) 5.927 18.286 ( -9.709 -0.166 -4.377) 10.651 18.323 ( -4.983 -4.728 2.969) 7.483 18.710 ( -5.674 2.392 -15.008) 16.222 19.424 ( -11.832 5.340 8.608) 15.576 19.828 ( -7.412 -5.959 -9.279) 13.287 20.114 ( 1.514 1.301 8.953) 9.173 20.396 ( 3.729 -4.874 2.107) 6.489 20.467 ( 0.065 2.846 -8.197) 8.677 20.502 ( 3.647 4.686 -4.634) 7.532 20.639 ( 4.016 -2.728 6.689) 8.265 20.883 ( -3.163 3.689 -2.128) 5.305 21.365 ( 11.836 -5.284 3.534) 13.435 21.551 ( 9.409 -1.107 -1.460) 9.586 22.371 ( 2.747 14.604 9.353) 17.559 22.650 ( -17.082 25.958 -1.196) 31.097 23.254 ( -10.894 0.403 13.507) 17.357 23.941 ( -11.159 1.352 -19.745) 22.720 26.412 ( 8.823 1.795 7.194) 11.525 26.626 ( 11.009 -2.913 0.793) 11.415 26.877 ( 2.108 -7.880 15.477) 17.495 27.547 ( 4.857 -19.254 -13.137) 23.810 ======================= Grid point 183 (64/100) ======================= q-point: ( 0.33 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.319 ( 45.502 28.176 4.006) 53.669 5.281 ( 21.454 26.368 -2.668) 34.097 5.367 ( 21.402 24.262 -2.906) 32.483 6.789 ( -8.656 41.987 -14.758) 45.339 7.038 ( -21.740 6.765 -7.233) 23.890 7.070 ( -3.177 13.065 -14.195) 19.553 7.120 ( -18.458 12.638 -1.663) 22.432 7.360 ( 1.253 11.363 -10.554) 15.559 7.418 ( -5.290 8.090 -6.642) 11.728 7.548 ( 2.896 10.152 -8.420) 13.503 8.220 ( 44.282 23.429 29.619) 58.199 8.550 ( 11.713 -18.471 -3.421) 22.138 8.611 ( 4.871 -2.732 -6.803) 8.802 8.886 ( 5.135 -4.038 1.279) 6.657 9.009 ( 4.764 -10.038 0.927) 11.150 9.702 ( 3.693 -2.090 14.251) 14.869 9.743 ( 6.386 7.591 -4.986) 11.103 9.838 ( 3.090 3.684 0.656) 4.853 10.155 ( 6.851 -5.236 0.177) 8.625 10.225 ( 8.124 -11.897 -9.051) 17.013 10.444 ( 4.481 -2.571 2.847) 5.898 10.908 ( 27.288 15.526 -29.004) 42.742 11.451 ( 13.023 -8.130 9.967) 18.304 11.502 ( 15.480 -10.973 3.009) 19.212 11.515 ( 0.043 2.660 8.171) 8.593 11.654 ( 5.131 7.364 11.266) 14.404 11.785 ( 2.173 -2.754 4.320) 5.565 12.072 ( -7.904 -3.899 12.564) 15.347 12.126 ( 0.439 2.679 15.415) 15.652 12.181 ( -0.248 12.205 3.935) 12.826 12.256 ( -5.025 2.363 -5.276) 7.660 12.463 ( -6.914 -10.718 6.395) 14.268 12.566 ( 2.122 8.632 4.502) 9.964 12.673 ( 8.960 6.713 4.062) 11.910 12.700 ( 9.031 1.510 0.905) 9.201 12.851 ( 11.292 7.862 -1.488) 13.840 12.881 ( 3.210 5.500 -1.614) 6.569 13.235 ( 4.556 7.085 4.177) 9.403 13.318 ( 2.983 11.879 1.402) 12.328 13.400 ( 0.704 -2.738 6.467) 7.058 13.540 ( -0.314 12.568 -5.111) 13.571 13.677 ( -17.738 6.923 -6.214) 20.029 13.936 ( -6.016 -7.892 0.363) 9.930 14.076 ( -1.603 5.878 11.307) 12.844 14.422 ( -4.997 -3.303 -9.067) 10.867 14.499 ( -19.628 -6.351 3.229) 20.881 14.597 ( -2.500 4.492 -3.728) 6.350 14.972 ( -2.825 -12.428 9.993) 16.196 15.177 ( -1.247 -3.012 -10.868) 11.346 15.230 ( 3.011 -1.412 0.653) 3.389 15.350 ( -0.082 -3.932 -11.291) 11.956 15.574 ( -16.628 2.445 -12.357) 20.860 15.892 ( 4.268 -18.608 4.657) 19.651 16.258 ( -9.137 -22.231 -4.051) 24.375 16.869 ( -4.209 -3.740 20.723) 21.474 17.220 ( 3.026 -1.256 6.081) 6.908 17.320 ( -1.042 -7.946 0.263) 8.018 17.534 ( -15.903 -7.939 -2.054) 17.893 17.593 ( 8.899 -1.625 -3.008) 9.533 17.899 ( -1.440 0.548 -7.688) 7.841 17.910 ( 2.914 7.155 -3.830) 8.622 17.954 ( -1.463 3.472 -4.181) 5.628 18.063 ( -2.475 4.736 -2.455) 5.880 18.224 ( 0.988 -2.676 -6.972) 7.532 18.334 ( 2.055 0.193 -0.690) 2.177 18.647 ( -2.792 8.935 -13.519) 16.444 19.244 ( -5.448 5.630 5.682) 9.677 19.647 ( -10.718 -1.398 -11.234) 15.590 20.144 ( 2.114 1.900 7.176) 7.718 20.426 ( -4.681 2.379 -5.761) 7.795 20.436 ( 1.282 0.013 -0.230) 1.302 20.532 ( 0.075 5.407 -3.939) 6.690 20.755 ( 7.338 -0.174 7.090) 10.205 20.877 ( 2.914 3.730 2.071) 5.167 21.540 ( 2.590 4.238 6.391) 8.094 21.629 ( -1.213 6.397 3.974) 7.628 22.355 ( -8.737 13.649 2.345) 16.375 22.495 ( 6.883 3.156 -3.778) 8.462 23.070 ( -5.818 -3.939 13.269) 15.014 23.692 ( -14.058 -3.818 -15.785) 21.480 26.592 ( 9.042 -0.808 9.239) 12.953 26.802 ( 4.862 -6.141 12.871) 15.067 26.996 ( 10.655 -7.457 -0.633) 13.020 27.565 ( -2.836 -17.654 -13.724) 22.540 ======================= Grid point 184 (65/100) ======================= q-point: ( 0.44 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.246 ( 48.041 24.633 -3.587) 54.108 5.671 ( 17.117 18.442 -13.829) 28.711 5.747 ( 12.853 34.876 14.112) 39.758 6.175 ( -43.184 31.184 -3.523) 53.383 6.605 ( -15.502 16.462 -2.099) 22.710 6.649 ( -18.594 14.454 -6.690) 24.483 7.234 ( 7.582 23.580 -20.621) 32.230 7.335 ( -3.237 15.309 -11.453) 19.392 7.437 ( 3.735 17.997 -13.633) 22.885 7.517 ( -3.925 17.776 -17.623) 25.336 8.627 ( 3.729 -10.499 -12.115) 16.459 8.677 ( -0.421 -9.649 -12.648) 15.914 9.003 ( 8.498 -7.006 9.226) 14.367 9.020 ( 5.345 -7.316 5.502) 10.600 9.294 ( 33.646 9.532 26.419) 43.828 9.657 ( -7.477 -1.940 20.114) 21.546 9.787 ( 6.537 0.001 14.062) 15.507 9.925 ( -0.907 3.099 0.372) 3.250 10.341 ( 7.579 -15.265 -8.753) 19.160 10.396 ( 4.986 -13.284 -7.078) 15.857 10.512 ( 11.790 0.373 11.436) 16.429 11.093 ( -34.351 5.438 21.562) 40.920 11.491 ( 8.449 6.468 -7.194) 12.844 11.595 ( -4.380 0.215 3.454) 5.582 11.721 ( 12.930 -1.221 -2.980) 13.324 11.755 ( 9.372 -1.265 9.831) 13.642 11.960 ( 15.276 -7.778 2.051) 17.265 12.018 ( 16.092 1.335 1.462) 16.213 12.116 ( -4.596 -6.787 4.075) 9.154 12.188 ( 0.842 8.222 -2.050) 8.515 12.219 ( 3.647 8.361 0.899) 9.166 12.395 ( 1.273 -10.076 9.034) 13.592 12.555 ( -10.139 -6.514 0.527) 12.063 12.688 ( -24.990 1.055 -13.686) 28.512 12.776 ( 7.367 6.759 -7.152) 12.292 12.951 ( -9.789 5.901 -12.761) 17.131 13.021 ( 13.271 1.028 9.469) 16.335 13.235 ( 13.212 4.883 -2.423) 14.292 13.277 ( -8.374 -0.690 9.416) 12.620 13.410 ( 10.196 4.997 5.279) 12.522 13.509 ( -11.212 2.613 -5.364) 12.701 13.633 ( -13.628 7.565 7.308) 17.215 13.769 ( 16.995 -2.820 -0.102) 17.227 14.079 ( -3.872 1.652 11.066) 11.840 14.188 ( -8.286 4.851 -7.370) 12.104 14.298 ( -8.463 11.487 4.020) 14.823 14.609 ( 4.274 2.882 -2.455) 5.710 14.784 ( -12.774 -0.358 -0.169) 12.780 15.170 ( 2.632 9.808 -2.732) 10.516 15.273 ( -8.350 6.428 -4.168) 11.332 15.415 ( 12.137 -12.756 -2.380) 17.768 15.500 ( 5.500 -10.077 -3.571) 12.023 15.933 ( 0.071 -22.854 -1.912) 22.934 16.047 ( -11.568 -24.619 -5.277) 27.709 16.821 ( 3.699 -9.948 15.036) 18.405 17.045 ( -16.657 -6.907 9.916) 20.579 17.325 ( 2.216 -5.238 1.616) 5.913 17.362 ( -1.829 -4.644 1.988) 5.373 17.805 ( 5.943 5.333 -10.304) 13.036 17.870 ( -2.585 2.252 -6.244) 7.123 17.947 ( 5.635 1.473 -4.942) 7.638 18.026 ( -0.843 7.057 0.278) 7.112 18.048 ( 6.130 4.335 -3.733) 8.385 18.191 ( -5.202 -0.714 -7.533) 9.182 18.417 ( 6.192 8.983 -0.599) 10.927 18.552 ( -6.802 12.610 -5.263) 15.264 19.246 ( 5.647 2.541 -4.255) 7.513 19.425 ( -11.303 0.860 -10.323) 15.332 20.207 ( 4.424 3.237 3.335) 6.416 20.313 ( -6.100 3.811 -1.800) 7.414 20.467 ( 1.989 0.823 -1.668) 2.723 20.509 ( -2.042 2.497 -3.300) 4.614 20.909 ( 7.267 5.552 7.223) 11.654 20.957 ( 2.976 6.819 4.563) 8.728 21.485 ( -3.875 12.154 7.958) 15.036 21.520 ( -7.382 10.557 8.250) 15.297 22.361 ( 7.261 0.363 1.016) 7.341 22.515 ( -5.804 0.130 -3.418) 6.737 23.124 ( 11.084 -9.305 2.411) 14.671 23.401 ( -15.348 -7.803 -9.096) 19.473 26.746 ( 6.251 -3.375 11.876) 13.839 26.825 ( -1.703 -5.516 14.643) 15.740 27.237 ( 12.401 -10.477 -8.317) 18.241 27.448 ( -8.728 -14.328 -11.557) 20.372 ======================= Grid point 189 (66/100) ======================= q-point: ( 0.00 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.851 ( 0.000 31.052 37.459) 48.656 3.881 ( 0.000 44.222 14.593) 46.568 5.401 ( 0.000 -3.753 -28.496) 28.742 5.421 ( 0.000 5.290 -50.719) 50.994 6.859 ( 0.000 -19.170 4.039) 19.591 6.928 ( 0.000 -14.942 -8.282) 17.084 6.984 ( 0.000 -23.548 -11.610) 26.255 7.259 ( 0.000 -10.828 -4.830) 11.856 7.376 ( 0.000 -14.052 -14.066) 19.882 7.442 ( 0.000 16.120 5.736) 17.110 7.763 ( 0.000 49.159 29.973) 57.576 8.736 ( 0.000 4.481 -15.461) 16.097 8.755 ( 0.000 9.443 -11.329) 14.748 9.051 ( 0.000 -4.606 4.886) 6.715 9.071 ( 0.000 -5.441 4.019) 6.764 9.439 ( 0.000 12.799 -3.448) 13.256 9.832 ( 0.000 17.826 -2.016) 17.939 9.929 ( 0.000 2.922 -5.868) 6.555 10.179 ( 0.000 11.271 4.546) 12.153 10.217 ( 0.000 35.287 -28.366) 45.275 10.235 ( 0.000 10.653 11.863) 15.944 10.467 ( 0.000 1.018 3.893) 4.024 11.277 ( 0.000 19.651 13.452) 23.814 11.499 ( 0.000 0.613 7.145) 7.171 11.674 ( 0.000 -6.311 5.424) 8.321 11.686 ( 0.000 5.473 5.104) 7.484 11.776 ( 0.000 5.136 4.222) 6.649 11.791 ( 0.000 6.764 13.259) 14.885 12.008 ( 0.000 4.014 13.102) 13.703 12.131 ( 0.000 8.394 -3.572) 9.122 12.225 ( 0.000 -7.816 -3.441) 8.540 12.298 ( 0.000 4.030 11.227) 11.929 12.409 ( 0.000 7.825 4.007) 8.792 12.705 ( 0.000 -4.691 8.249) 9.490 12.802 ( 0.000 20.586 9.738) 22.773 13.051 ( 0.000 15.476 -2.357) 15.654 13.085 ( 0.000 1.785 5.536) 5.817 13.086 ( 0.000 4.463 5.186) 6.842 13.226 ( 0.000 -3.776 -1.478) 4.055 13.273 ( 0.000 11.872 1.037) 11.917 13.711 ( 0.000 15.127 7.591) 16.924 13.761 ( 0.000 -18.649 -2.095) 18.766 13.980 ( 0.000 15.215 0.763) 15.234 14.135 ( 0.000 -20.718 -2.780) 20.904 14.314 ( 0.000 -0.175 -9.235) 9.237 14.429 ( 0.000 -9.625 -14.882) 17.723 14.807 ( 0.000 5.164 11.443) 12.554 14.892 ( 0.000 -12.541 9.836) 15.938 15.196 ( 0.000 -16.510 -21.113) 26.802 15.232 ( 0.000 -7.990 1.156) 8.073 15.700 ( 0.000 -16.907 -19.641) 25.916 15.836 ( 0.000 -17.077 -4.021) 17.544 16.330 ( 0.000 3.940 8.582) 9.444 16.349 ( 0.000 1.535 0.225) 1.552 16.518 ( 0.000 8.144 5.535) 9.847 16.611 ( 0.000 -2.588 -6.964) 7.429 17.027 ( 0.000 6.629 -3.024) 7.286 17.568 ( 0.000 -7.680 -10.112) 12.698 17.791 ( 0.000 0.627 -1.708) 1.820 17.856 ( 0.000 -10.594 3.979) 11.317 17.893 ( 0.000 -7.035 -3.030) 7.660 17.992 ( 0.000 -11.682 1.203) 11.744 18.251 ( 0.000 3.325 7.802) 8.481 18.315 ( 0.000 1.084 4.734) 4.856 18.839 ( 0.000 -0.739 -9.133) 9.163 18.847 ( 0.000 -12.725 -5.326) 13.795 19.373 ( 0.000 -24.062 0.783) 24.074 19.478 ( 0.000 -16.797 -4.608) 17.418 20.160 ( 0.000 8.966 13.434) 16.151 20.177 ( 0.000 3.885 4.662) 6.068 20.330 ( 0.000 0.014 -0.430) 0.430 20.560 ( 0.000 -1.134 9.191) 9.260 20.699 ( 0.000 11.022 -10.594) 15.288 21.052 ( 0.000 -0.684 -3.222) 3.293 21.078 ( 0.000 -1.104 -2.188) 2.450 21.147 ( 0.000 -2.169 -11.888) 12.084 22.823 ( 0.000 20.434 18.151) 27.331 23.505 ( 0.000 0.023 13.360) 13.360 23.590 ( 0.000 21.032 -14.848) 25.745 24.294 ( 0.000 1.252 -24.796) 24.828 26.326 ( 0.000 6.481 3.948) 7.589 26.390 ( 0.000 1.433 1.797) 2.298 26.836 ( 0.000 -12.592 10.615) 16.469 26.895 ( 0.000 -9.431 3.395) 10.023 ======================= Grid point 190 (67/100) ======================= q-point: ( 0.11 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.861 ( 12.334 45.245 12.583) 48.555 4.410 ( 39.407 26.527 33.242) 57.979 5.181 ( -3.705 7.519 -41.966) 42.795 5.955 ( 34.714 -4.924 -32.575) 47.859 6.965 ( 6.176 -19.338 -3.608) 20.618 7.019 ( 3.927 -21.879 -11.439) 24.999 7.026 ( 12.786 -11.606 -2.500) 17.448 7.279 ( 3.011 1.543 3.199) 4.656 7.456 ( 9.459 -0.154 -5.108) 10.751 7.553 ( 6.712 -4.922 -10.547) 13.435 7.932 ( 16.454 47.191 31.623) 59.142 8.671 ( -5.046 5.968 -12.660) 14.878 8.693 ( -6.371 10.716 -11.109) 16.698 8.970 ( -7.541 4.351 5.663) 10.386 9.060 ( -4.223 -1.099 1.621) 4.655 9.494 ( 4.947 9.485 -4.060) 11.442 9.800 ( 0.681 -0.472 1.300) 1.542 9.983 ( -6.634 11.195 -2.358) 13.224 9.994 ( 2.082 8.942 6.050) 10.995 10.211 ( -10.791 10.435 -5.154) 15.872 10.355 ( 4.474 24.655 -20.589) 32.431 10.369 ( 3.176 5.714 -0.449) 6.553 11.308 ( 0.258 15.778 12.170) 19.928 11.516 ( 0.445 -0.420 5.763) 5.795 11.648 ( -3.003 1.793 6.584) 7.455 11.707 ( 2.495 -1.517 15.180) 15.458 11.819 ( 3.911 9.402 8.810) 13.465 11.863 ( 7.791 6.061 9.826) 13.928 12.038 ( 6.188 7.725 5.454) 11.301 12.128 ( -0.854 7.968 -3.835) 8.884 12.194 ( -4.852 -5.981 -2.617) 8.134 12.382 ( 3.653 1.675 4.087) 5.732 12.469 ( 7.821 -9.564 12.713) 17.727 12.588 ( -4.404 8.538 7.344) 12.092 12.825 ( -5.352 0.496 9.617) 11.017 12.877 ( -2.109 8.799 8.126) 12.161 13.000 ( -1.307 14.451 -3.169) 14.852 13.203 ( 4.873 9.915 -0.715) 11.071 13.341 ( -1.556 5.984 5.516) 8.286 13.431 ( 8.621 4.936 -2.531) 10.251 13.674 ( 4.813 -10.901 -1.618) 12.025 13.838 ( 5.720 2.403 -2.185) 6.577 13.912 ( -2.906 5.982 -1.005) 6.726 14.215 ( 4.005 -19.161 -1.086) 19.605 14.273 ( -2.073 -0.660 -10.497) 10.720 14.533 ( 5.293 -3.228 5.132) 8.048 14.659 ( -6.279 10.969 5.543) 13.801 15.024 ( 7.276 -8.917 3.460) 12.017 15.155 ( -4.667 -12.808 -11.990) 18.154 15.256 ( 1.170 -10.219 -3.036) 10.724 15.637 ( -2.824 -12.803 -19.451) 23.457 15.779 ( -11.985 -8.209 -2.668) 14.770 15.910 ( -23.036 -0.738 -1.899) 23.126 16.218 ( -6.486 -13.802 -1.808) 15.357 16.781 ( 10.217 3.770 11.423) 15.782 16.839 ( 17.200 6.140 -0.642) 18.274 17.042 ( 0.895 5.354 -4.042) 6.768 17.598 ( 2.278 -9.657 -10.937) 14.767 17.667 ( -8.994 -6.518 3.629) 11.686 17.833 ( -1.463 -9.409 2.798) 9.925 17.930 ( 0.592 -1.703 -4.255) 4.621 18.011 ( 1.789 -10.024 -2.905) 10.588 18.198 ( -3.825 4.081 8.300) 10.009 18.305 ( -1.582 0.351 3.808) 4.138 18.589 ( -15.605 -2.645 -2.589) 16.038 18.841 ( -2.377 1.975 -13.786) 14.128 19.508 ( 0.831 -13.244 -1.728) 13.382 19.510 ( 8.183 -23.007 -1.500) 24.464 20.158 ( -0.531 2.508 10.620) 10.925 20.232 ( 6.091 7.129 6.889) 11.635 20.347 ( 2.052 -1.450 -0.201) 2.521 20.580 ( 1.768 -0.505 9.799) 9.970 20.699 ( 0.348 11.290 -10.295) 15.283 21.013 ( -2.822 1.006 -3.539) 4.637 21.117 ( 3.041 -2.230 -5.836) 6.948 21.226 ( 8.354 -5.296 -7.359) 12.328 22.789 ( -3.576 19.490 17.202) 26.241 23.399 ( -11.004 5.488 8.982) 15.228 23.510 ( -7.807 16.188 -7.991) 19.669 24.195 ( -9.753 0.469 -23.309) 25.272 26.365 ( 3.967 5.649 4.043) 8.000 26.445 ( 5.265 1.073 1.330) 5.535 26.731 ( -3.826 -8.372 13.791) 16.581 27.047 ( 8.345 -15.191 -1.874) 17.433 ======================= Grid point 191 (68/100) ======================= q-point: ( 0.22 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.287 ( 29.711 43.545 2.833) 52.792 5.248 ( 14.110 14.661 -30.562) 36.716 5.279 ( 41.323 20.577 25.321) 52.651 6.695 ( 37.287 -6.737 -24.836) 45.305 7.100 ( 6.988 -14.660 -6.117) 17.354 7.147 ( 10.157 -12.441 -10.667) 19.280 7.299 ( 11.189 -1.048 -2.533) 11.520 7.401 ( 7.999 1.691 7.834) 11.323 7.615 ( 1.007 0.858 -12.130) 12.202 7.688 ( 10.087 1.655 -6.497) 12.111 8.300 ( 15.711 39.342 29.257) 51.484 8.431 ( -20.467 15.336 -3.843) 25.863 8.602 ( 1.496 8.547 -5.258) 10.145 8.851 ( -9.292 4.618 -2.186) 10.604 8.931 ( 2.373 3.345 -5.925) 7.206 9.649 ( 10.298 2.325 -0.251) 10.560 9.831 ( -14.416 5.675 1.990) 15.620 9.840 ( -4.690 4.548 -0.421) 6.547 9.990 ( 12.563 -4.116 -1.960) 13.364 10.079 ( 2.015 -1.633 7.153) 7.609 10.397 ( -0.173 6.183 -4.022) 7.378 10.687 ( 24.920 24.363 -30.058) 46.022 11.235 ( -5.362 7.998 14.221) 17.174 11.486 ( -2.436 3.991 1.823) 5.018 11.635 ( 2.168 0.511 9.756) 10.007 11.726 ( -1.917 3.532 9.243) 10.078 11.841 ( -2.614 9.622 10.418) 14.420 12.026 ( -0.330 -7.490 8.738) 11.514 12.060 ( 0.089 5.716 0.379) 5.730 12.194 ( 12.249 3.534 8.888) 15.541 12.306 ( 12.689 2.410 1.643) 13.020 12.367 ( -2.288 -10.309 3.089) 11.003 12.563 ( 2.037 -5.938 8.429) 10.510 12.592 ( 3.476 8.881 5.631) 11.076 12.801 ( -2.189 4.957 0.491) 5.441 12.913 ( 5.807 3.201 11.144) 12.967 12.959 ( -4.004 6.517 0.592) 7.672 13.176 ( -2.748 0.372 -1.005) 2.950 13.329 ( 0.013 4.587 7.056) 8.416 13.526 ( 4.412 -2.485 -5.423) 7.419 13.739 ( -2.427 -6.736 -5.873) 9.260 13.893 ( 4.901 14.110 6.811) 16.417 14.011 ( 2.219 8.892 -9.804) 13.421 14.210 ( -5.947 -2.789 7.502) 9.971 14.260 ( -0.939 -7.436 -12.494) 14.570 14.490 ( 8.310 -2.890 8.502) 12.235 14.805 ( 6.089 13.591 0.236) 14.894 14.873 ( -19.778 -6.791 -14.266) 25.314 15.123 ( -1.630 -6.679 2.518) 7.322 15.218 ( -5.223 -12.521 7.770) 15.634 15.479 ( -12.639 -9.188 -1.242) 15.675 15.553 ( -6.227 -5.848 -13.251) 15.767 15.681 ( 1.304 -3.657 -10.493) 11.189 16.065 ( -12.281 -18.452 -8.856) 23.870 16.903 ( 1.914 0.294 18.856) 18.955 17.075 ( 2.180 0.249 0.095) 2.196 17.123 ( 10.221 -0.725 -1.659) 10.380 17.449 ( -7.889 -10.544 6.254) 14.578 17.626 ( -5.045 -6.436 -1.379) 8.294 17.838 ( 4.142 -7.145 -14.411) 16.609 17.941 ( 1.010 0.657 -3.747) 3.936 18.026 ( -0.592 -4.249 -7.419) 8.570 18.143 ( -1.672 5.386 6.684) 8.746 18.282 ( 0.915 0.620 4.271) 4.412 18.354 ( -6.961 8.543 0.760) 11.046 18.826 ( 0.875 8.323 -16.427) 18.436 19.454 ( -5.356 -3.075 2.343) 6.605 19.607 ( 1.294 -16.569 -4.459) 17.207 20.149 ( -0.182 1.662 8.744) 8.903 20.336 ( 2.767 -1.102 5.068) 5.879 20.432 ( 5.201 -0.018 -3.414) 6.221 20.629 ( 3.745 0.781 8.398) 9.228 20.713 ( 0.783 10.579 -7.728) 13.124 20.963 ( -1.046 3.822 -1.627) 4.284 21.237 ( 10.111 -6.413 -2.346) 12.201 21.453 ( 13.676 -7.386 -4.939) 16.309 22.687 ( -6.458 15.734 13.393) 21.648 23.089 ( -19.678 13.039 3.932) 23.931 23.299 ( -13.289 8.352 2.649) 15.918 23.936 ( -16.008 -2.311 -19.601) 25.412 26.473 ( 6.591 4.363 4.434) 9.063 26.578 ( 7.604 -1.327 2.403) 8.084 26.720 ( 2.834 -7.429 12.060) 14.445 27.175 ( 4.384 -17.802 -6.999) 19.624 ======================= Grid point 192 (69/100) ======================= q-point: ( 0.33 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.974 ( 39.351 36.988 -2.048) 54.045 5.563 ( 20.756 16.403 -27.923) 38.465 6.046 ( 31.707 27.313 29.619) 51.270 7.134 ( -6.003 -2.638 -4.074) 7.720 7.150 ( 1.638 -1.077 -4.877) 5.256 7.343 ( -4.061 8.888 -1.182) 9.843 7.447 ( 6.822 4.808 -8.688) 12.047 7.504 ( 0.503 0.076 -3.632) 3.668 7.645 ( 4.655 25.057 -19.336) 31.990 7.719 ( 0.068 8.926 -8.505) 12.330 8.170 ( 4.120 -9.633 1.498) 10.584 8.422 ( -0.311 -3.845 -7.287) 8.245 8.760 ( 8.335 7.293 -3.940) 11.755 8.922 ( 12.401 10.827 3.300) 16.790 8.968 ( 4.052 8.502 2.628) 9.778 9.609 ( 0.699 -5.868 9.408) 11.110 9.848 ( 3.781 3.519 -3.650) 6.325 9.961 ( 13.839 7.564 2.920) 16.039 10.054 ( 0.239 -2.910 -6.232) 6.882 10.226 ( 3.755 8.624 9.497) 13.367 10.404 ( 2.004 -0.235 -1.539) 2.538 11.216 ( 21.561 9.964 -15.061) 28.124 11.270 ( 16.013 -1.715 10.021) 18.968 11.506 ( 7.129 12.561 -9.492) 17.283 11.637 ( -3.631 5.201 10.593) 12.347 11.728 ( 5.341 0.458 7.637) 9.330 11.771 ( -2.263 2.155 4.968) 5.869 11.970 ( -7.687 -8.666 10.571) 15.682 12.042 ( -3.044 -2.882 15.092) 15.664 12.238 ( -4.656 -9.268 7.628) 12.874 12.367 ( -5.796 0.421 6.681) 8.855 12.419 ( -3.783 7.740 4.136) 9.557 12.557 ( -1.443 -5.202 3.824) 6.615 12.758 ( 4.166 3.287 1.484) 5.510 12.804 ( 15.283 5.684 2.004) 16.428 12.940 ( 6.268 -0.270 -5.137) 8.109 12.976 ( -1.624 4.601 -0.753) 4.936 13.223 ( 1.962 -10.617 10.574) 15.112 13.312 ( 1.931 1.024 2.585) 3.385 13.506 ( -7.484 -2.453 -2.000) 8.126 13.721 ( -13.833 7.750 -6.131) 17.000 13.811 ( 1.223 -2.866 -7.518) 8.138 13.909 ( -6.415 12.950 0.054) 14.452 14.168 ( -12.981 1.810 5.412) 14.180 14.303 ( 4.846 -1.261 -10.304) 11.456 14.420 ( -3.663 2.737 -4.331) 6.298 14.704 ( 2.539 -8.616 5.271) 10.414 14.884 ( 0.827 15.384 3.044) 15.704 15.051 ( -2.252 -10.683 -7.678) 13.348 15.133 ( -4.802 -9.628 2.431) 11.031 15.324 ( -0.855 -10.355 -3.330) 10.911 15.570 ( 2.340 -8.107 -7.888) 11.551 15.625 ( -7.168 4.478 -3.666) 9.212 15.838 ( -6.834 -12.692 -4.190) 15.012 16.769 ( -14.244 -6.003 18.551) 24.147 17.100 ( 1.768 -9.373 7.182) 11.940 17.263 ( -6.588 -2.632 1.127) 7.183 17.285 ( -0.675 -6.897 -3.835) 7.920 17.652 ( 10.550 1.473 -1.165) 10.716 17.901 ( 0.291 -2.191 -13.151) 13.335 17.948 ( -0.905 1.897 -4.653) 5.105 18.019 ( 0.508 -3.799 -6.888) 7.883 18.122 ( -0.188 2.781 3.169) 4.220 18.242 ( -3.031 1.296 -1.908) 3.809 18.449 ( 12.530 15.736 4.835) 20.688 18.856 ( 1.553 11.696 -12.741) 17.365 19.344 ( -4.800 3.108 2.882) 6.403 19.570 ( -4.804 -7.289 -6.410) 10.831 20.165 ( 2.183 0.581 5.051) 5.534 20.370 ( 1.505 -4.626 1.201) 5.011 20.447 ( -3.167 1.071 -8.772) 9.387 20.631 ( -4.814 1.496 -8.143) 9.577 20.828 ( 11.863 8.015 9.790) 17.344 21.030 ( 7.856 10.344 4.333) 13.692 21.486 ( 13.229 -6.632 3.706) 15.255 21.683 ( 7.130 -2.256 0.062) 7.479 22.565 ( -6.243 7.371 3.835) 10.393 22.697 ( -16.456 13.929 2.547) 21.710 23.020 ( -13.804 0.399 8.355) 16.141 23.590 ( -18.979 -6.742 -14.863) 25.031 26.604 ( 6.345 2.364 5.627) 8.804 26.697 ( 3.979 -3.902 9.656) 11.149 26.843 ( 8.998 -7.457 0.411) 11.694 27.213 ( -0.437 -17.080 -8.350) 19.017 ======================= Grid point 193 (70/100) ======================= q-point: ( 0.44 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.777 ( 40.472 29.381 -4.356) 50.201 6.010 ( 21.604 19.823 -13.979) 32.482 6.447 ( 4.118 29.219 15.172) 33.180 6.690 ( -34.120 20.758 -7.836) 40.699 6.925 ( -7.531 16.229 0.792) 17.909 7.090 ( -16.090 22.114 15.041) 31.212 7.491 ( 6.846 0.322 -5.056) 8.516 7.562 ( 1.534 5.545 -4.628) 7.383 7.797 ( 5.379 11.170 -13.180) 18.095 7.842 ( 2.939 16.745 -18.518) 25.139 8.349 ( 5.986 -14.523 -8.419) 17.823 8.429 ( 0.965 -13.115 -10.593) 16.886 8.797 ( -0.091 -10.133 -10.817) 14.822 8.869 ( -2.385 -0.554 -7.955) 8.324 9.452 ( 24.576 1.690 8.821) 26.165 9.759 ( 7.760 8.332 13.804) 17.894 9.796 ( -5.899 -9.271 -9.307) 14.401 10.002 ( -9.419 -1.385 -4.411) 10.493 10.166 ( 7.210 5.258 -1.296) 9.017 10.253 ( -1.449 6.252 -2.263) 6.805 10.620 ( 26.243 12.496 22.623) 36.833 11.258 ( -28.043 11.656 19.888) 36.302 11.548 ( 2.705 -0.997 8.535) 9.009 11.577 ( 3.818 -1.975 7.832) 8.934 11.717 ( 3.913 -0.800 12.096) 12.738 11.813 ( 3.989 4.374 2.831) 6.562 11.829 ( 12.641 -0.205 2.952) 12.983 11.922 ( 1.580 -7.854 11.238) 13.801 12.069 ( 13.646 2.826 -9.990) 17.147 12.198 ( 4.616 -5.175 6.155) 9.272 12.285 ( -3.131 -7.610 -1.274) 8.327 12.342 ( -1.067 1.986 1.174) 2.542 12.479 ( -5.391 2.248 5.199) 7.820 12.729 ( -17.258 0.618 -0.719) 17.284 12.860 ( 7.471 0.703 -10.474) 12.885 13.022 ( 3.788 -1.227 5.289) 6.620 13.101 ( -7.180 -3.702 6.336) 10.267 13.137 ( -18.211 2.190 -8.247) 20.111 13.254 ( 8.107 -3.445 -5.881) 10.592 13.395 ( -3.631 -6.483 -2.487) 7.835 13.611 ( 5.803 7.369 -3.568) 10.036 13.735 ( 1.590 0.146 -4.382) 4.664 13.830 ( -4.427 7.997 0.188) 9.143 13.939 ( -8.646 -4.930 0.070) 9.953 14.398 ( 5.096 4.499 0.513) 6.817 14.551 ( -10.488 -0.215 6.751) 12.474 14.573 ( 12.030 10.300 -1.774) 15.937 14.836 ( -12.872 9.288 0.009) 15.873 15.093 ( 6.089 -18.738 -3.565) 20.023 15.153 ( 9.042 -20.010 -2.537) 22.105 15.282 ( -1.917 -9.469 -2.554) 9.993 15.507 ( -11.728 -7.800 -9.070) 16.752 15.630 ( 7.470 12.347 1.123) 14.474 15.754 ( -3.777 5.060 -0.451) 6.330 16.606 ( 2.307 -11.106 15.547) 19.245 16.845 ( -18.436 -12.687 10.387) 24.672 17.278 ( 5.797 0.941 -1.250) 6.004 17.343 ( -0.114 2.228 1.778) 2.853 17.828 ( 4.603 -4.491 -11.879) 13.508 17.877 ( -1.966 -3.203 -12.930) 13.465 17.952 ( 2.976 2.396 -0.106) 3.822 18.012 ( -1.796 -3.490 -2.900) 4.880 18.144 ( 2.186 1.395 0.587) 2.659 18.192 ( -2.425 0.702 -1.597) 2.987 18.701 ( 11.332 18.048 2.657) 21.476 18.851 ( -3.410 16.276 -2.203) 16.775 19.311 ( 2.649 2.852 -3.721) 5.384 19.435 ( -8.152 -0.768 -7.088) 10.830 20.239 ( 5.155 0.422 -0.896) 5.249 20.351 ( -5.891 0.864 -6.979) 9.174 20.418 ( 3.702 -4.699 -3.838) 7.107 20.516 ( -6.025 -2.053 -7.537) 9.865 21.096 ( 13.405 12.473 11.820) 21.794 21.196 ( 5.402 15.435 8.072) 18.237 21.645 ( 1.155 2.559 7.456) 7.967 21.681 ( -4.583 5.219 7.078) 9.917 22.414 ( -0.715 5.014 1.659) 5.329 22.546 ( -8.615 3.794 -2.401) 9.715 22.915 ( 7.908 -11.252 2.450) 13.969 23.213 ( -18.818 -11.077 -9.005) 23.620 26.705 ( 3.646 -0.236 7.485) 8.329 26.739 ( 0.244 -2.665 9.548) 9.916 27.024 ( 8.568 -10.553 -4.680) 14.376 27.159 ( -5.017 -14.199 -7.202) 16.693 ======================= Grid point 198 (71/100) ======================= q-point: ( 0.00 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.490 ( 0.000 32.092 22.449) 39.165 4.726 ( 0.000 34.281 -2.979) 34.410 5.157 ( 0.000 -16.730 -1.858) 16.833 5.404 ( 0.000 -13.008 -31.350) 33.942 6.510 ( 0.000 -14.337 -14.231) 20.201 6.541 ( 0.000 -12.445 -13.500) 18.361 6.771 ( 0.000 2.472 -15.858) 16.049 6.979 ( 0.000 -15.661 -17.280) 23.321 7.270 ( 0.000 1.036 -9.988) 10.041 7.343 ( 0.000 -6.028 -11.857) 13.301 8.758 ( 0.000 6.592 -11.313) 13.093 8.816 ( 0.000 -1.121 -13.973) 14.017 8.989 ( 0.000 -0.712 4.728) 4.782 8.997 ( 0.000 -1.973 3.901) 4.372 9.165 ( 0.000 54.807 32.351) 63.643 9.578 ( 0.000 1.472 5.761) 5.946 9.941 ( 0.000 8.371 7.328) 11.125 10.150 ( 0.000 14.958 11.625) 18.944 10.347 ( 0.000 -1.913 9.480) 9.671 10.406 ( 0.000 3.827 11.278) 11.909 10.477 ( 0.000 1.936 5.720) 6.039 10.718 ( 0.000 -35.933 18.580) 40.453 11.230 ( 0.000 22.413 -13.727) 26.282 11.496 ( 0.000 0.491 3.025) 3.065 11.739 ( 0.000 9.189 0.955) 9.239 11.832 ( 0.000 -0.023 -0.143) 0.145 11.904 ( 0.000 14.033 5.478) 15.064 11.923 ( 0.000 4.242 4.959) 6.526 12.042 ( 0.000 1.063 3.793) 3.939 12.084 ( 0.000 2.307 8.380) 8.692 12.164 ( 0.000 -2.292 2.934) 3.723 12.242 ( 0.000 -6.248 8.192) 10.302 12.531 ( 0.000 1.748 -11.693) 11.823 12.871 ( 0.000 -31.899 -22.552) 39.066 12.887 ( 0.000 15.345 10.860) 18.799 13.036 ( 0.000 -1.126 7.373) 7.459 13.158 ( 0.000 -1.153 -0.523) 1.266 13.215 ( 0.000 7.546 3.607) 8.363 13.282 ( 0.000 0.443 9.849) 9.859 13.309 ( 0.000 9.924 10.598) 14.519 13.723 ( 0.000 11.999 -0.780) 12.024 13.805 ( 0.000 0.107 6.295) 6.296 13.857 ( 0.000 -7.306 0.534) 7.326 14.003 ( 0.000 -17.566 -15.092) 23.159 14.405 ( 0.000 7.740 -6.689) 10.230 14.491 ( 0.000 7.034 4.587) 8.398 14.771 ( 0.000 7.682 0.905) 7.735 14.892 ( 0.000 3.613 -1.220) 3.814 15.009 ( 0.000 -2.953 -7.620) 8.173 15.110 ( 0.000 -6.677 -4.289) 7.935 15.346 ( 0.000 -12.964 -19.432) 23.360 15.440 ( 0.000 -18.560 -9.715) 20.949 16.447 ( 0.000 5.683 1.964) 6.012 16.451 ( 0.000 5.596 4.929) 7.457 16.638 ( 0.000 3.447 2.165) 4.070 16.644 ( 0.000 2.510 -2.677) 3.670 17.219 ( 0.000 11.553 -6.641) 13.325 17.396 ( 0.000 -7.695 -6.602) 10.139 17.610 ( 0.000 -13.120 7.580) 15.152 17.615 ( 0.000 -11.593 5.574) 12.863 17.804 ( 0.000 1.110 -2.142) 2.413 17.859 ( 0.000 -4.299 -3.996) 5.870 18.329 ( 0.000 3.096 7.451) 8.069 18.342 ( 0.000 1.447 7.440) 7.580 18.715 ( 0.000 0.141 -1.180) 1.188 18.834 ( 0.000 -6.136 -2.326) 6.562 19.031 ( 0.000 -3.027 -6.533) 7.201 19.181 ( 0.000 -12.761 -9.091) 15.668 20.222 ( 0.000 3.814 7.138) 8.093 20.296 ( 0.000 -3.158 4.113) 5.186 20.383 ( 0.000 9.044 11.690) 14.780 20.514 ( 0.000 -4.184 11.463) 12.202 20.874 ( 0.000 6.749 -5.477) 8.692 20.985 ( 0.000 -4.856 -0.622) 4.895 21.087 ( 0.000 1.823 -10.999) 11.149 21.124 ( 0.000 -1.326 -16.237) 16.291 23.171 ( 0.000 14.683 17.191) 22.608 23.401 ( 0.000 -8.550 16.121) 18.248 23.988 ( 0.000 16.612 -20.736) 26.570 24.230 ( 0.000 -7.787 -23.951) 25.185 26.437 ( 0.000 3.150 4.987) 5.899 26.449 ( 0.000 4.441 3.268) 5.514 26.652 ( 0.000 -4.536 9.129) 10.193 26.715 ( 0.000 -8.189 3.705) 8.988 ======================= Grid point 199 (72/100) ======================= q-point: ( 0.11 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.751 ( 20.299 41.452 5.589) 46.493 4.926 ( 23.781 23.452 10.615) 35.046 5.267 ( 9.087 -1.790 -14.384) 17.108 5.604 ( 22.009 -29.600 -15.764) 40.113 6.574 ( 7.589 -13.153 -10.112) 18.244 6.614 ( 7.301 -14.141 -13.009) 20.555 6.954 ( 17.095 4.386 -16.332) 24.046 7.129 ( 13.203 -10.982 -14.651) 22.574 7.388 ( 11.557 -0.186 -11.046) 15.988 7.438 ( 8.881 -4.806 -11.838) 15.560 8.725 ( -3.553 5.902 -13.198) 14.887 8.773 ( -3.565 0.785 -13.661) 14.141 9.039 ( 3.196 1.365 5.770) 6.735 9.047 ( 2.763 -0.000 4.988) 5.702 9.212 ( 4.362 48.037 28.321) 55.934 9.543 ( -2.443 -0.795 5.967) 6.496 9.873 ( -4.827 15.654 14.617) 21.954 10.085 ( -8.141 3.860 6.539) 11.133 10.137 ( -14.680 -0.491 11.130) 18.429 10.348 ( -6.129 9.732 5.207) 12.624 10.468 ( 0.305 -0.145 2.332) 2.356 10.777 ( 5.884 -39.305 20.019) 44.500 11.230 ( 0.222 24.730 -15.725) 29.307 11.522 ( 1.343 -0.058 0.874) 1.603 11.779 ( -5.380 9.406 2.997) 11.243 11.839 ( 4.916 10.063 4.531) 12.082 11.903 ( 3.817 -1.035 2.671) 4.772 11.970 ( 1.503 4.563 8.783) 10.011 12.050 ( 2.090 0.917 2.510) 3.392 12.123 ( 4.482 -2.176 4.108) 6.458 12.195 ( 3.015 2.943 6.218) 7.511 12.323 ( 6.148 -7.150 9.589) 13.449 12.460 ( -5.288 8.300 -10.173) 14.155 12.793 ( -6.633 8.754 8.179) 13.694 12.848 ( -0.643 -17.173 -5.559) 18.062 12.898 ( -3.194 -5.376 1.373) 6.402 13.107 ( -3.030 -3.949 -4.438) 6.669 13.163 ( -7.147 -1.662 5.913) 9.424 13.484 ( 4.651 9.791 0.051) 10.840 13.519 ( 7.534 8.867 0.562) 11.649 13.558 ( -4.639 1.292 -3.631) 6.031 13.797 ( 3.598 -9.516 -0.950) 10.218 13.920 ( 6.103 -0.190 6.400) 8.846 14.084 ( 7.927 -4.642 -1.534) 9.313 14.345 ( -3.474 7.609 -3.153) 8.939 14.492 ( 0.982 -2.980 3.466) 4.675 14.855 ( -1.046 4.993 -8.945) 10.297 14.874 ( 2.516 -2.077 7.137) 7.847 15.061 ( 4.031 5.326 4.483) 8.044 15.233 ( 6.326 7.999 -13.975) 17.300 15.308 ( -0.799 -17.368 -17.440) 24.626 15.512 ( 7.441 -16.639 -8.953) 20.307 15.960 ( -28.970 5.931 -1.640) 29.616 16.076 ( -24.820 -4.434 -2.729) 25.360 16.878 ( 8.181 5.261 9.618) 13.679 16.940 ( 13.041 1.536 2.368) 13.343 17.184 ( -4.156 7.216 -4.979) 9.702 17.358 ( -3.892 -11.458 -4.652) 12.964 17.535 ( 0.145 -1.876 4.252) 4.650 17.646 ( -0.580 -10.038 3.500) 10.646 17.863 ( 3.862 -2.533 -3.226) 5.634 17.879 ( 3.609 -2.890 -5.875) 7.476 18.296 ( -2.575 4.164 6.850) 8.420 18.331 ( -1.751 0.840 5.703) 6.025 18.652 ( -2.903 9.991 0.708) 10.428 18.903 ( 3.979 -3.919 -7.810) 9.601 19.100 ( 6.662 -9.092 -3.812) 11.899 19.239 ( 4.750 -13.033 -8.068) 16.047 20.210 ( -0.836 3.698 7.322) 8.245 20.286 ( -0.587 -3.426 4.888) 5.998 20.423 ( 3.828 8.253 11.499) 14.663 20.545 ( 2.873 -3.788 11.960) 12.870 20.883 ( 0.760 7.265 -5.048) 8.880 20.990 ( -0.327 -3.462 -1.705) 3.873 21.102 ( 1.738 0.761 -11.791) 11.943 21.141 ( 3.368 -3.043 -14.598) 15.287 23.119 ( -5.479 13.757 16.785) 22.383 23.329 ( -7.392 -7.533 16.083) 19.237 23.886 ( -10.276 16.318 -18.747) 26.894 24.125 ( -10.553 -7.763 -22.103) 25.694 26.454 ( 2.627 3.356 5.161) 6.693 26.503 ( 4.317 1.681 3.737) 5.952 26.619 ( -1.130 0.602 8.440) 8.536 26.779 ( 4.384 -11.815 1.001) 12.642 ======================= Grid point 200 (73/100) ======================= q-point: ( 0.22 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.161 ( 23.930 41.485 -6.452) 48.324 5.495 ( 17.264 7.427 -16.273) 24.860 5.634 ( 39.784 14.791 15.720) 45.262 6.179 ( 31.874 -37.890 -7.082) 50.018 6.822 ( 16.656 -9.226 -5.302) 19.765 6.849 ( 18.192 -11.776 -3.937) 22.025 7.326 ( 17.241 4.042 -14.049) 22.604 7.396 ( 12.021 -2.372 -7.368) 14.297 7.642 ( 12.055 1.956 -12.208) 17.268 7.684 ( 15.960 -1.743 -11.908) 19.989 8.604 ( -9.285 5.277 -15.730) 19.013 8.648 ( -11.323 2.434 -14.151) 18.286 8.991 ( -6.698 6.036 1.590) 9.155 8.997 ( -11.166 7.290 3.423) 13.767 9.292 ( 2.127 24.204 16.316) 29.268 9.507 ( -3.169 -8.907 5.555) 10.965 9.869 ( 5.186 4.460 13.296) 14.952 9.941 ( 2.393 -3.061 2.125) 4.429 10.006 ( 5.512 23.176 12.021) 26.684 10.279 ( -2.020 16.905 7.220) 18.493 10.438 ( -3.250 -4.497 -0.861) 5.615 10.947 ( 10.564 -46.111 25.546) 53.763 11.273 ( 6.025 26.435 -19.230) 33.240 11.507 ( -3.720 5.239 2.329) 6.835 11.671 ( -2.594 7.160 7.207) 10.485 11.847 ( -5.976 0.435 3.720) 7.053 11.888 ( -1.478 -0.240 7.820) 7.962 11.974 ( -1.349 -1.342 11.870) 12.021 12.152 ( 1.607 -0.411 0.277) 1.682 12.190 ( -2.965 3.665 -4.436) 6.473 12.293 ( 10.105 8.047 4.318) 13.620 12.479 ( 9.718 12.584 3.681) 16.320 12.499 ( 13.762 -1.860 3.616) 14.350 12.679 ( -3.722 -0.103 1.951) 4.203 12.812 ( -10.474 -4.297 11.191) 15.919 12.920 ( 1.010 -10.842 1.404) 10.979 13.003 ( -4.843 -1.409 -2.796) 5.767 13.045 ( 0.566 -11.214 -6.421) 12.934 13.351 ( -8.958 -0.769 -7.801) 11.904 13.369 ( -8.065 -2.113 -10.806) 13.648 13.730 ( 6.849 8.273 1.184) 10.805 13.941 ( 2.049 -10.269 