----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 19:43:49]------------------------- 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: [1 3 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.780954543592867 -2.532259145000000 0.000000000000000 b 6.780954543592867 2.532259145000000 0.000000000000000 c -1.856886376515987 0.000000000000000 4.742258989621720 Atomic positions (fractional): *1 F 0.29726211492073 0.92590865538986 0.85532321804230 18.998 2 F 0.07409134461014 0.70273788507927 0.64467678195770 18.998 3 F 0.70273788507927 0.07409134461014 0.14467678195770 18.998 4 F 0.92590865538986 0.29726211492073 0.35532321804230 18.998 *5 F 0.76902627033674 0.68788541622750 0.76869718694353 18.998 6 F 0.31211458377250 0.23097372966326 0.73130281305647 18.998 7 F 0.23097372966326 0.31211458377250 0.23130281305647 18.998 8 F 0.68788541622750 0.76902627033674 0.26869718694353 18.998 *9 Al 0.50000000000000 0.00000000000000 0.00000000000000 26.982 10 Al 0.00000000000000 0.50000000000000 0.50000000000000 26.982 *11 Tl 0.26184896381852 0.73815103618148 0.25000000000000 204.383 12 Tl 0.73815103618148 0.26184896381852 0.75000000000000 204.383 -------------------------------- unit cell --------------------------------- Lattice vectors: a 13.561909087185734 0.000000000000000 0.000000000000000 b 0.000000000000000 5.064518290000000 0.000000000000000 c -1.856886376515987 0.000000000000000 4.742258989621720 Atomic positions (fractional): *1 F 0.61158538515530 0.31432327023456 0.85532321804230 18.998 > 1 2 F 0.88841461484470 0.81432327023456 0.64467678195770 18.998 > 2 3 F 0.88841461484470 0.18567672976544 0.14467678195770 18.998 > 3 4 F 0.61158538515530 0.68567672976544 0.35532321804230 18.998 > 4 *5 F 0.72845584328212 0.95942957294538 0.76869718694353 18.998 > 5 6 F 0.77154415671788 0.45942957294538 0.73130281305647 18.998 > 6 7 F 0.77154415671788 0.54057042705462 0.23130281305647 18.998 > 7 8 F 0.72845584328212 0.04057042705462 0.26869718694353 18.998 > 8 9 F 0.11158538515530 0.81432327023456 0.85532321804230 18.998 > 1 10 F 0.38841461484470 0.31432327023456 0.64467678195770 18.998 > 2 11 F 0.38841461484470 0.68567672976544 0.14467678195770 18.998 > 3 12 F 0.11158538515530 0.18567672976544 0.35532321804230 18.998 > 4 13 F 0.22845584328212 0.45942957294538 0.76869718694353