0.020) 10.471 14.106 ( 12.059 8.244 6.781) 16.105 14.264 ( 7.093 -1.071 4.995) 8.741 14.352 ( 1.947 10.246 -2.084) 10.636 14.482 ( -0.135 -1.760 4.685) 5.007 14.788 ( -8.296 1.033 -7.415) 11.175 14.898 ( -1.916 -7.616 3.227) 8.491 15.055 ( -3.363 0.664 -4.338) 5.529 15.108 ( -9.624 -5.252 -5.633) 12.327 15.313 ( -15.134 8.663 4.609) 18.037 15.504 ( -5.726 -2.049 -9.174) 11.007 15.667 ( 1.334 -0.142 -10.535) 10.620 15.775 ( 0.074 -11.893 -7.221) 13.914 16.904 ( -3.436 2.008 7.066) 8.110 17.005 ( -5.563 -7.038 0.246) 8.974 17.144 ( 0.238 3.211 4.126) 5.234 17.252 ( -3.786 -8.147 4.665) 10.123 17.590 ( 3.169 2.842 0.553) 4.293 17.697 ( 5.634 -6.929 -5.540) 10.509 17.939 ( 4.012 0.431 -4.742) 6.227 17.966 ( 3.686 -1.898 -5.895) 7.207 18.230 ( -3.911 3.361 3.776) 6.391 18.278 ( -3.385 -1.355 2.217) 4.268 18.667 ( 5.135 20.718 1.874) 21.427 18.974 ( 3.545 0.707 -11.205) 11.774 19.250 ( 7.615 -12.773 -2.221) 15.036 19.318 ( 2.692 -9.353 -4.910) 10.901 20.198 ( -0.457 3.542 6.602) 7.506 20.279 ( -0.235 -4.210 5.100) 6.617 20.512 ( 3.715 6.076 5.456) 8.971 20.612 ( 3.201 -3.173 8.577) 9.689 20.892 ( 0.721 7.308 -5.248) 9.026 20.994 ( 3.000 -2.228 1.901) 4.192 21.181 ( 7.764 2.462 -10.968) 13.661 21.297 ( 11.888 -7.703 -7.692) 16.119 22.955 ( -11.087 11.005 14.756) 21.489 23.114 ( -14.303 -4.907 14.844) 21.189 23.596 ( -18.860 15.363 -13.191) 27.672 23.833 ( -18.675 -8.457 -17.376) 26.873 26.540 ( 5.806 1.791 4.771) 7.725 26.598 ( 4.849 -4.247 7.198) 9.662 26.638 ( 3.351 7.981 2.533) 9.019 26.860 ( 3.669 -13.814 -2.402) 14.494 ======================= Grid point 201 (74/100) ======================= q-point: ( 0.33 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.709 ( 31.658 33.484 -4.713) 46.321 5.900 ( 24.509 13.636 -12.413) 30.671 6.366 ( 32.012 6.379 13.751) 35.419 6.714 ( 22.240 -29.922 -6.627) 37.866 7.149 ( 13.610 0.730 3.195) 13.999 7.273 ( 17.994 -10.972 8.732) 22.812 7.503 ( -2.746 6.157 1.093) 6.830 7.548 ( 4.261 2.004 -4.525) 6.531 7.842 ( 2.608 5.579 -7.713) 9.870 7.918 ( 7.556 0.381 -12.521) 14.630 8.351 ( -10.865 13.111 -12.724) 21.257 8.385 ( -12.489 3.386 -15.398) 20.113 8.772 ( -7.272 -1.291 -18.233) 19.671 8.876 ( -0.093 -6.188 -18.437) 19.448 9.289 ( -1.945 9.110 5.081) 10.611 9.453 ( -0.019 -9.034 -0.726) 9.063 10.073 ( 12.318 3.631 6.022) 14.184 10.098 ( 6.071 8.836 0.633) 10.739 10.119 ( -2.163 11.005 3.967) 11.897 10.345 ( -1.023 -3.989 0.458) 4.144 10.475 ( 22.840 23.512 25.740) 41.678 11.157 ( 12.389 -28.710 20.089) 37.166 11.442 ( 1.957 13.545 7.414) 15.565 11.530 ( 16.917 0.536 -3.381) 17.260 11.668 ( -0.131 1.460 10.051) 10.158 11.761 ( -1.700 -1.388 6.131) 6.512 11.840 ( -1.419 3.413 6.498) 7.475 11.929 ( -2.764 -6.905 12.160) 14.254 12.086 ( -4.838 11.349 -2.793) 12.650 12.164 ( -1.161 2.300 3.950) 4.716 12.380 ( -8.683 7.912 3.439) 12.241 12.464 ( -8.927 1.554 6.131) 10.940 12.526 ( -4.691 0.739 9.133) 10.294 12.796 ( 2.594 1.177 -8.083) 8.571 12.838 ( 6.272 -5.297 -3.567) 8.951 12.898 ( 10.583 -2.317 -1.890) 10.997 13.004 ( -0.801 -12.266 -5.906) 13.637 13.021 ( -2.010 -4.292 3.891) 6.132 13.230 ( -0.095 -5.167 -6.956) 8.666 13.299 ( -0.042 -5.883 -4.860) 7.631 13.829 ( 3.358 4.887 -1.431) 6.100 13.876 ( -8.854 3.084 -0.008) 9.376 14.148 ( -11.311 8.313 -3.740) 14.527 14.184 ( -23.417 3.698 -7.514) 24.869 14.314 ( 5.835 1.696 4.318) 7.454 14.531 ( -0.054 -8.925 -0.260) 8.929 14.584 ( -0.281 2.672 -3.610) 4.500 14.806 ( -6.563 -9.744 -6.959) 13.655 14.889 ( -7.681 -1.519 8.843) 11.811 15.031 ( -0.063 -9.796 0.605) 9.815 15.266 ( 4.366 12.906 -0.893) 13.653 15.465 ( 1.400 -6.355 -9.365) 11.404 15.741 ( 0.861 4.068 -1.505) 4.422 15.764 ( 4.483 0.600 -0.328) 4.535 16.713 ( -15.459 2.305 13.954) 20.952 16.870 ( -9.603 -12.037 11.613) 19.287 17.204 ( 4.624 1.866 -8.975) 10.268 17.267 ( 8.383 -2.391 -3.657) 9.454 17.666 ( 2.816 1.529 -0.643) 3.269 17.759 ( -0.124 -7.865 -6.127) 9.970 17.995 ( 1.778 2.407 -2.645) 3.994 18.018 ( 2.075 0.648 -3.553) 4.166 18.159 ( -3.079 1.992 1.228) 3.867 18.213 ( -2.931 -2.878 -0.770) 4.179 18.838 ( 11.120 20.004 0.133) 22.887 19.050 ( 4.502 4.127 -9.019) 10.892 19.337 ( -0.161 -3.809 -0.049) 3.813 19.368 ( 3.105 -9.568 -2.219) 10.301 20.198 ( 0.968 3.036 2.969) 4.355 20.277 ( 0.427 -4.630 2.037) 5.076 20.501 ( -4.555 4.292 -7.848) 10.039 20.593 ( -5.706 -4.207 -6.704) 9.757 21.020 ( 13.515 10.033 8.307) 18.770 21.168 ( 14.134 -1.391 9.833) 17.274 21.404 ( 13.787 3.335 -3.366) 14.579 21.563 ( 13.370 -8.780 -2.762) 16.232 22.709 ( -12.900 6.619 9.476) 17.321 22.804 ( -15.486 -2.147 11.502) 19.409 23.175 ( -23.223 13.099 -6.794) 27.515 23.419 ( -22.949 -10.671 -12.044) 28.028 26.657 ( 5.355 0.734 5.285) 7.559 26.690 ( 4.638 2.239 3.744) 6.367 26.732 ( 5.501 0.161 0.957) 5.586 26.913 ( 1.484 -12.953 -3.398) 13.473 ======================= Grid point 202 (75/100) ======================= q-point: ( 0.44 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.364 ( 33.047 26.557 -1.533) 42.423 6.423 ( 26.911 18.833 -3.374) 33.019 6.814 ( 7.777 6.296 10.023) 14.162 6.964 ( -8.005 -1.287 -1.414) 8.230 7.181 ( -5.319 10.650 4.918) 12.881 7.287 ( -5.180 0.471 4.368) 6.792 7.378 ( -13.091 -6.158 11.423) 18.434 7.432 ( -2.626 -12.006 6.383) 13.849 7.928 ( 9.225 5.286 -9.899) 14.527 8.063 ( 6.690 0.200 -15.854) 17.209 8.132 ( -7.190 -0.890 -15.532) 17.139 8.293 ( -8.357 -5.910 -15.464) 18.545 8.802 ( 14.020 14.077 -22.668) 30.142 9.034 ( 1.109 10.210 -21.891) 24.181 9.245 ( 5.310 -14.363 -8.311) 17.423 9.442 ( -5.354 -18.762 -14.060) 24.049 10.051 ( -0.707 15.847 5.142) 16.676 10.102 ( -3.889 9.333 4.257) 10.970 10.237 ( 4.526 -2.036 1.074) 5.077 10.307 ( -2.929 -6.253 -3.967) 7.964 11.044 ( 30.790 26.537 29.701) 50.343 11.439 ( 9.678 -5.156 15.241) 18.776 11.556 ( -0.518 3.215 14.156) 14.525 11.607 ( -1.919 5.216 13.941) 15.008 11.713 ( -3.632 -0.532 12.001) 12.550 11.764 ( -1.018 3.322 12.476) 12.951 11.880 ( 4.230 3.138 10.689) 11.916 11.936 ( 8.083 3.478 9.201) 12.732 11.984 ( 1.401 -6.828 12.824) 14.596 12.086 ( -8.925 -5.501 10.127) 14.576 12.225 ( -3.186 -7.968 10.745) 13.751 12.309 ( -5.270 -7.293 6.360) 11.018 12.526 ( 2.965 13.179 -6.661) 15.061 12.714 ( -10.040 1.611 -10.882) 14.894 12.801 ( 0.978 -5.960 -11.860) 13.309 12.890 ( -6.460 -13.373 -5.648) 15.889 13.017 ( 4.219 1.841 -5.775) 7.385 13.130 ( 5.528 -8.601 -8.743) 13.453 13.268 ( -4.708 0.262 -5.966) 7.604 13.276 ( -9.590 1.342 -7.119) 12.019 13.744 ( 3.818 6.051 -4.145) 8.269 13.806 ( -1.906 4.810 -6.515) 8.319 13.868 ( -0.722 3.368 -2.254) 4.116 13.983 ( -8.862 -0.008 -4.717) 10.039 14.399 ( 2.593 0.426 0.848) 2.761 14.471 ( -5.114 -0.132 1.242) 5.264 14.607 ( 1.837 -19.505 -2.275) 19.723 14.668 ( -5.246 -18.880 0.217) 19.596 14.916 ( 8.092 14.362 -0.219) 16.486 15.097 ( 0.538 4.499 -4.064) 6.087 15.172 ( -4.076 1.657 -3.256) 5.474 15.356 ( -11.470 -8.217 -8.001) 16.220 15.932 ( 14.892 13.276 9.077) 21.919 15.999 ( 14.332 10.707 5.869) 18.829 16.418 ( -11.155 -4.854 15.635) 19.810 16.563 ( -18.701 -14.759 12.188) 26.759 17.370 ( 9.091 7.748 -7.523) 14.116 17.429 ( 5.156 4.979 -4.533) 8.481 17.663 ( -1.596 -8.748 -7.442) 11.596 17.705 ( -4.442 -10.464 -8.191) 14.012 18.028 ( 1.799 4.318 -0.594) 4.716 18.051 ( 0.415 4.397 -1.905) 4.809 18.124 ( 0.226 -2.307 0.209) 2.328 18.161 ( -2.559 -3.577 -1.342) 4.598 19.051 ( 9.380 15.572 0.957) 18.204 19.136 ( 2.280 10.642 -1.973) 11.061 19.312 ( -0.815 -3.291 -0.237) 3.398 19.362 ( -3.441 -6.515 -1.935) 7.618 20.255 ( 5.013 1.877 -3.715) 6.515 20.320 ( 4.384 -4.457 -4.672) 7.805 20.379 ( -6.920 2.342 -9.293) 11.820 20.447 ( -7.903 -4.136 -9.314) 12.896 21.348 ( 17.228 11.742 11.903) 24.007 21.461 ( 11.742 6.645 10.211) 16.920 21.618 ( 4.530 -1.067 6.388) 7.903 21.702 ( -1.419 -3.344 6.118) 7.115 22.525 ( -1.905 6.162 2.409) 6.885 22.654 ( 0.853 -1.731 -1.107) 2.225 22.749 ( -15.080 3.469 -0.761) 15.493 22.972 ( -21.273 -12.896 -7.188) 25.895 26.736 ( 2.603 2.568 4.313) 5.655 26.751 ( 1.185 5.049 2.517) 5.765 26.841 ( 5.043 -7.455 -0.484) 9.013 26.910 ( -1.865 -10.558 -2.472) 11.003 ======================= Grid point 243 (76/100) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 50 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.046 ( 0.000 0.000 -59.731) 59.731 4.046 ( 0.000 0.000 59.731) 59.731 4.113 ( 0.000 0.000 -59.924) 59.924 4.113 ( 0.000 0.000 59.924) 59.924 5.815 ( 0.000 0.000 -89.136) 89.136 5.815 ( 0.000 0.000 89.136) 89.136 7.122 ( 0.000 0.000 -1.120) 1.120 7.122 ( 0.000 0.000 1.120) 1.120 7.527 ( 0.000 0.000 -0.871) 0.871 7.527 ( 0.000 0.000 0.871) 0.871 8.076 ( 0.000 0.000 -18.412) 18.412 8.076 ( 0.000 0.000 18.412) 18.412 8.553 ( 0.000 0.000 -0.387) 0.387 8.553 ( 0.000 0.000 0.387) 0.387 9.694 ( 0.000 0.000 -3.172) 3.172 9.694 ( 0.000 0.000 3.172) 3.172 9.935 ( 0.000 0.000 -4.488) 4.488 9.935 ( 0.000 0.000 4.488) 4.488 10.082 ( 0.000 0.000 -15.123) 15.123 10.082 ( 0.000 0.000 15.123) 15.123 10.137 ( 0.000 0.000 -14.482) 14.482 10.137 ( 0.000 0.000 14.482) 14.482 10.514 ( 0.000 0.000 -16.004) 16.004 10.514 ( 0.000 0.000 16.004) 16.004 10.541 ( 0.000 0.000 -10.410) 10.410 10.541 ( 0.000 0.000 10.410) 10.410 11.496 ( 0.000 0.000 -5.733) 5.733 11.496 ( 0.000 0.000 5.733) 5.733 11.772 ( 0.000 0.000 -5.593) 5.593 11.772 ( 0.000 0.000 5.593) 5.593 12.040 ( 0.000 0.000 -11.098) 11.098 12.040 ( 0.000 0.000 11.098) 11.098 12.150 ( 0.000 0.000 -12.517) 12.517 12.150 ( 0.000 0.000 12.517) 12.517 12.300 ( 0.000 0.000 -9.206) 9.206 12.300 ( 0.000 0.000 9.206) 9.206 13.305 ( 0.000 0.000 -5.567) 5.567 13.305 ( 0.000 0.000 5.567) 5.567 13.370 ( 0.000 0.000 -4.467) 4.467 13.370 ( 0.000 0.000 4.467) 4.467 13.886 ( 0.000 0.000 -8.200) 8.200 13.886 ( 0.000 0.000 8.200) 8.200 14.204 ( 0.000 0.000 -5.790) 5.790 14.204 ( 0.000 0.000 5.790) 5.790 15.001 ( 0.000 0.000 -5.270) 5.270 15.001 ( 0.000 0.000 5.270) 5.270 15.470 ( 0.000 0.000 -5.316) 5.316 15.470 ( 0.000 0.000 5.316) 5.316 15.541 ( 0.000 0.000 -34.603) 34.603 15.541 ( 0.000 0.000 34.603) 34.603 16.026 ( 0.000 0.000 -27.288) 27.288 16.026 ( 0.000 0.000 27.288) 27.288 16.368 ( 0.000 0.000 -33.602) 33.602 16.368 ( 0.000 0.000 33.602) 33.602 16.899 ( 0.000 0.000 -18.494) 18.494 16.899 ( 0.000 0.000 18.494) 18.494 17.208 ( 0.000 0.000 -7.275) 7.275 17.208 ( 0.000 0.000 7.275) 7.275 17.817 ( 0.000 0.000 -1.142) 1.142 17.817 ( 0.000 0.000 1.142) 1.142 17.977 ( 0.000 0.000 -0.664) 0.664 17.977 ( 0.000 0.000 0.664) 0.664 18.224 ( 0.000 0.000 -2.294) 2.294 18.224 ( 0.000 0.000 2.294) 2.294 19.126 ( 0.000 0.000 -8.878) 8.878 19.126 ( 0.000 0.000 8.878) 8.878 19.807 ( 0.000 0.000 -8.246) 8.246 19.807 ( 0.000 0.000 8.246) 8.246 20.403 ( 0.000 0.000 -2.708) 2.708 20.403 ( 0.000 0.000 2.708) 2.708 20.516 ( 0.000 0.000 -5.361) 5.361 20.516 ( 0.000 0.000 5.361) 5.361 20.932 ( 0.000 0.000 -6.049) 6.049 20.932 ( 0.000 0.000 6.049) 6.049 21.225 ( 0.000 0.000 -2.905) 2.905 21.225 ( 0.000 0.000 2.905) 2.905 21.948 ( 0.000 0.000 -15.109) 15.109 21.948 ( 0.000 0.000 15.109) 15.109 23.689 ( 0.000 0.000 -8.317) 8.317 23.689 ( 0.000 0.000 8.317) 8.317 26.259 ( 0.000 0.000 -6.473) 6.473 26.259 ( 0.000 0.000 6.473) 6.473 27.428 ( 0.000 0.000 -9.052) 9.052 27.428 ( 0.000 0.000 9.052) 9.052 ======================= Grid point 245 (77/100) ======================= q-point: ( 0.11 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.099 ( 1.592 0.000 -62.179) 62.199 4.099 ( 1.592 0.000 62.179) 62.199 4.118 ( 7.321 0.000 -57.516) 57.980 4.118 ( 7.321 0.000 57.516) 57.980 6.293 ( 44.388 0.000 -77.789) 89.563 6.293 ( 44.388 0.000 77.789) 89.563 7.080 ( -4.171 0.000 -1.900) 4.583 7.080 ( -4.171 0.000 1.900) 4.583 7.552 ( -0.637 0.000 -4.919) 4.960 7.552 ( -0.637 0.000 4.919) 4.960 7.883 ( -18.008 0.000 -13.980) 22.797 7.883 ( -18.008 0.000 13.980) 22.797 8.521 ( -0.748 0.000 -1.381) 1.571 8.521 ( -0.748 0.000 1.381) 1.571 9.535 ( -12.583 0.000 -4.162) 13.254 9.535 ( -12.583 0.000 4.162) 13.254 9.892 ( -11.358 0.000 -7.629) 13.683 9.892 ( -11.358 0.000 7.629) 13.683 10.062 ( 9.613 0.000 -5.553) 11.101 10.062 ( 9.613 0.000 5.553) 11.101 10.185 ( 9.153 0.000 -18.368) 20.522 10.185 ( 9.153 0.000 18.368) 20.522 10.837 ( 25.948 0.000 -11.275) 28.292 10.837 ( 25.948 0.000 11.275) 28.292 10.869 ( 24.853 0.000 -17.583) 30.444 10.869 ( 24.853 0.000 17.583) 30.444 11.573 ( 7.114 0.000 -4.671) 8.510 11.573 ( 7.114 0.000 4.671) 8.510 11.782 ( 2.119 0.000 -6.622) 6.953 11.782 ( 2.119 0.000 6.622) 6.953 12.020 ( -2.568 0.000 -14.306) 14.535 12.020 ( -2.568 0.000 14.306) 14.535 12.229 ( 7.474 0.000 -12.133) 14.251 12.229 ( 7.474 0.000 12.133) 14.251 12.319 ( 3.229 0.000 -11.839) 12.272 12.319 ( 3.229 0.000 11.839) 12.272 13.281 ( -1.613 0.000 -8.880) 9.025 13.281 ( -1.613 0.000 8.880) 9.025 13.300 ( -6.168 0.000 -3.429) 7.057 13.300 ( -6.168 0.000 3.429) 7.057 13.951 ( 5.282 0.000 -9.261) 10.661 13.951 ( 5.282 0.000 9.261) 10.661 14.185 ( -4.836 0.000 -18.691) 19.306 14.185 ( -4.836 0.000 18.691) 19.306 14.972 ( -5.752 0.000 -8.351) 10.140 14.972 ( -5.752 0.000 8.351) 10.140 15.328 ( -13.088 0.000 -30.213) 32.926 15.328 ( -13.088 0.000 30.213) 32.926 15.387 ( -8.556 0.000 -8.186) 11.841 15.387 ( -8.556 0.000 8.186) 11.841 16.003 ( -1.908 0.000 -24.181) 24.256 16.003 ( -1.908 0.000 24.181) 24.256 16.292 ( -8.650 0.000 -29.268) 30.520 16.292 ( -8.650 0.000 29.268) 30.520 16.985 ( 9.212 0.000 -8.478) 12.519 16.985 ( 9.212 0.000 8.478) 12.519 17.371 ( 12.574 0.000 -10.598) 16.444 17.371 ( 12.574 0.000 10.598) 16.444 17.779 ( -3.843 0.000 -1.369) 4.079 17.779 ( -3.843 0.000 1.369) 4.079 17.934 ( -3.996 0.000 -1.179) 4.167 17.934 ( -3.996 0.000 1.179) 4.167 18.224 ( -0.007 0.000 -2.057) 2.057 18.224 ( -0.007 0.000 2.057) 2.057 18.950 ( -16.562 0.000 -12.298) 20.629 18.950 ( -16.562 0.000 12.298) 20.629 19.707 ( -8.264 0.000 -10.684) 13.507 19.707 ( -8.264 0.000 10.684) 13.507 20.375 ( -2.830 0.000 -2.011) 3.472 20.375 ( -2.830 0.000 2.011) 3.472 20.505 ( -1.566 0.000 -4.443) 4.711 20.505 ( -1.566 0.000 4.443) 4.711 20.925 ( -0.569 0.000 -5.133) 5.165 20.925 ( -0.569 0.000 5.133) 5.165 21.313 ( 6.559 0.000 -2.230) 6.928 21.313 ( 6.559 0.000 2.230) 6.928 21.970 ( 3.111 0.000 -9.536) 10.031 21.970 ( 3.111 0.000 9.536) 10.031 23.646 ( -4.039 0.000 -10.935) 11.657 23.646 ( -4.039 0.000 10.935) 11.657 26.349 ( 8.905 0.000 -6.753) 11.176 26.349 ( 8.905 0.000 6.753) 11.176 27.472 ( 3.704 0.000 -17.800) 18.181 27.472 ( 3.704 0.000 17.800) 18.181 ======================= Grid point 247 (78/100) ======================= q-point: ( 0.22 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.258 ( 15.122 0.000 -55.830) 57.842 4.258 ( 15.122 0.000 55.830) 57.842 4.325 ( 13.561 0.000 -51.007) 52.779 4.325 ( 13.561 0.000 51.007) 52.779 6.956 ( -8.939 0.000 -5.886) 10.703 6.956 ( -8.939 0.000 5.886) 10.703 7.230 ( 9.012 0.000 -17.858) 20.004 7.230 ( 9.012 0.000 17.858) 20.004 7.461 ( -22.486 0.000 -8.584) 24.069 7.461 ( -22.486 0.000 8.584) 24.069 7.505 ( 34.098 0.000 -46.573) 57.721 7.505 ( 34.098 0.000 46.573) 57.721 8.598 ( 6.851 0.000 -0.867) 6.906 8.598 ( 6.851 0.000 0.867) 6.906 9.288 ( -11.782 0.000 -2.078) 11.964 9.288 ( -11.782 0.000 2.078) 11.964 9.831 ( 7.382 0.000 -2.821) 7.902 9.831 ( 7.382 0.000 2.821) 7.902 10.276 ( 10.548 0.000 -5.228) 11.773 10.276 ( 10.548 0.000 5.228) 11.773 10.387 ( 10.364 0.000 -16.780) 19.722 10.387 ( 10.364 0.000 16.780) 19.722 11.324 ( 19.117 0.000 -13.644) 23.486 11.324 ( 19.117 0.000 13.644) 23.486 11.423 ( 31.110 0.000 -8.415) 32.228 11.423 ( 31.110 0.000 8.415) 32.228 11.688 ( 3.765 0.000 -3.583) 5.197 11.688 ( 3.765 0.000 3.583) 5.197 11.943 ( 15.095 0.000 -3.720) 15.546 11.943 ( 15.095 0.000 3.720) 15.546 11.948 ( -3.211 0.000 -11.875) 12.302 11.948 ( -3.211 0.000 11.875) 12.302 12.423 ( 12.239 0.000 -10.989) 16.448 12.423 ( 12.239 0.000 10.989) 16.448 12.468 ( 11.728 0.000 -12.084) 16.840 12.468 ( 11.728 0.000 12.084) 16.840 13.169 ( -6.414 0.000 -3.817) 7.463 13.169 ( -6.414 0.000 3.817) 7.463 13.271 ( 0.983 0.000 -11.372) 11.414 13.271 ( 0.983 0.000 11.372) 11.414 13.854 ( -31.211 0.000 -27.443) 41.561 13.854 ( -31.211 0.000 27.443) 41.561 14.035 ( 2.036 0.000 -9.311) 9.531 14.035 ( 2.036 0.000 9.311) 9.531 14.748 ( -11.120 0.000 -18.779) 21.824 14.748 ( -11.120 0.000 18.779) 21.824 15.133 ( -17.380 0.000 -13.458) 21.982 15.133 ( -17.380 0.000 13.458) 21.982 15.248 ( -0.656 0.000 -9.122) 9.145 15.248 ( -0.656 0.000 9.122) 9.145 15.976 ( -0.215 0.000 -16.621) 16.622 15.976 ( -0.215 0.000 16.621) 16.622 16.129 ( -4.219 0.000 -17.834) 18.327 16.129 ( -4.219 0.000 17.834) 18.327 17.161 ( 6.814 0.000 -8.419) 10.831 17.161 ( 6.814 0.000 8.419) 10.831 17.587 ( 7.502 0.000 -14.358) 16.200 17.587 ( 7.502 0.000 14.358) 16.200 17.670 ( -7.195 0.000 -1.675) 7.388 17.670 ( -7.195 0.000 1.675) 7.388 17.848 ( -3.819 0.000 -1.913) 4.272 17.848 ( -3.819 0.000 1.913) 4.272 18.224 ( -0.023 0.000 -1.502) 1.502 18.224 ( -0.023 0.000 1.502) 1.502 18.568 ( -19.890 0.000 -14.264) 24.476 18.568 ( -19.890 0.000 14.264) 24.476 19.541 ( -8.004 0.000 -13.063) 15.320 19.541 ( -8.004 0.000 13.063) 15.320 20.298 ( -4.699 0.000 -0.702) 4.751 20.298 ( -4.699 0.000 0.702) 4.751 20.454 ( -3.360 0.000 -2.683) 4.300 20.454 ( -3.360 0.000 2.683) 4.300 20.915 ( -0.396 0.000 -3.156) 3.181 20.915 ( -0.396 0.000 3.156) 3.181 21.385 ( 0.054 0.000 -5.365) 5.365 21.385 ( 0.054 0.000 5.365) 5.365 22.096 ( 9.349 0.000 -3.785) 10.086 22.096 ( 9.349 0.000 3.785) 10.086 23.552 ( -5.067 0.000 -14.803) 15.646 23.552 ( -5.067 0.000 14.803) 15.646 26.586 ( 14.522 0.000 -8.317) 16.736 26.586 ( 14.522 0.000 8.317) 16.736 27.535 ( 1.903 0.000 -23.994) 24.069 27.535 ( 1.903 0.000 23.994) 24.069 ======================= Grid point 249 (79/100) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.628 ( 16.540 0.000 -39.639) 42.952 4.628 ( 16.540 0.000 39.639) 42.952 4.671 ( 25.987 0.000 -40.437) 48.068 4.671 ( 25.987 0.000 40.437) 48.068 6.691 ( -18.277 0.000 -13.472) 22.706 6.691 ( -18.277 0.000 13.472) 22.706 6.782 ( -31.121 0.000 -2.196) 31.199 6.782 ( -31.121 0.000 2.196) 31.199 7.113 ( -11.342 0.000 -6.808) 13.229 7.113 ( -11.342 0.000 6.808) 13.229 8.601 ( 23.577 0.000 -13.858) 27.348 8.601 ( 23.577 0.000 13.858) 27.348 8.802 ( 43.407 0.000 -36.253) 56.555 8.802 ( 43.407 0.000 36.253) 56.555 9.092 ( -7.917 0.000 -0.947) 7.973 9.092 ( -7.917 0.000 0.947) 7.973 10.145 ( 20.526 0.000 -7.788) 21.954 10.145 ( 20.526 0.000 7.788) 21.954 10.470 ( 10.812 0.000 -2.718) 11.148 10.470 ( 10.812 0.000 2.718) 11.148 10.561 ( 7.100 0.000 -11.008) 13.099 10.561 ( 7.100 0.000 11.008) 13.099 11.527 ( 1.563 0.000 -2.305) 2.785 11.527 ( 1.563 0.000 2.305) 2.785 11.696 ( 1.492 0.000 -4.791) 5.018 11.696 ( 1.492 0.000 4.791) 5.018 11.973 ( 5.616 0.000 -6.369) 8.491 11.973 ( 5.616 0.000 6.369) 8.491 12.029 ( 24.392 0.000 -6.109) 25.146 12.029 ( 24.392 0.000 6.109) 25.146 12.286 ( 17.487 0.000 -5.676) 18.385 12.286 ( 17.487 0.000 5.676) 18.385 12.697 ( 5.389 0.000 -8.195) 9.808 12.697 ( 5.389 0.000 8.195) 9.808 12.713 ( 16.961 0.000 -6.895) 18.309 12.713 ( 16.961 0.000 6.895) 18.309 13.038 ( -42.517 0.000 -31.255) 52.769 13.038 ( -42.517 0.000 31.255) 52.769 13.089 ( 0.333 0.000 -4.813) 4.825 13.089 ( 0.333 0.000 4.813) 4.825 13.373 ( 8.304 0.000 -13.922) 16.211 13.373 ( 8.304 0.000 13.922) 16.211 13.999 ( -5.735 0.000 -8.328) 10.112 13.999 ( -5.735 0.000 8.328) 10.112 14.574 ( -9.338 0.000 -22.555) 24.411 14.574 ( -9.338 0.000 22.555) 24.411 14.717 ( -24.603 0.000 -16.628) 29.695 14.717 ( -24.603 0.000 16.628) 29.695 15.117 ( -11.947 0.000 -1.361) 12.024 15.117 ( -11.947 0.000 1.361) 12.024 16.012 ( 3.762 0.000 -8.586) 9.374 16.012 ( 3.762 0.000 8.586) 9.374 16.230 ( 13.520 0.000 -12.865) 18.663 16.230 ( 13.520 0.000 12.865) 18.663 17.229 ( -0.145 0.000 -10.979) 10.980 17.229 ( -0.145 0.000 10.979) 10.980 17.511 ( -8.422 0.000 -1.517) 8.557 17.511 ( -8.422 0.000 1.517) 8.557 17.605 ( -4.074 0.000 -5.680) 6.990 17.605 ( -4.074 0.000 5.680) 6.990 17.826 ( 1.330 0.000 -3.486) 3.731 17.826 ( 1.330 0.000 3.486) 3.731 18.223 ( -0.032 0.000 -0.873) 0.874 18.223 ( -0.032 0.000 0.873) 0.874 18.239 ( -13.652 0.000 -10.142) 17.007 18.239 ( -13.652 0.000 10.142) 17.007 19.411 ( -4.896 0.000 -10.255) 11.363 19.411 ( -4.896 0.000 10.255) 11.363 20.206 ( -4.301 0.000 -0.309) 4.312 20.206 ( -4.301 0.000 0.309) 4.312 20.388 ( -3.049 0.000 -3.147) 4.382 20.388 ( -3.049 0.000 3.147) 4.382 20.911 ( -0.033 0.000 -1.443) 1.444 20.911 ( -0.033 0.000 1.443) 1.444 21.345 ( -3.009 0.000 -7.246) 7.845 21.345 ( -3.009 0.000 7.246) 7.845 22.285 ( 8.677 0.000 -8.425) 12.094 22.285 ( 8.677 0.000 8.425) 12.094 23.463 ( -3.728 0.000 -13.891) 14.383 23.463 ( -3.728 0.000 13.891) 14.383 26.889 ( 15.769 0.000 -11.323) 19.413 26.889 ( 15.769 0.000 11.323) 19.413 27.525 ( -3.183 0.000 -23.354) 23.570 27.525 ( -3.183 0.000 23.354) 23.570 ======================= Grid point 251 (80/100) ======================= q-point: ( 0.44 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.911 ( 9.717 0.000 -17.723) 20.212 4.911 ( 9.717 0.000 17.723) 20.212 5.204 ( 24.301 0.000 -19.917) 31.420 5.204 ( 24.301 0.000 19.917) 31.420 6.179 ( -26.174 0.000 -5.756) 26.800 6.179 ( -26.174 0.000 5.756) 26.800 6.357 ( -11.668 0.000 -9.084) 14.787 6.357 ( -11.668 0.000 9.084) 14.787 6.987 ( -2.762 0.000 -2.352) 3.627 6.987 ( -2.762 0.000 2.352) 3.627 8.666 ( -0.010 0.000 -1.046) 1.046 8.666 ( -0.010 0.000 1.046) 1.046 8.986 ( -2.773 0.000 -0.340) 2.793 8.986 ( -2.773 0.000 0.340) 2.793 9.792 ( 31.018 0.000 -20.689) 37.285 9.792 ( 31.018 0.000 20.689) 37.285 10.491 ( 14.093 0.000 -5.769) 15.228 10.491 ( 14.093 0.000 5.769) 15.228 10.656 ( 2.453 0.000 -3.767) 4.495 10.656 ( 2.453 0.000 3.767) 4.495 10.810 ( 27.600 0.000 -18.530) 33.243 10.810 ( 27.600 0.000 18.530) 33.243 11.457 ( -11.307 0.000 -9.847) 14.994 11.457 ( -11.307 0.000 9.847) 14.994 11.712 ( 0.375 0.000 -1.804) 1.843 11.712 ( 0.375 0.000 1.804) 1.843 11.888 ( -30.526 0.000 -21.859) 37.546 11.888 ( -30.526 0.000 21.859) 37.546 12.208 ( -7.891 0.000 -11.329) 13.806 12.208 ( -7.891 0.000 11.329) 13.806 12.359 ( 9.552 0.000 -8.043) 12.487 12.359 ( 9.552 0.000 8.043) 12.487 12.506 ( 2.898 0.000 -6.971) 7.549 12.506 ( 2.898 0.000 6.971) 7.549 12.854 ( 0.777 0.000 -3.522) 3.607 12.854 ( 0.777 0.000 3.522) 3.607 13.009 ( 11.563 0.000 -5.671) 12.879 13.009 ( 11.563 0.000 5.671) 12.879 13.254 ( 11.245 0.000 -2.307) 11.479 13.254 ( 11.245 0.000 2.307) 11.479 13.667 ( 17.583 0.000 -14.910) 23.053 13.667 ( 17.583 0.000 14.910) 23.053 13.888 ( -0.184 0.000 -13.201) 13.203 13.888 ( -0.184 0.000 13.201) 13.203 14.212 ( -24.553 0.000 -16.853) 29.780 14.212 ( -24.553 0.000 16.853) 29.780 14.300 ( -16.929 0.000 -20.080) 26.264 14.300 ( -16.929 0.000 20.080) 26.264 14.931 ( -4.698 0.000 -2.613) 5.376 14.931 ( -4.698 0.000 2.613) 5.376 16.090 ( 2.977 0.000 -2.504) 3.891 16.090 ( 2.977 0.000 2.504) 3.891 16.521 ( 11.869 0.000 -8.921) 14.848 16.521 ( 11.869 0.000 8.921) 14.848 17.150 ( -5.899 0.000 -9.369) 11.071 17.150 ( -5.899 0.000 9.369) 11.071 17.376 ( -4.283 0.000 -0.645) 4.332 17.376 ( -4.283 0.000 0.645) 4.332 17.565 ( 0.612 0.000 -3.915) 3.962 17.565 ( 0.612 0.000 3.915) 3.962 17.870 ( 3.650 0.000 -12.221) 12.754 17.870 ( 3.650 0.000 12.221) 12.754 18.007 ( -10.091 0.000 -11.087) 14.992 18.007 ( -10.091 0.000 11.087) 14.992 18.223 ( -0.016 0.000 -0.283) 0.283 18.223 ( -0.016 0.000 0.283) 0.283 19.352 ( -1.334 0.000 -3.680) 3.914 19.352 ( -1.334 0.000 3.680) 3.914 20.145 ( -1.709 0.000 -0.187) 1.719 20.145 ( -1.709 0.000 0.187) 1.719 20.344 ( -1.202 0.000 -1.605) 2.005 20.344 ( -1.202 0.000 1.605) 2.005 20.911 ( 0.043 0.000 -0.389) 0.391 20.911 ( 0.043 0.000 0.389) 0.391 21.298 ( -1.396 0.000 -3.078) 3.380 21.298 ( -1.396 0.000 3.078) 3.380 22.405 ( 3.220 0.000 -4.024) 5.153 22.405 ( 3.220 0.000 4.024) 5.153 23.413 ( -1.311 0.000 -5.841) 5.986 23.413 ( -1.311 0.000 5.841) 5.986 27.178 ( 12.995 0.000 -14.607) 19.550 27.178 ( 12.995 0.000 14.607) 19.550 27.409 ( -8.367 0.000 -18.962) 20.726 27.409 ( -8.367 0.000 18.962) 20.726 ======================= Grid point 261 (81/100) ======================= q-point: ( 0.00 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.008 ( 0.000 -0.513 -58.733) 58.735 4.008 ( 0.000 -0.513 58.733) 58.735 4.184 ( 0.000 6.733 -54.045) 54.463 4.184 ( 0.000 6.733 54.045) 54.463 6.276 ( 0.000 42.510 -75.708) 86.826 6.276 ( 0.000 42.510 75.708) 86.826 7.230 ( 0.000 6.450 -2.500) 6.917 7.230 ( 0.000 6.450 2.500) 6.917 7.502 ( 0.000 -0.181 -1.925) 1.934 7.502 ( 0.000 -0.181 1.925) 1.934 7.980 ( 0.000 -10.359 -13.503) 17.019 7.980 ( 0.000 -10.359 13.503) 17.019 8.475 ( 0.000 -6.335 -0.094) 6.336 8.475 ( 0.000 -6.335 0.094) 6.336 9.566 ( 0.000 -16.858 -3.037) 17.129 9.566 ( 0.000 -16.858 3.037) 17.129 9.674 ( 0.000 -8.757 -5.342) 10.257 9.674 ( 0.000 -8.757 5.342) 10.257 10.014 ( 0.000 -0.769 -0.372) 0.854 10.014 ( 0.000 -0.769 0.372) 0.854 10.161 ( 0.000 3.546 -12.089) 12.599 10.161 ( 0.000 3.546 12.089) 12.599 10.829 ( 0.000 23.942 -18.146) 30.042 10.829 ( 0.000 23.942 18.146) 30.042 10.992 ( 0.000 31.463 -5.846) 32.002 10.992 ( 0.000 31.463 5.846) 32.002 11.567 ( 0.000 6.607 -4.118) 7.785 11.567 ( 0.000 6.607 4.118) 7.785 11.838 ( 0.000 3.644 -11.452) 12.018 11.838 ( 0.000 3.644 11.452) 12.018 12.044 ( 0.000 -0.542 -12.394) 12.406 12.044 ( 0.000 -0.542 12.394) 12.406 12.102 ( 0.000 4.219 -7.125) 8.280 12.102 ( 0.000 4.219 7.125) 8.280 12.506 ( 0.000 16.383 -8.898) 18.644 12.506 ( 0.000 16.383 8.898) 18.644 13.214 ( 0.000 -7.820 -7.460) 10.808 13.214 ( 0.000 -7.820 7.460) 10.808 13.346 ( 0.000 -2.755 -2.466) 3.697 13.346 ( 0.000 -2.755 2.466) 3.697 13.866 ( 0.000 -1.450 -8.187) 8.315 13.866 ( 0.000 -1.450 8.187) 8.315 14.207 ( 0.000 -0.620 -7.743) 7.768 14.207 ( 0.000 -0.620 7.743) 7.768 14.913 ( 0.000 -8.497 -6.411) 10.644 14.913 ( 0.000 -8.497 6.411) 10.644 15.345 ( 0.000 -14.038 -0.946) 14.070 15.345 ( 0.000 -14.038 0.946) 14.070 15.558 ( 0.000 -6.649 -9.435) 11.542 15.558 ( 0.000 -6.649 9.435) 11.542 15.830 ( 0.000 -0.760 -8.683) 8.716 15.830 ( 0.000 -0.760 8.683) 8.716 16.447 ( 0.000 -2.814 -26.410) 26.559 16.447 ( 0.000 -2.814 26.410) 26.559 16.837 ( 0.000 -7.290 -13.527) 15.366 16.837 ( 0.000 -7.290 13.527) 15.366 17.177 ( 0.000 1.068 -15.986) 16.022 17.177 ( 0.000 1.068 15.986) 16.022 17.820 ( 0.000 0.373 -4.772) 4.786 17.820 ( 0.000 0.373 4.772) 4.786 18.001 ( 0.000 1.683 -0.854) 1.887 18.001 ( 0.000 1.683 0.854) 1.887 18.237 ( 0.000 1.293 -0.901) 1.576 18.237 ( 0.000 1.293 0.901) 1.576 19.155 ( 0.000 -0.170 -9.629) 9.630 19.155 ( 0.000 -0.170 9.629) 9.630 19.868 ( 0.000 6.866 -7.929) 10.489 19.868 ( 0.000 6.866 7.929) 10.489 20.216 ( 0.000 -15.405 -2.097) 15.547 20.216 ( 0.000 -15.405 2.097) 15.547 20.483 ( 0.000 -6.639 -2.567) 7.118 20.483 ( 0.000 -6.639 2.567) 7.118 20.803 ( 0.000 -5.377 -7.575) 9.289 20.803 ( 0.000 -5.377 7.575) 9.289 21.227 ( 0.000 -0.872 -2.693) 2.831 21.227 ( 0.000 -0.872 2.693) 2.831 22.240 ( 0.000 24.071 -15.330) 28.538 22.240 ( 0.000 24.071 15.330) 28.538 23.737 ( 0.000 4.264 -10.558) 11.386 23.737 ( 0.000 4.264 10.558) 11.386 26.273 ( 0.000 1.442 -5.825) 6.001 26.273 ( 0.000 1.442 5.825) 6.001 27.350 ( 0.000 -7.513 -6.806) 10.138 27.350 ( 0.000 -7.513 6.806) 10.138 ======================= Grid point 263 (82/100) ======================= q-point: ( 0.11 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.855 ( -2.223 -4.530 -60.853) 61.061 3.855 ( -2.223 -4.530 60.853) 61.061 4.539 ( 21.749 21.249 -53.755) 61.759 4.539 ( 21.749 21.249 53.755) 61.759 6.586 ( 30.393 29.163 -66.593) 78.796 6.586 ( 30.393 29.163 66.593) 78.796 7.212 ( -1.547 9.134 -4.505) 10.302 7.212 ( -1.547 9.134 4.505) 10.302 7.521 ( -0.909 -1.321 -6.331) 6.531 7.521 ( -0.909 -1.321 6.331) 6.531 7.895 ( -9.091 0.779 -9.706) 13.322 7.895 ( -9.091 0.779 9.706) 13.322 8.454 ( 0.174 -5.948 -1.360) 6.104 8.454 ( 0.174 -5.948 1.360) 6.104 9.312 ( -11.754 -16.825 -3.543) 20.828 9.312 ( -11.754 -16.825 3.543) 20.828 9.837 ( -4.444 -7.480 -10.474) 13.616 9.837 ( -4.444 -7.480 10.474) 13.616 10.012 ( 11.263 -0.116 -3.961) 11.939 10.012 ( 11.263 -0.116 3.961) 11.939 10.193 ( 3.727 2.368 -8.385) 9.477 10.193 ( 3.727 2.368 8.385) 9.477 11.029 ( 16.231 16.641 -7.322) 24.372 11.029 ( 16.231 16.641 7.322) 24.372 11.193 ( 18.478 24.707 -13.203) 33.559 11.193 ( 18.478 24.707 13.203) 33.559 11.638 ( 6.984 5.534 -4.171) 9.839 11.638 ( 6.984 5.534 4.171) 9.839 11.837 ( 1.218 3.906 -10.662) 11.420 11.837 ( 1.218 3.906 10.662) 11.420 12.055 ( 0.243 3.431 -13.091) 13.535 12.055 ( 0.243 3.431 13.091) 13.535 12.158 ( 5.867 2.090 -10.370) 12.097 12.158 ( 5.867 2.090 10.370) 12.097 12.534 ( 3.601 15.618 -9.146) 18.453 12.534 ( 3.601 15.618 9.146) 18.453 13.106 ( -7.045 -10.395 -5.647) 13.769 13.106 ( -7.045 -10.395 5.647) 13.769 13.380 ( 0.529 1.870 -1.352) 2.367 13.380 ( 0.529 1.870 1.352) 2.367 13.915 ( 4.236 -3.064 -4.161) 6.682 13.915 ( 4.236 -3.064 4.161) 6.682 14.212 ( -1.806 1.627 -12.536) 12.770 14.212 ( -1.806 1.627 12.536) 12.770 14.896 ( -6.078 -7.248 -10.320) 14.000 14.896 ( -6.078 -7.248 10.320) 14.000 15.149 ( -11.379 -13.524 -22.348) 28.492 15.149 ( -11.379 -13.524 22.348) 28.492 15.474 ( -8.293 -2.407 -10.674) 13.730 15.474 ( -8.293 -2.407 10.674) 13.730 15.786 ( -4.593 -6.339 -12.401) 14.665 15.786 ( -4.593 -6.339 12.401) 14.665 16.390 ( -5.366 -0.157 -28.718) 29.216 16.390 ( -5.366 -0.157 28.718) 29.216 16.926 ( 8.200 -5.992 -4.410) 11.072 16.926 ( 8.200 -5.992 4.410) 11.072 17.313 ( 11.304 -2.819 -16.329) 20.059 17.313 ( 11.304 -2.819 16.329) 20.059 17.798 ( -2.313 1.690 -5.076) 5.828 17.798 ( -2.313 1.690 5.076) 5.828 17.966 ( -3.197 2.223 -1.375) 4.130 17.966 ( -3.197 2.223 1.375) 4.130 18.232 ( -0.742 0.886 -0.581) 1.293 18.232 ( -0.742 0.886 0.581) 1.293 18.933 ( -19.650 -3.691 -10.827) 22.737 18.933 ( -19.650 -3.691 10.827) 22.737 19.775 ( -8.493 5.965 -10.665) 14.881 19.775 ( -8.493 5.965 10.665) 14.881 20.236 ( 1.048 -8.652 -2.791) 9.152 20.236 ( 1.048 -8.652 2.791) 9.152 20.503 ( 0.946 -4.443 -2.948) 5.415 20.503 ( 0.946 -4.443 2.948) 5.415 20.807 ( 0.489 -5.754 -6.187) 8.464 20.807 ( 0.489 -5.754 6.187) 8.464 21.327 ( 8.790 -0.955 -4.024) 9.714 21.327 ( 8.790 -0.955 4.024) 9.714 22.219 ( -1.709 21.698 -11.706) 24.713 22.219 ( -1.709 21.698 11.706) 24.713 23.680 ( -5.290 3.148 -12.419) 13.861 23.680 ( -5.290 3.148 12.419) 13.861 26.356 ( 8.169 0.695 -6.159) 10.255 26.356 ( 8.169 0.695 6.159) 10.255 27.389 ( 3.363 -7.949 -15.616) 17.842 27.389 ( 3.363 -7.949 15.616) 17.842 ======================= Grid point 265 (83/100) ======================= q-point: ( 0.22 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.997 ( 16.269 -4.054 -50.985) 53.672 3.997 ( 16.269 -4.054 50.985) 53.672 4.929 ( 18.161 36.444 -48.850) 63.595 4.929 ( 18.161 36.444 48.850) 63.595 7.043 ( -1.862 8.063 -0.648) 8.301 7.043 ( -1.862 8.063 0.648) 8.301 7.321 ( -6.772 7.432 -8.348) 13.068 7.321 ( -6.772 7.432 8.348) 13.068 7.396 ( -2.315 -0.634 -17.419) 17.584 7.396 ( -2.315 -0.634 17.419) 17.584 7.761 ( 21.097 20.331 -35.896) 46.335 7.761 ( 21.097 20.331 35.896) 46.335 8.547 ( 7.364 -3.750 -1.790) 8.455 8.547 ( 7.364 -3.750 1.790) 8.455 9.176 ( -2.253 -11.798 -3.250) 12.443 9.176 ( -2.253 -11.798 3.250) 12.443 9.830 ( 5.652 -3.908 -4.063) 7.983 9.830 ( 5.652 -3.908 4.063) 7.983 10.115 ( 5.294 -3.437 -5.753) 8.540 10.115 ( 5.294 -3.437 5.753) 8.540 10.401 ( 10.894 -3.099 -6.457) 13.038 10.401 ( 10.894 -3.099 6.457) 13.038 11.352 ( 16.254 2.770 -9.786) 19.174 11.352 ( 16.254 2.770 9.786) 19.174 11.572 ( 14.343 8.057 -5.674) 17.402 11.572 ( 14.343 8.057 5.674) 17.402 11.764 ( 5.714 10.160 -4.040) 12.337 11.764 ( 5.714 10.160 4.040) 12.337 11.946 ( 7.008 0.077 -5.676) 9.019 11.946 ( 7.008 0.077 5.676) 9.019 12.114 ( 11.663 14.957 -4.054) 19.395 12.114 ( 11.663 14.957 4.054) 19.395 12.329 ( 11.475 -0.520 -11.863) 16.513 12.329 ( 11.475 -0.520 11.863) 16.513 12.665 ( 9.053 11.950 -6.466) 16.326 12.665 ( 9.053 11.950 6.466) 16.326 12.993 ( -3.501 -10.148 -2.135) 10.945 12.993 ( -3.501 -10.148 2.135) 10.945 13.373 ( -0.329 4.454 -2.806) 5.275 13.373 ( -0.329 4.454 2.806) 5.275 13.822 ( -24.043 -1.840 -21.782) 32.495 13.822 ( -24.043 -1.840 21.782) 32.495 14.132 ( -0.608 7.386 -6.711) 9.998 14.132 ( -0.608 7.386 6.711) 9.998 14.622 ( -13.087 -10.998 -20.359) 26.584 14.622 ( -13.087 -10.998 20.359) 26.584 15.097 ( -4.861 -4.166 -9.071) 11.103 15.097 ( -4.861 -4.166 9.071) 11.103 15.301 ( -4.530 0.131 -13.601) 14.336 15.301 ( -4.530 0.131 13.601) 14.336 15.642 ( -9.578 -15.099 -7.614) 19.434 15.642 ( -9.578 -15.099 7.614) 19.434 16.310 ( -0.885 2.507 -19.957) 20.134 16.310 ( -0.885 2.507 19.957) 20.134 17.090 ( 7.587 -4.590 -2.282) 9.157 17.090 ( 7.587 -4.590 2.282) 9.157 17.511 ( 5.942 -5.052 -16.638) 18.375 17.511 ( 5.942 -5.052 16.638) 18.375 17.743 ( -2.019 4.596 -4.827) 6.965 17.743 ( -2.019 4.596 4.827) 6.965 17.885 ( -5.607 2.438 -2.241) 6.512 17.885 ( -5.607 2.438 2.241) 6.512 18.198 ( -3.014 -2.034 -2.419) 4.367 18.198 ( -3.014 -2.034 2.419) 4.367 18.530 ( -17.813 -3.827 -10.723) 21.141 18.530 ( -17.813 -3.827 10.723) 21.141 19.581 ( -10.374 3.235 -13.332) 17.200 19.581 ( -10.374 3.235 13.332) 17.200 20.240 ( -0.559 -1.551 -3.366) 3.748 20.240 ( -0.559 -1.551 3.366) 3.748 20.491 ( -2.038 0.376 -1.763) 2.721 20.491 ( -2.038 0.376 1.763) 2.721 20.829 ( 1.758 -5.316 -3.556) 6.633 20.829 ( 1.758 -5.316 3.556) 6.633 21.479 ( 4.382 4.593 -2.173) 6.709 21.479 ( 4.382 4.593 2.173) 6.709 22.211 ( 2.125 12.350 -1.334) 12.603 22.211 ( 2.125 12.350 1.334) 12.603 23.556 ( -6.757 0.435 -15.370) 16.795 23.556 ( -6.757 0.435 15.370) 16.795 26.574 ( 13.478 -1.052 -7.695) 15.555 26.574 ( 13.478 -1.052 7.695) 15.555 27.448 ( 1.911 -8.378 -21.765) 23.400 27.448 ( 1.911 -8.378 21.765) 23.400 ======================= Grid point 267 (84/100) ======================= q-point: ( 0.33 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.449 ( 28.469 0.208 -35.001) 45.118 4.449 ( 28.469 0.208 35.001) 45.118 5.260 ( 15.479 39.242 -39.680) 57.914 5.260 ( 15.479 39.242 39.680) 57.914 6.788 ( -25.335 7.415 -4.186) 26.728 6.788 ( -25.335 7.415 4.186) 26.728 6.913 ( -21.785 14.391 -11.334) 28.464 6.913 ( -21.785 14.391 11.334) 28.464 7.179 ( -8.480 6.204 -6.672) 12.447 7.179 ( -8.480 6.204 6.672) 12.447 8.564 ( 12.916 -3.861 -6.666) 15.038 8.564 ( 12.916 -3.861 6.666) 15.038 8.822 ( 43.623 2.852 -35.652) 56.411 8.822 ( 43.623 2.852 35.652) 56.411 9.160 ( 1.698 5.083 -4.437) 6.957 9.160 ( 1.698 5.083 4.437) 6.957 10.082 ( 17.784 -6.399 -4.551) 19.440 10.082 ( 17.784 -6.399 4.551) 19.440 10.293 ( 12.250 -13.128 -9.593) 20.357 10.293 ( 12.250 -13.128 9.593) 20.357 10.539 ( 4.567 -2.658 -2.920) 6.037 10.539 ( 4.567 -2.658 2.920) 6.037 11.574 ( 0.706 3.982 -5.267) 6.641 11.574 ( 0.706 3.982 5.267) 6.641 11.738 ( 12.200 -9.109 -4.299) 15.821 11.738 ( 12.200 -9.109 4.299) 15.821 11.841 ( 1.336 10.594 -6.934) 12.732 11.841 ( 1.336 10.594 6.934) 12.732 12.172 ( 14.383 -0.130 -7.106) 16.043 12.172 ( 14.383 -0.130 7.106) 16.043 12.400 ( 10.706 11.573 -8.236) 17.787 12.400 ( 10.706 11.573 8.236) 17.787 12.610 ( 12.453 -1.791 -3.025) 12.940 12.610 ( 12.453 -1.791 3.025) 12.940 12.770 ( 2.779 -1.360 -5.211) 6.061 12.770 ( 2.779 -1.360 5.211) 6.061 13.014 ( -16.721 -1.935 -13.917) 21.841 13.014 ( -16.721 -1.935 13.917) 21.841 13.151 ( -11.206 10.468 -14.646) 21.205 13.151 ( -11.206 10.468 14.646) 21.205 13.420 ( 4.641 3.577 -6.424) 8.695 13.420 ( 4.641 3.577 6.424) 8.695 14.115 ( -3.483 9.352 -10.294) 14.338 14.115 ( -3.483 9.352 10.294) 14.338 14.410 ( -11.281 -10.546 -18.367) 23.996 14.410 ( -11.281 -10.546 18.367) 23.996 14.825 ( -18.950 5.423 -16.327) 25.595 14.825 ( -18.950 5.423 16.327) 25.595 15.188 ( -12.161 6.458 -4.074) 14.359 15.188 ( -12.161 6.458 4.074) 14.359 15.598 ( 8.315 -26.848 -3.631) 28.340 15.598 ( 8.315 -26.848 3.631) 28.340 16.361 ( 4.275 -2.614 -12.127) 13.121 16.361 ( 4.275 -2.614 12.127) 13.121 17.214 ( 4.888 2.710 -6.488) 8.563 17.214 ( 4.888 2.710 6.488) 8.563 17.480 ( -6.966 -4.512 -6.063) 10.278 17.480 ( -6.966 -4.512 6.063) 10.278 17.681 ( -8.585 4.550 -5.123) 10.984 17.681 ( -8.585 4.550 5.123) 10.984 17.804 ( 2.385 -1.694 -3.492) 4.555 17.804 ( 2.385 -1.694 3.492) 4.555 18.127 ( -3.617 -3.630 -7.432) 9.028 18.127 ( -3.617 -3.630 7.432) 9.028 18.318 ( -5.226 3.879 -4.854) 8.119 18.318 ( -5.226 3.879 4.854) 8.119 19.398 ( -7.793 -0.432 -11.528) 13.922 19.398 ( -7.793 -0.432 11.528) 13.922 20.223 ( -0.937 2.622 -3.762) 4.680 20.223 ( -0.937 2.622 3.762) 4.680 20.441 ( -2.638 3.188 -2.454) 4.811 20.441 ( -2.638 3.188 2.454) 4.811 20.870 ( 2.343 -2.593 -1.791) 3.927 20.870 ( 2.343 -2.593 1.791) 3.927 21.471 ( -3.992 10.335 -5.054) 12.177 21.471 ( -3.992 10.335 5.054) 12.177 22.306 ( 6.386 2.590 -7.552) 10.223 22.306 ( 6.386 2.590 7.552) 10.223 23.436 ( -5.184 -2.621 -14.360) 15.491 23.436 ( -5.184 -2.621 14.360) 15.491 26.856 ( 14.657 -3.135 -10.470) 18.283 26.856 ( 14.657 -3.135 10.470) 18.283 27.443 ( -2.645 -7.880 -21.461) 23.015 27.443 ( -2.645 -7.880 21.461) 23.015 ======================= Grid point 269 (85/100) ======================= q-point: ( 0.44 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.042 ( 29.253 10.534 -16.739) 35.311 5.042 ( 29.253 10.534 16.739) 35.311 5.450 ( -1.326 25.578 -15.478) 29.926 5.450 ( -1.326 25.578 15.478) 29.926 6.274 ( -18.313 11.094 -1.721) 21.480 6.274 ( -18.313 11.094 1.721) 21.480 6.563 ( -12.491 18.491 -12.063) 25.366 6.563 ( -12.491 18.491 12.063) 25.366 7.088 ( -1.948 9.755 -2.103) 10.167 7.088 ( -1.948 9.755 2.103) 10.167 8.624 ( 0.673 -4.158 -1.098) 4.353 8.624 ( 0.673 -4.158 1.098) 4.353 9.057 ( -1.641 6.059 -0.350) 6.287 9.057 ( -1.641 6.059 0.350) 6.287 9.771 ( 27.517 -1.792 -18.708) 33.322 9.771 ( 27.517 -1.792 18.708) 33.322 10.380 ( 10.452 -11.553 -9.510) 18.252 10.380 ( 10.452 -11.553 9.510) 18.252 10.453 ( 0.829 -17.743 -8.218) 19.571 10.453 ( 0.829 -17.743 8.218) 19.571 10.821 ( 30.868 1.972 -21.542) 37.693 10.821 ( 30.868 1.972 21.542) 37.693 11.481 ( -12.801 2.469 -10.462) 16.716 11.481 ( -12.801 2.469 10.462) 16.716 11.827 ( -2.639 8.796 -0.642) 9.206 11.827 ( -2.639 8.796 0.642) 9.206 11.881 ( -13.408 -0.898 -13.437) 19.004 11.881 ( -13.408 -0.898 13.437) 19.004 12.170 ( -11.003 -0.021 -9.966) 14.846 12.170 ( -11.003 -0.021 9.966) 14.846 12.397 ( 4.862 2.059 -9.964) 11.276 12.397 ( 4.862 2.059 9.964) 11.276 12.509 ( -1.370 -0.640 -9.343) 9.465 12.509 ( -1.370 -0.640 9.343) 9.465 12.755 ( 0.795 -6.339 -3.712) 7.389 12.755 ( 0.795 -6.339 3.712) 7.389 13.087 ( 13.809 4.541 -2.505) 14.751 13.087 ( 13.809 4.541 2.505) 14.751 13.311 ( 7.578 5.054 -1.914) 9.307 13.311 ( 7.578 5.054 1.914) 9.307 13.616 ( 11.651 -1.386 -12.275) 16.980 13.616 ( 11.651 -1.386 12.275) 16.980 13.987 ( -9.130 2.093 -8.717) 12.795 13.987 ( -9.130 2.093 8.717) 12.795 14.204 ( -3.700 5.605 -10.597) 12.546 14.204 ( -3.700 5.605 10.597) 12.546 14.415 ( -20.454 8.384 -22.471) 31.522 14.415 ( -20.454 8.384 22.471) 31.522 15.004 ( -4.618 6.982 -2.984) 8.887 15.004 ( -4.618 6.982 2.984) 8.887 15.807 ( 9.027 -21.944 -1.312) 23.764 15.807 ( 9.027 -21.944 1.312) 23.764 16.392 ( -1.503 -15.473 -4.549) 16.198 16.392 ( -1.503 -15.473 4.549) 16.198 17.262 ( 1.207 4.432 -12.926) 13.718 17.262 ( 1.207 4.432 12.926) 13.718 17.335 ( -6.130 -1.099 -10.812) 12.477 17.335 ( -6.130 -1.099 10.812) 12.477 17.602 ( 0.567 1.979 -4.660) 5.094 17.602 ( 0.567 1.979 4.660) 5.094 17.886 ( 5.759 2.599 -7.839) 10.068 17.886 ( 5.759 2.599 7.839) 10.068 18.027 ( -7.015 2.541 -8.200) 11.086 18.027 ( -7.015 2.541 8.200) 11.086 18.261 ( -1.208 4.563 -1.129) 4.853 18.261 ( -1.208 4.563 1.129) 4.853 19.292 ( -2.782 -3.915 -4.594) 6.646 19.292 ( -2.782 -3.915 4.594) 6.646 20.209 ( -0.418 4.628 -1.920) 5.028 20.209 ( -0.418 4.628 1.920) 5.028 20.402 ( -1.078 4.670 -1.752) 5.103 20.402 ( -1.078 4.670 1.752) 5.103 20.911 ( 1.382 0.804 -0.784) 1.780 20.911 ( 1.382 0.804 0.784) 1.780 21.388 ( -3.011 8.574 -2.611) 9.455 21.388 ( -3.011 8.574 2.611) 9.455 22.408 ( 3.037 0.293 -4.218) 5.206 22.408 ( 3.037 0.293 4.218) 5.206 23.364 ( -1.944 -4.852 -6.186) 8.099 23.364 ( -1.944 -4.852 6.186) 8.099 27.122 ( 11.656 -5.389 -13.015) 18.284 27.122 ( 11.656 -5.389 13.015) 18.284 27.343 ( -7.201 -6.344 -17.026) 19.545 27.343 ( -7.201 -6.344 17.026) 19.545 ======================= Grid point 279 (86/100) ======================= q-point: ( 0.00 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.112 ( 0.000 11.761 -53.799) 55.070 4.112 ( 0.000 11.761 53.799) 55.070 4.379 ( 0.000 12.823 -48.926) 50.579 4.379 ( 0.000 12.823 48.926) 50.579 7.115 ( 0.000 5.872 -11.713) 13.102 7.115 ( 0.000 5.872 11.713) 13.102 7.294 ( 0.000 14.931 -19.414) 24.492 7.294 ( 0.000 14.931 19.414) 24.492 7.525 ( 0.000 -2.818 -20.038) 20.235 7.525 ( 0.000 -2.818 20.038) 20.235 7.745 ( 0.000 6.150 -16.453) 17.565 7.745 ( 0.000 6.150 16.453) 17.565 8.442 ( 0.000 5.629 -1.498) 5.825 8.442 ( 0.000 5.629 1.498) 5.825 9.278 ( 0.000 -10.893 -2.628) 11.206 9.278 ( 0.000 -10.893 2.628) 11.206 9.601 ( 0.000 3.090 -1.867) 3.610 9.601 ( 0.000 3.090 1.867) 3.610 10.068 ( 0.000 3.729 -6.189) 7.225 10.068 ( 0.000 3.729 6.189) 7.225 10.273 ( 0.000 7.565 -10.626) 13.044 10.273 ( 0.000 7.565 10.626) 13.044 11.252 ( 0.000 17.306 -15.828) 23.453 11.252 ( 0.000 17.306 15.828) 23.453 11.553 ( 0.000 18.066 -2.169) 18.195 11.553 ( 0.000 18.066 2.169) 18.195 11.783 ( 0.000 17.930 -3.103) 18.197 11.783 ( 0.000 17.930 3.103) 18.197 11.860 ( 0.000 0.921 -12.656) 12.689 11.860 ( 0.000 0.921 12.656) 12.689 12.107 ( 0.000 8.462 -8.463) 11.968 12.107 ( 0.000 8.462 8.463) 11.968 12.306 ( 0.000 13.079 -3.206) 13.466 12.306 ( 0.000 13.079 3.206) 13.466 12.909 ( 0.000 19.240 -0.215) 19.241 12.909 ( 0.000 19.240 0.215) 19.241 13.093 ( 0.000 1.252 -9.950) 10.028 13.093 ( 0.000 1.252 9.950) 10.028 13.270 ( 0.000 -4.572 -2.530) 5.226 13.270 ( 0.000 -4.572 2.530) 5.226 13.819 ( 0.000 -5.051 -11.944) 12.968 13.819 ( 0.000 -5.051 11.944) 12.968 14.128 ( 0.000 -8.049 -13.621) 15.821 14.128 ( 0.000 -8.049 13.621) 15.821 14.615 ( 0.000 -20.917 -2.556) 21.072 14.615 ( 0.000 -20.917 2.556) 21.072 15.049 ( 0.000 -10.418 -7.575) 12.881 15.049 ( 0.000 -10.418 7.575) 12.881 15.357 ( 0.000 -10.685 -20.549) 23.161 15.357 ( 0.000 -10.685 20.549) 23.161 15.906 ( 0.000 -1.922 -7.073) 7.330 15.906 ( 0.000 -1.922 7.073) 7.330 16.309 ( 0.000 -5.245 -10.389) 11.638 16.309 ( 0.000 -5.245 10.389) 11.638 16.639 ( 0.000 -8.959 -4.201) 9.895 16.639 ( 0.000 -8.959 4.201) 9.895 17.236 ( 0.000 2.026 -23.907) 23.993 17.236 ( 0.000 2.026 23.907) 23.993 17.835 ( 0.000 0.630 -6.779) 6.808 17.835 ( 0.000 0.630 6.779) 6.808 18.018 ( 0.000 -0.469 -2.930) 2.967 18.018 ( 0.000 -0.469 2.930) 2.967 18.281 ( 0.000 3.252 -1.180) 3.459 18.281 ( 0.000 3.252 1.180) 3.459 19.019 ( 0.000 -13.113 -6.725) 14.736 19.019 ( 0.000 -13.113 6.725) 14.736 19.835 ( 0.000 -20.616 -0.932) 20.637 19.835 ( 0.000 -20.616 0.932) 20.637 20.094 ( 0.000 12.599 -8.876) 15.411 20.094 ( 0.000 12.599 8.876) 15.411 20.351 ( 0.000 -3.182 -5.152) 6.055 20.351 ( 0.000 -3.182 5.152) 6.055 20.783 ( 0.000 1.285 -10.906) 10.982 20.783 ( 0.000 1.285 10.906) 10.982 21.177 ( 0.000 -4.031 -2.122) 4.556 21.177 ( 0.000 -4.031 2.122) 4.556 22.748 ( 0.000 25.557 -16.852) 30.613 22.748 ( 0.000 25.557 16.852) 30.613 23.823 ( 0.000 3.605 -14.847) 15.278 23.823 ( 0.000 3.605 14.847) 15.278 26.317 ( 0.000 2.951 -4.082) 5.037 26.317 ( 0.000 2.951 4.082) 5.037 27.159 ( 0.000 -11.047 -2.610) 11.351 27.159 ( 0.000 -11.047 2.610) 11.351 ======================= Grid point 281 (87/100) ======================= q-point: ( 0.11 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.948 ( -1.781 13.622 -51.049) 52.866 3.948 ( -1.781 13.622 51.049) 52.866 4.904 ( 36.649 16.118 -48.626) 62.987 4.904 ( 36.649 16.118 48.626) 62.987 7.136 ( 2.277 1.649 -6.954) 7.501 7.136 ( 2.277 1.649 6.954) 7.501 7.382 ( 7.239 17.103 -24.231) 30.530 7.382 ( 7.239 17.103 24.231) 30.530 7.473 ( -1.746 -6.834 -12.553) 14.399 7.473 ( -1.746 -6.834 12.553) 14.399 7.993 ( 19.752 17.326 -28.194) 38.538 7.993 ( 19.752 17.326 28.194) 38.538 8.389 ( -3.668 3.941 -2.267) 5.841 8.389 ( -3.668 3.941 2.267) 5.841 9.069 ( -14.309 -5.190 -3.222) 15.558 9.069 ( -14.309 -5.190 3.222) 15.558 9.761 ( 2.652 0.886 -4.216) 5.059 9.761 ( 2.652 0.886 4.216) 5.059 9.988 ( 4.599 0.256 -2.176) 5.094 9.988 ( 4.599 0.256 2.176) 5.094 10.286 ( -1.030 4.025 -0.982) 4.270 10.286 ( -1.030 4.025 0.982) 4.270 11.309 ( 3.249 11.094 -6.254) 13.143 11.309 ( 3.249 11.094 6.254) 13.143 11.663 ( 6.972 15.862 -3.995) 17.781 11.663 ( 6.972 15.862 3.995) 17.781 11.793 ( 3.771 9.869 -8.288) 13.428 11.793 ( 3.771 9.869 8.288) 13.428 11.903 ( 5.269 6.402 -6.331) 10.432 11.903 ( 5.269 6.402 6.331) 10.432 12.166 ( 6.515 9.706 -14.109) 18.322 12.166 ( 6.515 9.706 14.109) 18.322 12.361 ( 4.709 14.281 -8.455) 17.251 12.361 ( 4.709 14.281 8.455) 17.251 12.902 ( -0.850 12.976 -2.187) 13.186 12.902 ( -0.850 12.976 2.187) 13.186 12.942 ( -7.778 1.929 -4.588) 9.234 12.942 ( -7.778 1.929 4.588) 9.234 13.388 ( 5.087 0.380 -3.591) 6.238 13.388 ( 5.087 0.380 3.591) 6.238 13.835 ( 2.986 -5.901 -2.952) 7.242 13.835 ( 2.986 -5.901 2.952) 7.242 14.172 ( 2.084 -8.662 -9.519) 13.038 14.172 ( 2.084 -8.662 9.519) 13.038 14.614 ( -2.731 -18.198 -0.705) 18.416 14.614 ( -2.731 -18.198 0.705) 18.416 14.944 ( -9.224 -4.060 -11.933) 15.620 14.944 ( -9.224 -4.060 11.933) 15.620 15.291 ( -2.887 -11.190 -17.921) 21.324 15.291 ( -2.887 -11.190 17.921) 21.324 15.797 ( -10.718 0.323 -4.963) 11.816 15.797 ( -10.718 0.323 4.963) 11.816 16.243 ( -5.046 -13.657 -26.363) 30.116 16.243 ( -5.046 -13.657 26.363) 30.116 16.798 ( 12.653 -2.910 -3.351) 13.409 16.798 ( 12.653 -2.910 3.351) 13.409 17.295 ( 5.679 -0.672 -22.231) 22.955 17.295 ( 5.679 -0.672 22.231) 22.955 17.833 ( -0.582 0.759 -7.278) 7.341 17.833 ( -0.582 0.759 7.278) 7.341 17.991 ( -2.729 -0.125 -2.790) 3.905 17.991 ( -2.729 -0.125 2.790) 3.905 18.266 ( -1.721 2.686 -2.389) 3.985 18.266 ( -1.721 2.686 2.389) 3.985 18.769 ( -19.953 -11.310 -6.700) 23.894 18.769 ( -19.953 -11.310 6.700) 23.894 19.794 ( -6.080 -8.388 -6.247) 12.097 19.794 ( -6.080 -8.388 6.247) 12.097 20.208 ( 8.707 7.673 -7.754) 13.957 20.208 ( 8.707 7.673 7.754) 13.957 20.359 ( 1.643 -5.944 -3.466) 7.074 20.359 ( 1.643 -5.944 3.466) 7.074 20.779 ( -0.413 1.234 -9.705) 9.792 20.779 ( -0.413 1.234 9.705) 9.792 21.259 ( 8.236 -5.521 -4.233) 10.781 21.259 ( 8.236 -5.521 4.233) 10.781 22.698 ( -5.112 24.763 -14.552) 29.174 22.698 ( -5.112 24.763 14.552) 29.174 23.746 ( -7.368 2.837 -15.431) 17.334 23.746 ( -7.368 2.837 15.431) 17.334 26.380 ( 6.365 1.884 -4.480) 8.008 26.380 ( 6.365 1.884 4.480) 8.008 27.186 ( 2.427 -11.749 -11.313) 16.490 27.186 ( 2.427 -11.749 11.313) 16.490 ======================= Grid point 283 (88/100) ======================= q-point: ( 0.22 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.121 ( 18.680 15.877 -39.872) 46.806 4.121 ( 18.680 15.877 39.872) 46.806 5.602 ( 31.746 28.832 -43.957) 61.411 5.602 ( 31.746 28.832 43.957) 61.411 7.166 ( -0.811 0.534 -1.197) 1.541 7.166 ( -0.811 0.534 1.197) 1.541 7.405 ( -5.381 0.299 -9.081) 10.560 7.405 ( -5.381 0.299 9.081) 10.560 7.517 ( -0.841 11.282 -10.666) 15.549 7.517 ( -0.841 11.282 10.666) 15.549 8.221 ( 5.966 17.560 -14.954) 23.824 8.221 ( 5.966 17.560 14.954) 23.824 8.562 ( 19.685 13.345 -21.770) 32.242 8.562 ( 19.685 13.345 21.770) 32.242 8.899 ( 3.045 -10.786 -2.290) 11.439 8.899 ( 3.045 -10.786 2.290) 11.439 9.734 ( 2.402 -0.825 -4.866) 5.489 9.734 ( 2.402 -0.825 4.866) 5.489 10.154 ( 0.077 1.166 -4.963) 5.099 10.154 ( 0.077 1.166 4.963) 5.099 10.332 ( 10.805 -2.090 -2.269) 11.236 10.332 ( 10.805 -2.090 2.269) 11.236 11.346 ( 3.104 -0.626 -2.701) 4.162 11.346 ( 3.104 -0.626 2.701) 4.162 11.726 ( -0.165 7.254 -3.892) 8.233 11.726 ( -0.165 7.254 3.892) 8.233 11.922 ( 5.557 0.285 -9.097) 10.664 11.922 ( 5.557 0.285 9.097) 10.664 12.051 ( 10.392 12.130 -1.480) 16.042 12.051 ( 10.392 12.130 1.480) 16.042 12.382 ( 12.167 9.443 -11.624) 19.296 12.382 ( 12.167 9.443 11.624) 19.296 12.468 ( 7.923 12.886 -5.774) 16.191 12.468 ( 7.923 12.886 5.774) 16.191 12.770 ( -7.018 -1.583 -3.699) 8.090 12.770 ( -7.018 -1.583 3.699) 8.090 13.006 ( 8.998 11.540 -4.499) 15.310 13.006 ( 8.998 11.540 4.499) 15.310 13.440 ( 1.165 3.833 -4.511) 6.033 13.440 ( 1.165 3.833 4.511) 6.033 13.806 ( -12.828 0.119 -13.151) 18.372 13.806 ( -12.828 0.119 13.151) 18.372 14.189 ( 0.489 -9.660 -10.896) 14.570 14.189 ( 0.489 -9.660 10.896) 14.570 14.414 ( -11.083 -2.603 -15.476) 19.212 14.414 ( -11.083 -2.603 15.476) 19.212 14.860 ( -0.240 -16.194 -8.601) 18.338 14.860 ( -0.240 -16.194 8.601) 18.338 15.271 ( -1.701 0.995 -15.291) 15.418 15.271 ( -1.701 0.995 15.291) 15.418 15.544 ( -13.741 -0.783 -3.227) 14.137 15.544 ( -13.741 -0.783 3.227) 14.137 16.128 ( -5.261 -19.226 -22.241) 29.866 16.128 ( -5.261 -19.226 22.241) 29.866 17.066 ( 13.962 1.925 -2.922) 14.393 17.066 ( 13.962 1.925 2.922) 14.393 17.412 ( 4.098 -4.627 -21.418) 22.292 17.412 ( 4.098 -4.627 21.418) 22.292 17.786 ( -5.601 -3.931 -9.082) 11.372 17.786 ( -5.601 -3.931 9.082) 11.372 17.900 ( -6.189 0.851 -3.678) 7.250 17.900 ( -6.189 0.851 3.678) 7.250 18.193 ( -5.280 2.407 -4.655) 7.439 18.193 ( -5.280 2.407 4.655) 7.439 18.455 ( -8.138 -1.890 -9.281) 12.488 18.455 ( -8.138 -1.890 9.281) 12.488 19.622 ( -10.336 -0.289 -10.058) 14.425 19.622 ( -10.336 -0.289 10.058) 14.425 20.291 ( 0.546 4.690 -8.227) 9.486 20.291 ( 0.546 4.690 8.227) 9.486 20.439 ( 4.170 -3.078 -2.267) 5.657 20.439 ( 4.170 -3.078 2.267) 5.657 20.784 ( 1.843 0.768 -6.551) 6.849 20.784 ( 1.843 0.768 6.551) 6.849 21.470 ( 11.791 -5.036 -5.426) 13.923 21.470 ( 11.791 -5.036 5.426) 13.923 22.558 ( -8.490 20.665 -7.530) 23.576 22.558 ( -8.490 20.665 7.530) 23.576 23.564 ( -10.392 0.197 -16.444) 19.453 23.564 ( -10.392 0.197 16.444) 19.453 26.553 ( 10.798 -0.778 -5.860) 12.310 26.553 ( 10.798 -0.778 5.860) 12.310 27.233 ( 1.796 -12.542 -16.762) 21.011 27.233 ( 1.796 -12.542 16.762) 21.011 ======================= Grid point 285 (89/100) ======================= q-point: ( 0.33 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.632 ( 32.130 17.555 -25.541) 44.641 4.632 ( 32.130 17.555 25.541) 44.641 6.091 ( 17.343 41.143 -38.640) 59.047 6.091 ( 17.343 41.143 38.640) 59.047 6.961 ( -22.748 9.835 -0.893) 24.799 6.961 ( -22.748 9.835 0.893) 24.799 7.263 ( -14.346 15.719 -7.773) 22.656 7.263 ( -14.346 15.719 7.773) 22.656 7.334 ( -2.543 10.763 -6.249) 12.703 7.334 ( -2.543 10.763 6.249) 12.703 8.451 ( 7.815 -7.687 -3.161) 11.408 8.451 ( 7.815 -7.687 3.161) 11.408 8.841 ( 16.411 -4.489 -9.457) 19.465 8.841 ( 16.411 -4.489 9.457) 19.465 9.289 ( 27.666 10.266 -27.633) 40.427 9.289 ( 27.666 10.266 27.633) 40.427 9.906 ( 12.687 -8.211 -4.896) 15.885 9.906 ( 12.687 -8.211 4.896) 15.885 10.127 ( 0.161 -2.943 -5.324) 6.086 10.127 ( 0.161 -2.943 5.324) 6.086 10.523 ( 8.987 2.887 -8.252) 12.537 10.523 ( 8.987 2.887 8.252) 12.537 11.528 ( 14.548 -8.472 -1.736) 16.924 11.528 ( 14.548 -8.472 1.736) 16.924 11.691 ( -1.722 4.395 -4.785) 6.721 11.691 ( -1.722 4.395 4.785) 6.721 11.988 ( 2.391 0.590 -13.469) 13.692 11.988 ( 2.391 0.590 13.469) 13.692 12.218 ( 3.270 6.931 -2.783) 8.153 12.218 ( 3.270 6.931 2.783) 8.153 12.489 ( -1.405 -3.999 -8.030) 9.080 12.489 ( -1.405 -3.999 8.030) 9.080 12.658 ( 0.636 5.737 -0.320) 5.781 12.658 ( 0.636 5.737 0.320) 5.781 12.774 ( 16.072 3.499 -2.926) 16.707 12.774 ( 16.072 3.499 2.926) 16.707 13.043 ( -18.887 4.894 -16.300) 25.424 13.043 ( -18.887 4.894 16.300) 25.424 13.399 ( -0.744 9.844 -3.656) 10.527 13.399 ( -0.744 9.844 3.656) 10.527 13.532 ( -1.100 9.714 -5.370) 11.154 13.532 ( -1.100 9.714 5.370) 11.154 14.136 ( -6.832 -9.714 -13.680) 18.115 14.136 ( -6.832 -9.714 13.680) 18.115 14.349 ( 1.230 4.439 -12.268) 13.104 14.349 ( 1.230 4.439 12.268) 13.104 14.835 ( -5.760 -6.831 -17.222) 19.402 14.835 ( -5.760 -6.831 17.222) 19.402 15.148 ( -7.603 -10.139 -6.927) 14.442 15.148 ( -7.603 -10.139 6.927) 14.442 15.360 ( -2.008 7.821 -8.334) 11.604 15.360 ( -2.008 7.821 8.334) 11.604 16.070 ( -2.484 -23.395 -11.309) 26.103 16.070 ( -2.484 -23.395 11.309) 26.103 17.271 ( -3.263 -6.852 -8.780) 11.605 17.271 ( -3.263 -6.852 8.780) 11.605 17.378 ( 1.560 0.732 -10.743) 10.880 17.378 ( 1.560 0.732 10.743) 10.880 17.633 ( -5.676 -4.837 -13.053) 15.033 17.633 ( -5.676 -4.837 13.053) 15.033 17.868 ( 3.249 4.954 -1.947) 6.236 17.868 ( 3.249 4.954 1.947) 6.236 18.129 ( -1.705 3.136 -4.494) 5.739 18.129 ( -1.705 3.136 4.494) 5.739 18.409 ( 0.996 6.361 -7.935) 10.219 18.409 ( 0.996 6.361 7.935) 10.219 19.419 ( -9.898 2.277 -10.221) 14.409 19.419 ( -9.898 2.277 10.221) 14.409 20.283 ( -0.861 1.833 -6.449) 6.760 20.283 ( -0.861 1.833 6.449) 6.760 20.471 ( -0.205 0.173 -2.174) 2.190 20.471 ( -0.205 0.173 2.174) 2.190 20.869 ( 6.458 3.501 -3.098) 7.972 20.869 ( 6.458 3.501 3.098) 7.972 21.636 ( 2.960 3.901 -2.616) 5.552 21.636 ( 2.960 3.901 2.616) 5.552 22.421 ( -3.704 9.635 -3.470) 10.890 22.421 ( -3.704 9.635 3.470) 10.890 23.366 ( -9.274 -4.209 -15.153) 18.257 23.366 ( -9.274 -4.209 15.153) 18.257 26.780 ( 11.717 -4.120 -8.032) 14.791 26.780 ( 11.717 -4.120 8.032) 14.791 27.240 ( -1.302 -11.848 -16.791) 20.592 27.240 ( -1.302 -11.848 16.791) 20.592 ======================= Grid point 287 (90/100) ======================= q-point: ( 0.44 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.324 ( 36.643 18.852 -11.513) 42.786 5.324 ( 36.643 18.852 11.513) 42.786 6.059 ( -26.636 30.616 -7.854) 41.334 6.059 ( -26.636 30.616 7.854) 41.334 6.659 ( 2.233 27.917 -13.897) 31.265 6.659 ( 2.233 27.917 13.897) 31.265 6.995 ( -11.256 23.086 -15.228) 29.859 6.995 ( -11.256 23.086 15.228) 29.859 7.336 ( 0.533 14.155 -0.983) 14.199 7.336 ( 0.533 14.155 0.983) 14.199 8.494 ( -0.148 -9.260 -1.658) 9.409 8.494 ( -0.148 -9.260 1.658) 9.409 9.107 ( 7.142 -6.456 -0.311) 9.633 9.107 ( 7.142 -6.456 0.311) 9.633 9.750 ( 15.509 -0.036 -14.195) 21.025 9.750 ( 15.509 -0.036 14.195) 21.025 10.059 ( -0.548 -12.664 -11.952) 17.422 10.059 ( -0.548 -12.664 11.952) 17.422 10.142 ( 1.845 -13.427 -13.828) 19.363 10.142 ( 1.845 -13.427 13.828) 19.363 10.921 ( 32.784 8.813 -26.079) 42.808 10.921 ( 32.784 8.813 26.079) 42.808 11.559 ( -11.379 5.466 -8.455) 15.194 11.559 ( -11.379 5.466 8.455) 15.194 11.808 ( -3.138 -3.366 -8.138) 9.349 11.808 ( -3.138 -3.366 8.138) 9.349 12.007 ( -0.737 4.181 -7.062) 8.240 12.007 ( -0.737 4.181 7.062) 8.240 12.160 ( 0.164 -2.168 -6.542) 6.894 12.160 ( 0.164 -2.168 6.542) 6.894 12.430 ( -2.133 -4.028 -10.625) 11.562 12.430 ( -2.133 -4.028 10.625) 11.562 12.486 ( -9.575 3.256 -1.286) 10.195 12.486 ( -9.575 3.256 1.286) 10.195 12.722 ( -5.462 5.347 -4.955) 9.109 12.722 ( -5.462 5.347 4.955) 9.109 13.157 ( 17.516 2.178 -3.766) 18.049 13.157 ( 17.516 2.178 3.766) 18.049 13.404 ( -6.304 2.968 -4.520) 8.305 13.404 ( -6.304 2.968 4.520) 8.305 13.622 ( 9.506 0.347 -9.105) 13.168 13.622 ( 9.506 0.347 9.105) 13.168 13.940 ( -11.549 -3.399 -13.045) 17.751 13.940 ( -11.549 -3.399 13.045) 17.751 14.386 ( 2.550 8.325 -11.313) 14.276 14.386 ( 2.550 8.325 11.313) 14.276 14.591 ( -12.501 8.185 -13.610) 20.211 14.591 ( -12.501 8.185 13.610) 20.211 15.150 ( 3.051 3.189 -3.344) 5.538 15.150 ( 3.051 3.189 3.344) 5.538 15.451 ( 9.072 -6.414 -2.811) 11.460 15.451 ( 9.072 -6.414 2.811) 11.460 15.944 ( -9.522 -28.089 -3.619) 29.879 15.944 ( -9.522 -28.089 3.619) 29.879 17.080 ( -6.299 -12.102 -7.030) 15.348 17.080 ( -6.299 -12.102 7.030) 15.348 17.498 ( 3.616 5.090 -12.802) 14.243 17.498 ( 3.616 5.090 12.802) 14.243 17.559 ( -1.929 -2.994 -16.058) 16.448 17.559 ( -1.929 -2.994 16.058) 16.448 17.975 ( 5.841 2.786 -3.035) 7.147 17.975 ( 5.841 2.786 3.035) 7.147 18.090 ( -2.714 4.310 -3.847) 6.383 18.090 ( -2.714 4.310 3.847) 6.383 18.445 ( 1.737 14.199 -3.700) 14.776 18.445 ( 1.737 14.199 3.700) 14.776 19.263 ( -5.012 1.311 -4.936) 7.155 19.263 ( -5.012 1.311 4.936) 7.155 20.268 ( -0.490 0.885 -2.482) 2.680 20.268 ( -0.490 0.885 2.482) 2.680 20.460 ( -0.459 -0.128 -1.100) 1.198 20.460 ( -0.459 -0.128 1.100) 1.198 21.001 ( 5.311 9.376 -0.991) 10.821 21.001 ( 5.311 9.376 0.991) 10.821 21.591 ( -4.402 10.380 -1.402) 11.362 21.591 ( -4.402 10.380 1.402) 11.362 22.422 ( 1.797 1.328 -4.514) 5.037 22.422 ( 1.797 1.328 4.514) 5.037 23.226 ( -4.218 -8.837 -7.103) 12.097 23.226 ( -4.218 -8.837 7.103) 12.097 26.985 ( 8.202 -7.764 -8.792) 14.313 26.985 ( 8.202 -7.764 8.792) 14.313 27.181 ( -4.224 -9.415 -12.034) 15.852 27.181 ( -4.224 -9.415 12.034) 15.852 ======================= Grid point 297 (91/100) ======================= q-point: ( 0.00 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.456 ( 0.000 21.701 -37.485) 43.314 4.456 ( 0.000 21.701 37.485) 43.314 4.673 ( 0.000 16.032 -37.484) 40.769 4.673 ( 0.000 16.032 37.484) 40.769 6.837 ( 0.000 -23.007 -1.322) 23.044 6.837 ( 0.000 -23.007 1.322) 23.044 7.063 ( 0.000 -23.070 -13.712) 26.838 7.063 ( 0.000 -23.070 13.712) 26.838 7.291 ( 0.000 -9.085 -6.507) 11.175 7.291 ( 0.000 -9.085 6.507) 11.175 8.554 ( 0.000 9.074 -7.666) 11.878 8.554 ( 0.000 9.074 7.666) 11.878 8.798 ( 0.000 58.245 -43.155) 72.491 8.798 ( 0.000 58.245 43.155) 72.491 9.123 ( 0.000 -4.602 -2.009) 5.021 9.123 ( 0.000 -4.602 2.009) 5.021 9.790 ( 0.000 12.896 -5.038) 13.846 9.790 ( 0.000 12.896 5.038) 13.846 10.168 ( 0.000 9.131 -5.792) 10.812 10.168 ( 0.000 9.131 5.792) 10.812 10.435 ( 0.000 7.675 -6.182) 9.855 10.435 ( 0.000 7.675 6.182) 9.855 11.503 ( 0.000 7.763 -6.808) 10.325 11.503 ( 0.000 7.763 6.808) 10.325 11.698 ( 0.000 2.362 -1.115) 2.612 11.698 ( 0.000 2.362 1.115) 2.612 11.949 ( 0.000 7.712 -4.804) 9.085 11.949 ( 0.000 7.712 4.804) 9.085 12.073 ( 0.000 5.960 -2.697) 6.542 12.073 ( 0.000 5.960 2.697) 6.542 12.302 ( 0.000 6.992 -9.352) 11.677 12.302 ( 0.000 6.992 9.352) 11.677 12.649 ( 0.000 18.676 -13.721) 23.175 12.649 ( 0.000 18.676 13.721) 23.175 13.026 ( 0.000 -7.605 -14.262) 16.163 13.026 ( 0.000 -7.605 14.262) 16.163 13.147 ( 0.000 -4.241 -2.525) 4.936 13.147 ( 0.000 -4.241 2.525) 4.936 13.186 ( 0.000 -3.945 -1.880) 4.370 13.186 ( 0.000 -3.945 1.880) 4.370 13.814 ( 0.000 15.223 -3.080) 15.531 13.814 ( 0.000 15.223 3.080) 15.531 14.019 ( 0.000 -0.270 -8.698) 8.702 14.019 ( 0.000 -0.270 8.698) 8.702 14.228 ( 0.000 -18.267 -4.161) 18.735 14.228 ( 0.000 -18.267 4.161) 18.735 14.915 ( 0.000 -4.465 -0.713) 4.522 14.915 ( 0.000 -4.465 0.713) 4.522 15.169 ( 0.000 -7.324 -17.181) 18.676 15.169 ( 0.000 -7.324 17.181) 18.676 15.622 ( 0.000 -22.797 -15.769) 27.719 15.622 ( 0.000 -22.797 15.769) 27.719 16.303 ( 0.000 2.734 -0.782) 2.844 16.303 ( 0.000 2.734 0.782) 2.844 16.620 ( 0.000 6.280 -3.145) 7.023 16.620 ( 0.000 6.280 3.145) 7.023 17.232 ( 0.000 -1.687 -19.690) 19.763 17.232 ( 0.000 -1.687 19.690) 19.763 17.812 ( 0.000 -3.264 -3.607) 4.864 17.812 ( 0.000 -3.264 3.607) 4.864 17.951 ( 0.000 -7.598 -4.097) 8.632 17.951 ( 0.000 -7.598 4.097) 8.632 18.359 ( 0.000 4.228 -1.393) 4.452 18.359 ( 0.000 4.228 1.393) 4.452 18.761 ( 0.000 -8.949 -1.432) 9.062 18.761 ( 0.000 -8.949 1.432) 9.062 19.405 ( 0.000 -21.531 -2.440) 21.669 19.405 ( 0.000 -21.531 2.440) 21.669 20.275 ( 0.000 3.751 -4.277) 5.689 20.275 ( 0.000 3.751 4.277) 5.689 20.431 ( 0.000 10.981 -12.752) 16.829 20.431 ( 0.000 10.981 12.752) 16.829 20.811 ( 0.000 0.952 -13.039) 13.074 20.811 ( 0.000 0.952 13.039) 13.074 21.079 ( 0.000 -5.411 -1.004) 5.503 21.079 ( 0.000 -5.411 1.004) 5.503 23.211 ( 0.000 20.791 -18.760) 28.004 23.211 ( 0.000 20.791 18.760) 28.004 23.854 ( 0.000 -0.903 -18.220) 18.243 23.854 ( 0.000 -0.903 18.220) 18.243 26.390 ( 0.000 4.508 -1.809) 4.857 26.390 ( 0.000 4.508 1.809) 4.857 26.938 ( 0.000 -10.817 -0.303) 10.822 26.938 ( 0.000 -10.817 0.303) 10.822 ======================= Grid point 299 (92/100) ======================= q-point: ( 0.11 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.354 ( 1.927 26.083 -33.975) 42.876 4.354 ( 1.927 26.083 33.975) 42.876 5.188 ( 38.556 12.132 -39.022) 56.182 5.188 ( 38.556 12.132 39.022) 56.182 6.881 ( 4.647 -21.154 -0.780) 21.672 6.881 ( 4.647 -21.154 0.780) 21.672 7.190 ( 11.269 -19.177 -11.899) 25.225 7.190 ( 11.269 -19.177 11.899) 25.225 7.372 ( 7.585 -7.192 -5.750) 11.930 7.372 ( 7.585 -7.192 5.750) 11.930 8.512 ( -4.148 6.268 -3.735) 8.393 8.512 ( -4.148 6.268 3.735) 8.393 8.877 ( 7.418 51.236 -39.358) 65.033 8.877 ( 7.418 51.236 39.358) 65.033 9.085 ( -4.442 6.723 -4.739) 9.348 9.085 ( -4.442 6.723 4.739) 9.348 9.851 ( 6.688 7.476 -3.904) 10.763 9.851 ( 6.688 7.476 3.904) 10.763 10.099 ( -7.246 11.910 -5.021) 14.818 10.099 ( -7.246 11.910 5.021) 14.818 10.330 ( -6.183 1.735 -4.887) 8.070 10.330 ( -6.183 1.735 4.887) 8.070 11.501 ( -1.158 7.728 -5.681) 9.661 11.501 ( -1.158 7.728 5.681) 9.661 11.758 ( 4.205 0.603 -3.771) 5.680 11.758 ( 4.205 0.603 3.771) 5.680 11.981 ( 2.256 9.232 -4.731) 10.616 11.981 ( 2.256 9.232 4.731) 10.616 12.063 ( -0.309 3.133 -8.834) 9.378 12.063 ( -0.309 3.133 8.834) 9.378 12.354 ( 5.883 5.510 -12.629) 14.982 12.354 ( 5.883 5.510 12.629) 14.982 12.682 ( 1.552 13.960 -8.324) 16.327 12.682 ( 1.552 13.960 8.324) 16.327 12.936 ( -5.700 5.363 -1.358) 7.943 12.936 ( -5.700 5.363 1.358) 7.943 13.030 ( -0.797 -12.096 -10.935) 16.326 13.030 ( -0.797 -12.096 10.935) 16.326 13.429 ( 7.754 -2.980 -2.374) 8.640 13.429 ( 7.754 -2.980 2.374) 8.640 13.716 ( -1.884 2.653 -8.567) 9.164 13.716 ( -1.884 2.653 8.567) 9.164 13.995 ( -1.131 -0.338 -9.474) 9.547 13.995 ( -1.131 -0.338 9.474) 9.547 14.388 ( 10.150 -7.424 -11.609) 17.114 14.388 ( 10.150 -7.424 11.609) 17.114 14.931 ( -8.771 1.943 -9.609) 13.154 14.931 ( -8.771 1.943 9.609) 13.154 15.088 ( 3.790 -8.512 -10.396) 13.961 15.088 ( 3.790 -8.512 10.396) 13.961 15.646 ( -0.517 -17.725 -12.816) 21.880 15.646 ( -0.517 -17.725 12.816) 21.880 15.994 ( -20.259 -5.650 -10.791) 23.639 15.994 ( -20.259 -5.650 10.791) 23.639 16.873 ( 15.052 8.406 -3.026) 17.504 16.873 ( 15.052 8.406 3.026) 17.504 17.249 ( 2.469 -3.847 -20.108) 20.621 17.249 ( 2.469 -3.847 20.108) 20.621 17.787 ( -3.871 -5.518 -6.835) 9.599 17.787 ( -3.871 -5.518 6.835) 9.599 17.927 ( -1.814 -6.746 -4.265) 8.185 17.927 ( -1.814 -6.746 4.265) 8.185 18.332 ( -2.775 3.564 -2.842) 5.337 18.332 ( -2.775 3.564 2.842) 5.337 18.618 ( -9.644 -0.971 -6.793) 11.836 18.618 ( -9.644 -0.971 6.793) 11.836 19.493 ( 4.932 -19.434 -0.229) 20.051 19.493 ( 4.932 -19.434 0.229) 20.051 20.293 ( 1.320 0.835 -4.397) 4.666 20.293 ( 1.320 0.835 4.397) 4.666 20.455 ( 2.764 12.249 -12.144) 17.469 20.455 ( 2.764 12.249 12.144) 17.469 20.811 ( -0.129 1.490 -11.994) 12.087 20.811 ( -0.129 1.490 11.994) 12.087 21.127 ( 5.630 -7.326 -3.689) 9.949 21.127 ( 5.630 -7.326 3.689) 9.949 23.151 ( -6.363 20.451 -17.076) 27.392 23.151 ( -6.363 20.451 17.076) 27.392 23.769 ( -8.288 -0.957 -17.932) 19.778 23.769 ( -8.288 -0.957 17.932) 19.778 26.435 ( 4.431 3.709 -2.216) 6.189 26.435 ( 4.431 3.709 2.216) 6.189 26.951 ( 1.289 -11.506 -7.524) 13.808 26.951 ( 1.289 -11.506 7.524) 13.808 ======================= Grid point 301 (93/100) ======================= q-point: ( 0.22 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.580 ( 20.239 29.113 -24.736) 43.232 4.580 ( 20.239 29.113 24.736) 43.232 6.010 ( 42.211 11.524 -36.536) 57.004 6.010 ( 42.211 11.524 36.536) 57.004 7.018 ( 8.903 -14.025 -0.587) 16.623 7.018 ( 8.903 -14.025 0.587) 16.623 7.388 ( 5.937 -3.910 -7.672) 10.459 7.388 ( 5.937 -3.910 7.672) 10.459 7.557 ( 9.645 -5.390 -5.927) 12.538 7.557 ( 9.645 -5.390 5.927) 12.538 8.387 ( -8.874 6.175 -1.315) 10.891 8.387 ( -8.874 6.175 1.315) 10.891 8.819 ( -10.274 6.945 -3.023) 12.764 8.819 ( -10.274 6.945 3.023) 12.764 9.223 ( 16.839 35.890 -34.838) 52.776 9.223 ( 16.839 35.890 34.838) 52.776 9.832 ( -5.802 8.040 -0.940) 9.959 9.832 ( -5.802 8.040 0.940) 9.959 10.150 ( 7.008 2.729 -15.004) 16.783 10.150 ( 7.008 2.729 15.004) 16.783 10.308 ( 9.075 1.275 -10.388) 13.853 10.308 ( 9.075 1.275 10.388) 13.853 11.435 ( -4.551 8.749 -5.609) 11.345 11.435 ( -4.551 8.749 5.609) 11.345 11.794 ( -0.020 -0.053 -4.717) 4.717 11.794 ( -0.020 -0.053 4.717) 4.717 11.959 ( -2.208 2.479 -8.453) 9.081 11.959 ( -2.208 2.479 8.453) 9.081 12.204 ( 10.314 3.897 -6.493) 12.796 12.204 ( 10.314 3.897 6.493) 12.796 12.450 ( 4.446 -0.796 -4.161) 6.141 12.450 ( 4.446 -0.796 4.161) 6.141 12.693 ( -0.483 4.701 -1.315) 4.905 12.693 ( -0.483 4.701 1.315) 4.905 12.825 ( -7.193 4.848 -8.292) 12.000 12.825 ( -7.193 4.848 8.292) 12.000 13.092 ( 7.298 -3.183 -5.861) 9.887 13.092 ( 7.298 -3.183 5.861) 9.887 13.507 ( 2.058 -8.232 -2.440) 8.830 13.507 ( 2.058 -8.232 2.440) 8.830 13.708 ( -0.951 -2.692 -10.909) 11.277 13.708 ( -0.951 -2.692 10.909) 11.277 14.051 ( 3.902 8.171 -7.251) 11.600 14.051 ( 3.902 8.171 7.251) 11.600 14.506 ( -3.555 5.186 -17.623) 18.711 14.506 ( -3.555 5.186 17.623) 18.711 14.642 ( -7.956 -3.881 -6.520) 10.994 14.642 ( -7.956 -3.881 6.520) 10.994 15.280 ( 7.193 -3.971 -10.466) 13.306 15.280 ( 7.193 -3.971 10.466) 13.306 15.483 ( -13.788 -5.926 -4.754) 15.743 15.483 ( -13.788 -5.926 4.754) 15.743 15.719 ( -6.485 -15.524 -20.406) 26.447 15.719 ( -6.485 -15.524 20.406) 26.447 17.082 ( 5.924 -2.700 -1.983) 6.806 17.082 ( 5.924 -2.700 1.983) 6.806 17.340 ( 3.962 -2.548 -18.588) 19.176 17.340 ( 3.962 -2.548 18.588) 19.176 17.640 ( -7.671 -6.477 -5.201) 11.307 17.640 ( -7.671 -6.477 5.201) 11.307 17.907 ( -0.316 -1.055 -2.170) 2.434 17.907 ( -0.316 -1.055 2.170) 2.434 18.257 ( -4.227 2.656 -4.029) 6.416 18.257 ( -4.227 2.656 4.029) 6.416 18.523 ( 0.556 9.268 -12.399) 15.490 18.523 ( 0.556 9.268 12.399) 15.490 19.520 ( -1.908 -10.599 -3.795) 11.419 19.520 ( -1.908 -10.599 3.795) 11.419 20.303 ( -0.491 -0.660 -6.383) 6.436 20.303 ( -0.491 -0.660 6.383) 6.436 20.509 ( 0.618 6.872 -8.986) 11.329 20.509 ( 0.618 6.872 8.986) 11.329 20.836 ( 4.500 4.299 -9.044) 10.978 20.836 ( 4.500 4.299 9.044) 10.978 21.319 ( 13.560 -9.363 -7.149) 17.962 21.319 ( 13.560 -9.363 7.149) 17.962 22.957 ( -13.259 18.589 -11.707) 25.659 22.957 ( -13.259 18.589 11.707) 25.659 23.552 ( -13.278 -1.827 -16.876) 21.551 23.552 ( -13.278 -1.827 16.876) 21.551 26.556 ( 7.593 1.336 -3.102) 8.311 26.556 ( 7.593 1.336 3.102) 8.311 26.982 ( 1.671 -12.190 -11.393) 16.769 26.982 ( 1.671 -12.190 11.393) 16.769 ======================= Grid point 303 (94/100) ======================= q-point: ( 0.33 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.105 ( 32.245 29.149 -14.866) 45.939 5.105 ( 32.245 29.149 14.866) 45.939 6.715 ( 26.472 15.972 -32.554) 44.896 6.715 ( 26.472 15.972 32.554) 44.896 7.139 ( -3.873 7.599 -3.187) 9.105 7.139 ( -3.873 7.599 3.187) 9.105 7.409 ( 0.533 4.742 -2.068) 5.201 7.409 ( 0.533 4.742 2.068) 5.201 7.600 ( -4.857 9.651 -4.412) 11.670 7.600 ( -4.857 9.651 4.412) 11.670 8.301 ( 2.774 -4.403 -7.426) 9.068 8.301 ( 2.774 -4.403 7.426) 9.068 8.678 ( -3.060 -8.781 -5.968) 11.049 8.678 ( -3.060 -8.781 5.968) 11.049 9.474 ( 7.639 1.990 -19.262) 20.816 9.474 ( 7.639 1.990 19.262) 20.816 9.912 ( 11.303 10.430 -3.201) 15.709 9.912 ( 11.303 10.430 3.201) 15.709 10.139 ( -3.041 4.117 -13.209) 14.166 10.139 ( -3.041 4.117 13.209) 14.166 10.687 ( 23.204 13.780 -23.699) 35.916 10.687 ( 23.204 13.780 23.699) 35.916 11.442 ( 8.714 2.315 -3.539) 9.686 11.442 ( 8.714 2.315 3.539) 9.686 11.779 ( -1.221 4.288 -1.898) 4.845 11.779 ( -1.221 4.288 1.898) 4.845 11.950 ( 1.447 -3.246 -10.469) 11.055 11.950 ( 1.447 -3.246 10.469) 11.055 12.292 ( -0.303 -2.295 -8.443) 8.755 12.292 ( -0.303 -2.295 8.443) 8.755 12.419 ( -10.922 -0.125 -8.289) 13.712 12.419 ( -10.922 -0.125 8.289) 13.712 12.688 ( -4.195 -4.002 -6.683) 8.848 12.688 ( -4.195 -4.002 6.683) 8.848 12.860 ( 15.789 5.099 -2.141) 16.730 12.860 ( 15.789 5.099 2.141) 16.730 13.145 ( -6.266 0.490 -10.907) 12.588 13.145 ( -6.266 0.491 10.907) 12.588 13.460 ( -3.520 -6.223 -5.293) 8.896 13.460 ( -3.520 -6.223 5.293) 8.896 13.679 ( -7.914 2.803 -4.688) 9.615 13.679 ( -7.914 2.803 4.688) 9.615 14.008 ( -4.106 2.588 -12.341) 13.261 14.008 ( -4.106 2.588 12.341) 13.261 14.366 ( -0.973 0.985 -7.409) 7.537 14.366 ( -0.973 0.985 7.409) 7.537 14.742 ( 10.376 -1.911 -6.602) 12.446 14.742 ( 10.376 -1.911 6.602) 12.446 15.094 ( -16.285 0.092 -6.375) 17.488 15.094 ( -16.285 0.092 6.375) 17.488 15.436 ( 0.657 -9.704 -7.125) 12.057 15.436 ( 0.657 -9.704 7.125) 12.057 15.667 ( 0.055 -4.414 -8.958) 9.986 15.667 ( 0.055 -4.414 8.958) 9.986 17.068 ( -9.547 -9.133 -9.377) 16.202 17.068 ( -9.547 -9.133 9.377) 16.202 17.320 ( 1.273 -8.307 -1.856) 8.606 17.320 ( 1.273 -8.307 1.856) 8.606 17.633 ( 2.132 3.030 -5.747) 6.837 17.633 ( 2.132 3.030 5.747) 6.837 17.924 ( 2.458 1.652 -2.538) 3.900 17.924 ( 2.458 1.652 2.538) 3.900 18.190 ( -2.434 1.553 -3.028) 4.184 18.190 ( -2.434 1.553 3.028) 4.184 18.611 ( 7.637 14.042 -10.204) 18.963 18.611 ( 7.637 14.042 10.204) 18.963 19.442 ( -5.715 -1.491 -5.747) 8.241 19.442 ( -5.715 -1.491 5.747) 8.241 20.279 ( -1.632 -0.866 -6.327) 6.591 20.279 ( -1.632 -0.866 6.327) 6.591 20.465 ( -3.722 -0.970 -6.702) 7.727 20.465 ( -3.722 -0.970 6.702) 7.727 21.008 ( 12.136 9.709 -5.901) 16.624 21.008 ( 12.136 9.709 5.901) 16.624 21.604 ( 13.343 -6.164 -6.372) 16.020 21.604 ( 13.343 -6.164 6.372) 16.020 22.664 ( -14.894 13.576 -4.539) 20.658 22.664 ( -14.894 13.576 4.539) 20.658 23.274 ( -14.485 -5.163 -14.754) 21.311 23.274 ( -14.485 -5.163 14.754) 21.311 26.714 ( 8.070 -1.998 -4.402) 9.408 26.714 ( 8.070 -1.998 4.402) 9.408 27.006 ( 0.437 -11.239 -11.169) 15.851 27.006 ( 0.437 -11.239 11.169) 15.851 ======================= Grid point 305 (95/100) ======================= q-point: ( 0.44 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.790 ( 35.584 27.791 -6.075) 45.557 5.790 ( 35.584 27.791 6.075) 45.557 6.590 ( -31.945 23.906 -2.225) 39.961 6.590 ( -31.945 23.906 2.225) 39.961 7.201 ( 13.494 18.395 -20.768) 30.851 7.201 ( 13.494 18.395 20.768) 30.851 7.409 ( -6.525 16.932 -11.477) 21.471 7.409 ( -6.525 16.932 11.477) 21.471 7.607 ( 5.727 13.497 -2.325) 14.845 7.607 ( 5.727 13.497 2.325) 14.845 8.279 ( -4.706 -10.990 -3.051) 12.339 8.279 ( -4.706 -10.990 3.051) 12.339 8.766 ( 7.652 -20.767 -3.448) 22.399 8.766 ( 7.652 -20.767 3.448) 22.399 9.586 ( 3.237 -17.407 -7.217) 19.120 9.586 ( 3.237 -17.407 7.217) 19.120 10.014 ( -0.503 2.977 -2.794) 4.114 10.014 ( -0.503 2.977 2.794) 4.114 10.108 ( -0.067 10.641 -4.555) 11.575 10.108 ( -0.067 10.641 4.555) 11.575 11.190 ( 26.143 18.372 -25.960) 41.169 11.190 ( 26.143 18.372 25.960) 41.169 11.675 ( 3.736 4.790 -2.846) 6.708 11.675 ( 3.736 4.790 2.846) 6.708 11.791 ( 2.004 4.265 -10.202) 11.237 11.791 ( 2.004 4.265 10.202) 11.237 11.974 ( -0.561 -4.091 -7.497) 8.559 11.974 ( -0.561 -4.091 7.497) 8.559 12.132 ( -6.443 -1.499 -9.796) 11.820 12.132 ( -6.443 -1.499 9.796) 11.820 12.309 ( -2.269 -5.833 -2.034) 6.581 12.309 ( -2.269 -5.833 2.034) 6.581 12.578 ( -2.784 4.147 -10.961) 12.046 12.578 ( -2.784 4.147 10.961) 12.046 12.880 ( -15.760 5.496 -8.924) 18.927 12.880 ( -15.760 5.496 8.924) 18.927 13.149 ( 9.766 -2.593 -5.164) 11.347 13.149 ( 9.766 -2.593 5.164) 11.347 13.323 ( -9.490 -12.354 -6.511) 16.884 13.323 ( -9.490 -12.354 6.511) 16.884 13.632 ( 7.015 1.511 -4.500) 8.470 13.632 ( 7.015 1.511 4.500) 8.470 13.904 ( -7.696 -0.372 -4.984) 9.176 13.904 ( -7.696 -0.372 4.984) 9.176 14.449 ( 7.351 -1.542 -5.739) 9.452 14.449 ( 7.351 -1.542 5.739) 9.452 14.758 ( -12.558 11.183 -7.607) 18.456 14.758 ( -12.558 11.183 7.607) 18.456 15.049 ( 16.103 -13.528 -4.364) 21.479 15.049 ( 16.103 -13.528 4.364) 21.479 15.345 ( -11.266 -18.396 -6.499) 22.530 15.345 ( -11.266 -18.396 6.499) 22.530 15.701 ( 2.619 16.875 -4.184) 17.582 15.701 ( 2.619 16.875 4.184) 17.582 16.863 ( -7.217 -10.098 -7.846) 14.684 16.863 ( -7.217 -10.098 7.846) 14.684 17.398 ( 3.921 -6.529 -5.171) 9.205 17.398 ( 3.921 -6.529 5.171) 9.205 17.622 ( -1.974 1.383 -2.471) 3.452 17.622 ( -1.974 1.383 2.471) 3.452 17.977 ( 1.803 0.036 -1.560) 2.384 17.977 ( 1.803 0.036 1.560) 2.384 18.161 ( -0.645 1.243 -1.231) 1.865 18.161 ( -0.645 1.243 1.231) 1.865 18.777 ( 7.069 17.844 -4.250) 19.658 18.777 ( 7.069 17.844 4.250) 19.658 19.319 ( -5.386 3.031 -3.639) 7.172 19.319 ( -5.386 3.031 3.639) 7.172 20.255 ( -0.615 -1.476 -2.470) 2.942 20.255 ( -0.615 -1.476 2.470) 2.942 20.404 ( -1.916 -4.638 -2.671) 5.685 20.404 ( -1.916 -4.638 2.671) 5.685 21.255 ( 10.460 14.821 -2.758) 18.349 21.255 ( 10.460 14.821 2.758) 18.349 21.740 ( -0.229 3.712 -1.283) 3.934 21.740 ( -0.229 3.712 1.283) 3.934 22.474 ( -3.014 4.359 -3.738) 6.485 22.474 ( -3.014 4.359 3.738) 6.485 23.028 ( -8.630 -10.857 -7.941) 15.982 23.028 ( -8.630 -10.857 7.941) 15.982 26.847 ( 4.655 -5.397 -4.184) 8.265 26.847 ( 4.655 -5.397 4.184) 8.265 26.995 ( -1.229 -8.878 -6.705) 11.193 26.995 ( -1.229 -8.878 6.705) 11.193 ======================= Grid point 315 (96/100) ======================= q-point: ( 0.00 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.872 ( 0.000 16.276 -15.764) 22.658 4.872 ( 0.000 16.276 15.764) 22.658 4.944 ( 0.000 8.476 -16.699) 18.727 4.944 ( 0.000 8.476 16.699) 18.727 6.387 ( 0.000 -16.894 -2.136) 17.029 6.387 ( 0.000 -16.894 2.136) 17.029 6.676 ( 0.000 -12.477 -8.381) 15.031 6.676 ( 0.000 -12.477 8.381) 15.031 7.187 ( 0.000 -2.347 -2.187) 3.208 7.187 ( 0.000 -2.347 2.187) 3.208 8.614 ( 0.000 0.776 -1.579) 1.759 8.614 ( 0.000 0.776 1.579) 1.759 9.045 ( 0.000 -1.711 -0.197) 1.722 9.045 ( 0.000 -1.711 0.197) 1.722 9.616 ( 0.000 10.567 -5.351) 11.845 9.616 ( 0.000 10.567 5.351) 11.845 10.269 ( 0.000 33.120 -14.448) 36.134 10.269 ( 0.000 33.120 14.448) 36.134 10.475 ( 0.000 26.374 -10.966) 28.563 10.475 ( 0.000 26.374 10.966) 28.563 10.523 ( 0.000 0.137 -0.007) 0.137 10.523 ( 0.000 0.137 0.007) 0.137 11.409 ( 0.000 -22.805 -13.210) 26.354 11.409 ( 0.000 -22.805 13.210) 26.354 11.788 ( 0.000 4.893 -2.847) 5.661 11.788 ( 0.000 4.893 2.847) 5.661 11.978 ( 0.000 -11.248 -2.601) 11.545 11.978 ( 0.000 -11.248 2.601) 11.545 12.120 ( 0.000 7.812 -1.299) 7.919 12.120 ( 0.000 7.812 1.299) 7.919 12.352 ( 0.000 -4.318 -1.415) 4.544 12.352 ( 0.000 -4.318 1.415) 4.544 12.431 ( 0.000 -10.786 -7.289) 13.018 12.431 ( 0.000 -10.786 7.289) 13.018 13.074 ( 0.000 3.723 -3.433) 5.064 13.074 ( 0.000 3.723 3.433) 5.064 13.169 ( 0.000 8.061 -3.716) 8.876 13.169 ( 0.000 8.061 3.716) 8.876 13.410 ( 0.000 15.552 -1.619) 15.636 13.410 ( 0.000 15.552 1.619) 15.636 13.750 ( 0.000 -19.456 -8.514) 21.237 13.750 ( 0.000 -19.456 8.514) 21.237 14.072 ( 0.000 4.789 -15.946) 16.650 14.072 ( 0.000 4.789 15.946) 16.650 14.199 ( 0.000 7.465 -19.850) 21.207 14.199 ( 0.000 7.465 19.850) 21.207 14.857 ( 0.000 -1.433 -1.425) 2.020 14.857 ( 0.000 -1.433 1.425) 2.020 15.082 ( 0.000 -2.168 -7.042) 7.369 15.082 ( 0.000 -2.168 7.042) 7.369 15.198 ( 0.000 -14.653 -12.981) 19.576 15.198 ( 0.000 -14.653 12.981) 19.576 16.381 ( 0.000 3.536 -0.741) 3.613 16.381 ( 0.000 3.536 0.741) 3.613 16.762 ( 0.000 5.341 -3.250) 6.253 16.762 ( 0.000 5.341 3.250) 6.253 17.205 ( 0.000 -0.455 -8.230) 8.242 17.205 ( 0.000 -0.455 8.230) 8.242 17.731 ( 0.000 -5.497 -4.567) 7.147 17.731 ( 0.000 -5.497 4.567) 7.147 17.748 ( 0.000 -6.921 -6.371) 9.407 17.748 ( 0.000 -6.921 6.371) 9.407 18.426 ( 0.000 1.959 -0.652) 2.065 18.426 ( 0.000 1.959 0.652) 2.065 18.737 ( 0.000 5.046 -4.213) 6.573 18.737 ( 0.000 5.046 4.213) 6.573 19.031 ( 0.000 -14.773 -4.799) 15.533 19.031 ( 0.000 -14.773 4.799) 15.533 20.319 ( 0.000 1.158 -1.980) 2.294 20.319 ( 0.000 1.158 1.980) 2.294 20.646 ( 0.000 9.339 -12.379) 15.507 20.646 ( 0.000 9.339 12.379) 15.507 20.792 ( 0.000 -3.623 -13.505) 13.982 20.792 ( 0.000 -3.623 13.505) 13.982 20.991 ( 0.000 -2.638 -0.474) 2.680 20.991 ( 0.000 -2.638 0.474) 2.680 23.555 ( 0.000 13.623 -19.147) 23.499 23.555 ( 0.000 13.623 19.147) 23.499 23.779 ( 0.000 -6.667 -19.066) 20.198 23.779 ( 0.000 -6.667 19.066) 20.198 26.486 ( 0.000 4.300 -0.041) 4.300 26.486 ( 0.000 4.300 0.041) 4.300 26.755 ( 0.000 -6.644 -0.884) 6.702 26.755 ( 0.000 -6.644 0.884) 6.702 ======================= Grid point 317 (97/100) ======================= q-point: ( 0.11 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.897 ( 8.107 25.374 -14.091) 30.135 4.897 ( 8.107 25.374 14.091) 30.135 5.302 ( 29.265 -3.752 -17.705) 34.409 5.302 ( 29.265 -3.752 17.705) 34.409 6.483 ( 10.229 -13.385 -1.850) 16.947 6.483 ( 10.229 -13.385 1.850) 16.947 6.851 ( 16.359 -11.373 -8.253) 21.566 6.851 ( 16.359 -11.373 8.253) 21.566 7.289 ( 9.763 -1.815 -1.719) 10.078 7.289 ( 9.763 -1.815 1.719) 10.078 8.573 ( -4.278 1.070 -1.599) 4.691 8.573 ( -4.278 1.070 1.599) 4.691 9.106 ( 4.312 1.154 -0.354) 4.477 9.106 ( 4.312 1.154 0.354) 4.477 9.575 ( -3.419 7.718 -4.895) 9.758 9.575 ( -3.419 7.718 4.895) 9.758 10.223 ( -13.140 12.924 -1.816) 18.520 10.223 ( -13.140 12.924 1.816) 18.520 10.368 ( -4.290 12.384 -12.150) 17.872 10.368 ( -4.290 12.384 12.150) 17.872 10.497 ( 3.133 31.885 -19.636) 37.577 10.497 ( 3.133 31.885 19.636) 37.577 11.411 ( 0.119 -23.513 -14.056) 27.395 11.411 ( 0.119 -23.513 14.056) 27.395 11.839 ( 2.087 5.788 -2.778) 6.751 11.839 ( 2.087 5.788 2.778) 6.751 11.948 ( -0.105 -9.488 -2.950) 9.936 11.948 ( -0.105 -9.488 2.950) 9.936 12.160 ( 4.127 6.969 -3.119) 8.679 12.160 ( 4.127 6.969 3.119) 8.679 12.373 ( -3.460 -4.014 -4.981) 7.273 12.373 ( -3.460 -4.014 4.981) 7.273 12.486 ( 8.393 -10.595 -8.133) 15.775 12.486 ( 8.393 -10.595 8.133) 15.775 12.979 ( -2.826 3.765 -2.030) 5.127 12.979 ( -2.826 3.765 2.030) 5.127 13.141 ( -5.136 5.976 -4.593) 9.121 13.141 ( -5.136 5.976 4.593) 9.121 13.397 ( -9.422 1.221 -0.125) 9.502 13.397 ( -9.422 1.221 0.125) 9.502 13.749 ( 8.377 -0.093 -8.071) 11.633 13.749 ( 8.377 -0.093 8.071) 11.633 14.136 ( 0.924 7.782 -4.709) 9.143 14.136 ( 0.924 7.782 4.709) 9.143 14.261 ( 9.621 -5.125 -6.532) 12.708 14.261 ( 9.621 -5.125 6.532) 12.708 14.955 ( 0.884 -1.391 -7.426) 7.607 14.955 ( 0.884 -1.391 7.426) 7.607 15.020 ( -1.317 1.747 -3.686) 4.287 15.020 ( -1.317 1.747 3.686) 4.287 15.299 ( 10.906 -11.468 -11.993) 19.857 15.299 ( 10.906 -11.468 11.993) 19.857 15.966 ( -29.018 0.150 -3.773) 29.263 15.966 ( -29.018 0.150 3.773) 29.263 17.042 ( 10.333 7.258 -6.356) 14.137 17.042 ( 10.333 7.258 6.356) 14.137 17.159 ( 0.846 -5.019 -12.403) 13.407 17.159 ( 0.846 -5.019 12.403) 13.407 17.663 ( -5.324 -4.399 -4.813) 8.418 17.663 ( -5.324 -4.399 4.813) 8.418 17.794 ( 3.492 -4.772 -1.507) 6.102 17.794 ( 3.492 -4.772 1.507) 6.102 18.387 ( -3.830 1.599 -1.123) 4.299 18.387 ( -3.830 1.599 1.123) 4.299 18.728 ( 0.184 9.739 -7.002) 11.996 18.728 ( 0.184 9.739 7.002) 11.996 19.112 ( 6.814 -16.649 -3.822) 18.392 19.112 ( 6.814 -16.649 3.822) 18.392 20.317 ( -0.111 0.942 -2.262) 2.453 20.317 ( -0.111 0.942 2.262) 2.453 20.675 ( 0.975 9.075 -12.103) 15.159 20.675 ( 0.975 9.075 12.103) 15.159 20.815 ( 3.289 -1.889 -13.595) 14.114 20.815 ( 3.289 -1.889 13.595) 14.114 20.996 ( 1.848 -4.674 -2.531) 5.627 20.996 ( 1.848 -4.674 2.531) 5.627 23.491 ( -7.080 13.793 -18.753) 24.332 23.491 ( -7.080 13.793 18.753) 24.332 23.695 ( -8.104 -6.864 -19.094) 21.849 23.695 ( -8.104 -6.864 19.094) 21.849 26.523 ( 3.588 4.522 -1.325) 5.923 26.523 ( 3.588 4.522 1.325) 5.923 26.754 ( 0.172 -7.435 -3.815) 8.358 26.754 ( 0.172 -7.435 3.815) 8.358 ======================= Grid point 319 (98/100) ======================= q-point: ( 0.22 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.189 ( 21.306 28.495 -9.216) 36.754 5.189 ( 21.306 28.495 9.216) 36.754 5.965 ( 34.995 -15.596 -13.289) 40.552 5.965 ( 34.995 -15.596 13.289) 40.552 6.807 ( 23.143 -3.121 -4.621) 23.805 6.807 ( 23.143 -3.121 4.621) 23.805 7.225 ( 19.125 -7.645 -6.789) 21.686 7.225 ( 19.125 -7.645 6.789) 21.686 7.525 ( 13.095 0.471 -1.597) 13.201 7.525 ( 13.095 0.471 1.597) 13.201 8.441 ( -9.299 0.282 -2.123) 9.542 8.441 ( -9.299 0.282 2.123) 9.542 9.033 ( -15.917 10.715 -0.958) 19.212 9.033 ( -15.917 10.715 0.958) 19.212 9.520 ( -4.314 -3.806 -5.045) 7.652 9.520 ( -4.314 -3.806 5.045) 7.652 9.957 ( -1.899 2.578 -0.474) 3.237 9.957 ( -1.899 2.578 0.474) 3.237 10.335 ( -3.354 7.614 -8.251) 11.717 10.335 ( -3.354 7.614 8.251) 11.717 10.677 ( 15.910 39.604 -31.289) 52.920 10.677 ( 15.910 39.604 31.289) 52.920 11.419 ( 1.280 -20.784 -13.503) 24.818 11.419 ( 1.280 -20.784 13.503) 24.818 11.814 ( -1.750 3.126 -6.014) 7.000 11.814 ( -1.750 3.126 6.014) 7.000 11.976 ( 0.032 -0.275 -4.475) 4.484 11.976 ( 0.032 -0.275 4.475) 4.484 12.217 ( -2.884 -0.723 -1.460) 3.312 12.217 ( -2.884 -0.723 1.460) 3.312 12.416 ( 12.078 -1.871 -8.030) 14.625 12.416 ( 12.078 -1.871 8.030) 14.625 12.582 ( 1.539 -6.292 -6.000) 8.829 12.582 ( 1.539 -6.292 6.000) 8.829 12.908 ( -15.039 1.301 -1.500) 15.170 12.908 ( -15.039 1.301 1.500) 15.170 13.050 ( 6.449 1.241 -3.807) 7.591 13.050 ( 6.449 1.241 3.807) 7.591 13.256 ( -4.031 -9.184 -0.830) 10.064 13.256 ( -4.031 -9.184 0.830) 10.064 13.835 ( 0.065 7.279 -8.250) 11.002 13.835 ( 0.065 7.279 8.250) 11.002 14.263 ( 7.279 8.764 -6.504) 13.119 14.263 ( 7.279 8.764 6.504) 13.119 14.415 ( 4.788 -8.669 -6.626) 11.915 14.415 ( 4.788 -8.669 6.626) 11.915 14.790 ( -13.769 10.596 -6.777) 18.650 14.790 ( -13.769 10.596 6.777) 18.650 15.064 ( 4.334 -10.699 -3.272) 11.998 15.064 ( 4.334 -10.699 3.272) 11.998 15.409 ( -20.637 -2.199 -6.958) 21.889 15.409 ( -20.637 -2.199 6.958) 21.889 15.587 ( 10.597 -1.593 -8.928) 13.948 15.587 ( 10.597 -1.593 8.928) 13.948 16.987 ( -3.438 -4.042 -1.929) 5.646 16.987 ( -3.438 -4.042 1.929) 5.646 17.276 ( -2.810 -3.198 -4.548) 6.230 17.276 ( -2.810 -3.198 4.548) 6.230 17.609 ( 2.867 1.449 -2.048) 3.810 17.609 ( 2.867 1.449 2.048) 3.810 17.875 ( 4.522 -1.489 -0.622) 4.802 17.875 ( 4.522 -1.489 0.622) 4.802 18.289 ( -5.633 0.767 -1.398) 5.855 18.289 ( -5.633 0.767 1.398) 5.855 18.770 ( 4.305 13.038 -7.825) 15.804 18.770 ( 4.305 13.038 7.825) 15.804 19.248 ( 6.349 -14.002 -1.794) 15.478 19.248 ( 6.349 -14.002 1.794) 15.478 20.313 ( -0.534 0.845 -3.172) 3.326 20.313 ( -0.534 0.845 3.172) 3.326 20.606 ( -7.551 2.490 -5.638) 9.747 20.606 ( -7.551 2.490 5.638) 9.747 20.954 ( 10.497 7.474 -9.439) 15.974 20.954 ( 10.497 7.474 9.439) 15.974 21.128 ( 12.195 -9.374 -8.163) 17.413 21.128 ( 12.195 -9.374 8.163) 17.413 23.262 ( -15.991 11.518 -12.819) 23.509 23.262 ( -15.991 11.518 12.819) 23.509 23.481 ( -13.622 -5.260 -14.549) 20.613 23.481 ( -13.622 -5.260 14.549) 20.613 26.613 ( 5.286 4.358 -2.163) 7.184 26.613 ( 5.286 4.358 2.163) 7.184 26.772 ( 1.779 -8.473 -6.141) 10.614 26.772 ( 1.779 -8.473 6.141) 10.614 ======================= Grid point 321 (99/100) ======================= q-point: ( 0.33 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.709 ( 31.059 27.956 -5.030) 42.089 5.709 ( 31.059 27.956 5.030) 42.089 6.574 ( 26.641 -20.835 -6.750) 34.488 6.574 ( 26.641 -20.835 6.750) 34.488 7.319 ( 23.376 7.780 -11.014) 26.987 7.319 ( 23.376 7.780 11.014) 26.987 7.485 ( 4.162 0.795 -5.014) 6.564 7.485 ( 4.162 0.795 5.014) 6.564 7.744 ( 7.171 6.602 -3.044) 10.211 7.744 ( 7.171 6.602 3.044) 10.211 8.244 ( -8.430 -4.506 -2.659) 9.922 8.244 ( -8.430 -4.506 2.659) 9.922 8.606 ( -18.928 1.951 -4.650) 19.589 8.606 ( -18.928 1.951 4.650) 19.589 9.392 ( -7.240 -5.591 -4.386) 10.144 9.392 ( -7.240 -5.591 4.387) 10.144 10.108 ( 8.822 5.086 -0.190) 10.185 10.108 ( 8.822 5.086 0.190) 10.185 10.245 ( -4.378 4.113 -6.403) 8.779 10.245 ( -4.378 4.113 6.403) 8.779 11.090 ( 24.978 25.479 -26.549) 44.474 11.090 ( 24.978 25.479 26.549) 44.474 11.516 ( 10.191 -5.581 -5.521) 12.864 11.516 ( 10.191 -5.581 5.521) 12.864 11.827 ( 3.505 2.178 -3.530) 5.430 11.827 ( 3.505 2.178 3.530) 5.430 11.948 ( -1.782 4.615 -3.007) 5.789 11.948 ( -1.782 4.615 3.007) 5.789 12.159 ( -1.796 -7.597 -6.312) 10.039 12.159 ( -1.796 -7.597 6.312) 10.039 12.449 ( -12.516 1.413 -4.498) 13.375 12.449 ( -12.516 1.413 4.498) 13.375 12.598 ( 0.949 -2.200 -5.845) 6.317 12.598 ( 0.949 -2.200 5.845) 6.317 12.845 ( 5.453 -11.246 -1.885) 12.640 12.845 ( 5.453 -11.246 1.885) 12.640 13.066 ( -2.593 2.383 -5.364) 6.416 13.066 ( -2.593 2.383 5.364) 6.416 13.231 ( 0.724 -10.962 -4.288) 11.793 13.231 ( 0.724 -10.962 4.288) 11.793 13.826 ( -1.800 8.877 -2.378) 9.365 13.826 ( -1.800 8.877 2.378) 9.365 14.109 ( -23.386 2.340 -1.891) 23.578 14.109 ( -23.386 2.340 1.891) 23.578 14.431 ( 0.203 4.366 -6.529) 7.857 14.431 ( 0.203 4.366 6.529) 7.857 14.604 ( -1.096 -10.081 -9.002) 13.560 14.604 ( -1.096 -10.081 9.002) 13.560 15.120 ( -7.829 2.139 -4.529) 9.294 15.120 ( -7.829 2.139 4.529) 9.294 15.227 ( 5.212 -4.693 -7.323) 10.140 15.227 ( 5.212 -4.693 7.323) 10.140 15.748 ( 8.724 3.976 -1.762) 9.748 15.748 ( 8.724 3.976 1.762) 9.748 16.985 ( -6.794 1.680 -11.931) 13.832 16.985 ( -6.794 1.680 11.931) 13.832 17.121 ( 0.049 -10.182 -10.782) 14.830 17.121 ( 0.049 -10.182 10.782) 14.830 17.671 ( -0.048 0.672 -2.153) 2.256 17.671 ( -0.048 0.672 2.153) 2.256 17.962 ( 4.154 1.784 -0.786) 4.588 17.962 ( 4.154 1.784 0.786) 4.588 18.190 ( -4.053 -0.759 -1.472) 4.378 18.190 ( -4.053 -0.759 1.472) 4.378 18.899 ( 8.775 12.180 -5.410) 15.957 18.899 ( 8.775 12.180 5.410) 15.957 19.342 ( 2.634 -7.020 -0.549) 7.518 19.342 ( 2.634 -7.020 0.549) 7.518 20.288 ( -2.086 1.336 -4.640) 5.260 20.288 ( -2.086 1.336 4.640) 5.260 20.432 ( -8.805 -1.753 -5.530) 10.545 20.432 ( -8.805 -1.753 5.530) 10.545 21.216 ( 15.898 10.510 -7.682) 20.548 21.216 ( 15.898 10.510 7.682) 20.548 21.437 ( 17.669 -9.664 -7.959) 21.655 21.437 ( 17.669 -9.664 7.959) 21.655 22.903 ( -19.287 9.138 -6.797) 22.399 22.903 ( -19.287 9.138 6.797) 22.399 23.163 ( -18.327 -5.456 -10.323) 21.730 23.163 ( -18.327 -5.456 10.323) 21.730 26.716 ( 4.942 2.465 -1.515) 5.726 26.716 ( 4.942 2.465 1.515) 5.726 26.817 ( 2.358 -7.506 -5.717) 9.726 26.817 ( 2.358 -7.506 5.717) 9.726 ======================= Grid point 323 (100/100) ======================= q-point: ( 0.44 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.84e-05 1.84e-05 1.84e-05 1.84e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.365 ( 34.100 26.963 -1.780) 43.508 6.365 ( 34.100 26.963 1.780) 43.508 6.923 ( -3.350 0.847 -2.439) 4.229 6.923 ( -3.350 0.847 2.439) 4.229 7.301 ( -3.694 4.062 -3.369) 6.442 7.301 ( -3.694 4.062 3.369) 6.442 7.512 ( -8.133 -6.057 -1.339) 10.229 7.512 ( -8.133 -6.057 1.339) 10.229 7.858 ( 6.215 7.222 -3.480) 10.143 7.858 ( 6.215 7.222 3.480) 10.143 8.076 ( -7.141 -8.129 -7.449) 13.137 8.076 ( -7.141 -8.129 7.449) 13.137 8.633 ( 14.452 7.631 -10.618) 19.489 8.633 ( 14.452 7.631 10.618) 19.489 9.216 ( -10.176 -16.379 -5.529) 20.060 9.216 ( -10.176 -16.379 5.529) 20.060 10.139 ( -1.364 7.640 -1.665) 7.937 10.139 ( -1.364 7.640 1.665) 7.937 10.238 ( 0.705 0.031 -1.154) 1.353 10.238 ( 0.705 0.031 1.154) 1.353 11.533 ( 15.009 11.404 -10.848) 21.749 11.533 ( 15.009 11.404 10.848) 21.749 11.769 ( 8.278 -2.032 -5.302) 10.038 11.769 ( 8.278 -2.032 5.302) 10.038 11.919 ( 6.625 12.641 -15.970) 21.418 11.919 ( 6.625 12.641 15.970) 21.418 12.007 ( 8.848 7.623 -1.691) 11.801 12.007 ( 8.848 7.623 1.691) 11.801 12.124 ( -2.792 1.357 -5.686) 6.478 12.124 ( -2.792 1.357 5.686) 6.478 12.241 ( -4.443 0.256 -5.772) 7.288 12.241 ( -4.443 0.256 5.772) 7.288 12.587 ( -3.031 -3.454 -6.296) 7.795 12.587 ( -3.031 -3.454 6.296) 7.795 12.731 ( -11.383 -18.504 -10.254) 24.023 12.731 ( -11.383 -18.504 10.254) 24.023 13.023 ( -0.087 -8.631 -4.675) 9.817 13.023 ( -0.087 -8.631 4.675) 9.817 13.186 ( -12.729 2.018 -0.721) 12.908 13.186 ( -12.729 2.018 0.721) 12.908 13.707 ( 2.681 6.029 -1.627) 6.795 13.707 ( 2.681 6.029 1.627) 6.795 13.886 ( -3.835 -2.634 -3.460) 5.798 13.886 ( -3.835 -2.634 3.460) 5.798 14.436 ( 0.100 2.282 -2.712) 3.546 14.436 ( 0.100 2.282 2.712) 3.546 14.627 ( 1.693 -18.688 -3.203) 19.036 14.627 ( 1.693 -18.688 3.203) 19.036 15.003 ( -3.643 10.824 -5.713) 12.770 15.003 ( -3.643 10.824 5.713) 12.770 15.187 ( -5.062 -4.661 -5.900) 9.064 15.187 ( -5.062 -4.661 5.900) 9.064 16.053 ( 18.082 14.040 -1.681) 22.954 16.053 ( 18.082 14.040 1.681) 22.954 16.665 ( -17.538 -8.923 -5.206) 20.354 16.665 ( -17.538 -8.923 5.206) 20.354 17.321 ( 11.971 -1.114 -4.370) 12.792 17.321 ( 11.971 -1.114 4.370) 12.792 17.583 ( -7.721 -3.221 -2.208) 8.652 17.583 ( -7.721 -3.221 2.208) 8.652 18.025 ( 1.940 3.958 -0.427) 4.429 18.025 ( 1.940 3.958 0.427) 4.429 18.135 ( -1.551 -3.056 -0.951) 3.556 18.135 ( -1.551 -3.056 0.951) 3.556 19.088 ( 8.866 11.797 -2.363) 14.945 19.088 ( 8.866 11.797 2.363) 14.945 19.330 ( -3.532 -2.402 -1.330) 4.473 19.330 ( -3.532 -2.402 1.330) 4.473 20.244 ( -1.598 1.075 -2.856) 3.444 20.244 ( -1.598 1.075 2.856) 3.444 20.308 ( -3.374 -4.462 -3.318) 6.504 20.308 ( -3.374 -4.462 3.318) 6.504 21.530 ( 13.402 11.759 -4.238) 18.326 21.530 ( 13.402 11.759 4.238) 18.326 21.724 ( 8.069 -4.949 -3.563) 10.114 21.724 ( 8.069 -4.949 3.563) 10.114 22.595 ( -8.822 7.223 -3.941) 12.063 22.595 ( -8.822 7.223 3.941) 12.063 22.818 ( -13.984 -9.546 -6.695) 18.207 22.818 ( -13.984 -9.546 6.695) 18.207 26.792 ( 2.350 0.065 -0.677) 2.447 26.792 ( 2.350 0.065 0.677) 2.447 26.849 ( 0.756 -5.477 -2.719) 6.161 26.849 ( 0.756 -5.477 2.719) 6.161 =================== 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 3/40824 10.0 56281.526 54516.535 14351.638 0.000 0.000 0.000 3/40824 20.0 30422.559 27919.001 32281.321 0.000 0.000 0.000 3/40824 30.0 16139.789 15285.892 16215.880 0.000 0.000 -0.000 3/40824 40.0 7967.877 7510.220 7545.960 0.000 0.000 -0.000 3/40824 50.0 3925.153 3674.004 3640.623 0.000 0.000 -0.000 3/40824 60.0 2082.218 1941.615 1909.612 0.000 0.000 -0.000 3/40824 70.0 1210.931 1126.025 1102.503 0.000 0.000 -0.000 3/40824 80.0 767.414 711.690 695.145 0.000 0.000 -0.000 3/40824 90.0 522.922 483.598 471.826 0.000 0.000 -0.000 3/40824 100.0 377.953 348.526 339.910 0.000 0.000 -0.000 3/40824 110.0 286.437 263.369 256.860 0.000 0.000 -0.000 3/40824 120.0 225.538 206.783 201.710 0.000 0.000 -0.000 3/40824 130.0 183.185 167.488 163.420 0.000 0.000 -0.000 3/40824 140.0 152.616 139.172 135.825 0.000 0.000 -0.000 3/40824 150.0 129.848 118.119 115.301 0.000 0.000 -0.000 3/40824 160.0 112.431 102.042 99.621 0.000 0.000 -0.000 3/40824 170.0 98.795 89.478 87.363 0.000 0.000 -0.000 3/40824 180.0 87.905 79.463 77.586 0.000 0.000 -0.000 3/40824 190.0 79.053 71.338 69.650 0.000 0.000 -0.000 3/40824 200.0 71.748 64.645 63.111 0.000 0.000 -0.000 3/40824 210.0 65.637 59.055 57.647 0.000 0.000 -0.000 3/40824 220.0 60.463 54.331 53.027 0.000 0.000 -0.000 3/40824 230.0 56.034 50.294 49.079 0.000 0.000 -0.000 3/40824 240.0 52.206 46.811 45.671 0.000 0.000 -0.000 3/40824 250.0 48.869 43.779 42.704 0.000 0.000 -0.000 3/40824 260.0 45.937 41.119 40.101 0.000 0.000 -0.000 3/40824 270.0 43.343 38.768 37.800 0.000 0.000 -0.000 3/40824 280.0 41.031 36.677 35.753 0.000 0.000 -0.000 3/40824 290.0 38.960 34.805 33.921 0.000 0.000 -0.000 3/40824 300.0 37.095 33.121 32.272 0.000 0.000 -0.000 3/40824 310.0 35.406 31.598 30.781 0.000 0.000 -0.000 3/40824 320.0 33.869 30.214 29.426 0.000 0.000 -0.000 3/40824 330.0 32.466 28.951 28.190 0.000 0.000 -0.000 3/40824 340.0 31.179 27.794 27.057 0.000 0.000 -0.000 3/40824 350.0 29.994 26.729 26.016 0.000 0.000 -0.000 3/40824 360.0 28.901 25.748 25.056 0.000 0.000 -0.000 3/40824 370.0 27.887 24.839 24.166 0.000 0.000 -0.000 3/40824 380.0 26.946 23.995 23.341 0.000 0.000 -0.000 3/40824 390.0 26.070 23.209 22.573 0.000 0.000 -0.000 3/40824 400.0 25.251 22.476 21.856 0.000 0.000 -0.000 3/40824 410.0 24.485 21.790 21.186 0.000 0.000 -0.000 3/40824 420.0 23.766 21.147 20.557 0.000 0.000 -0.000 3/40824 430.0 23.090 20.543 19.967 0.000 0.000 -0.000 3/40824 440.0 22.453 19.974 19.411 0.000 0.000 -0.000 3/40824 450.0 21.853 19.437 18.887 0.000 0.000 -0.000 3/40824 460.0 21.285 18.930 18.391 0.000 0.000 -0.000 3/40824 470.0 20.747 18.449 17.922 0.000 0.000 -0.000 3/40824 480.0 20.237 17.994 17.478 0.000 0.000 -0.000 3/40824 490.0 19.753 17.562 17.056 0.000 0.000 -0.000 3/40824 500.0 19.292 17.151 16.655 0.000 0.000 -0.000 3/40824 510.0 18.853 16.760 16.274 0.000 0.000 -0.000 3/40824 520.0 18.435 16.387 15.910 0.000 0.000 -0.000 3/40824 530.0 18.036 16.031 15.563 0.000 0.000 -0.000 3/40824 540.0 17.654 15.691 15.231 0.000 0.000 -0.000 3/40824 550.0 17.289 15.365 14.914 0.000 0.000 -0.000 3/40824 560.0 16.939 15.054 14.610 0.000 0.000 -0.000 3/40824 570.0 16.604 14.755 14.319 0.000 0.000 -0.000 3/40824 580.0 16.282 14.469 14.040 0.000 0.000 -0.000 3/40824 590.0 15.973 14.194 13.772 0.000 0.000 -0.000 3/40824 600.0 15.676 13.929 13.514 0.000 0.000 -0.000 3/40824 610.0 15.391 13.675 13.266 0.000 0.000 -0.000 3/40824 620.0 15.115 13.430 13.028 0.000 0.000 -0.000 3/40824 630.0 14.850 13.194 12.798 0.000 0.000 -0.000 3/40824 640.0 14.595 12.966 12.577 0.000 0.000 -0.000 3/40824 650.0 14.348 12.747 12.363 0.000 0.000 -0.000 3/40824 660.0 14.110 12.535 12.157 0.000 0.000 -0.000 3/40824 670.0 13.880 12.330 11.957 0.000 0.000 -0.000 3/40824 680.0 13.657 12.132 11.765 0.000 0.000 -0.000 3/40824 690.0 13.442 11.941 11.578 0.000 0.000 -0.000 3/40824 700.0 13.234 11.755 11.398 0.000 0.000 -0.000 3/40824 710.0 13.032 11.576 11.224 0.000 0.000 -0.000 3/40824 720.0 12.836 11.402 11.054 0.000 0.000 -0.000 3/40824 730.0 12.647 11.233 10.890 0.000 0.000 -0.000 3/40824 740.0 12.463 11.070 10.731 0.000 0.000 -0.000 3/40824 750.0 12.284 10.911 10.577 0.000 0.000 -0.000 3/40824 760.0 12.111 10.757 10.427 0.000 0.000 -0.000 3/40824 770.0 11.943 10.607 10.282 0.000 0.000 -0.000 3/40824 780.0 11.779 10.462 10.141 0.000 0.000 -0.000 3/40824 790.0 11.620 10.321 10.003 0.000 0.000 -0.000 3/40824 800.0 11.465 10.183 9.869 0.000 0.000 -0.000 3/40824 810.0 11.315 10.049 9.739 0.000 0.000 -0.000 3/40824 820.0 11.168 9.919 9.613 0.000 0.000 -0.000 3/40824 830.0 11.026 9.792 9.490 0.000 0.000 -0.000 3/40824 840.0 10.887 9.669 9.370 0.000 0.000 -0.000 3/40824 850.0 10.751 9.548 9.253 0.000 0.000 -0.000 3/40824 860.0 10.619 9.431 9.139 0.000 0.000 -0.000 3/40824 870.0 10.491 9.317 9.028 0.000 0.000 -0.000 3/40824 880.0 10.365 9.205 8.919 0.000 0.000 -0.000 3/40824 890.0 10.242 9.096 8.813 0.000 0.000 -0.000 3/40824 900.0 10.123 8.990 8.710 0.000 0.000 -0.000 3/40824 910.0 10.006 8.886 8.609 0.000 0.000 -0.000 3/40824 920.0 9.892 8.784 8.511 0.000 0.000 -0.000 3/40824 930.0 9.780 8.685 8.415 0.000 0.000 -0.000 3/40824 940.0 9.671 8.589 8.321 0.000 0.000 -0.000 3/40824 950.0 9.565 8.494 8.229 0.000 0.000 -0.000 3/40824 960.0 9.461 8.402 8.139 0.000 0.000 -0.000 3/40824 970.0 9.359 8.311 8.051 0.000 0.000 -0.000 3/40824 980.0 9.259 8.223 7.965 0.000 0.000 -0.000 3/40824 990.0 9.162 8.136 7.881 0.000 0.000 -0.000 3/40824 1000.0 9.066 8.051 7.799 0.000 0.000 -0.000 3/40824 Thermal conductivity related properties were written into "kappa-m996.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 21:45:08]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|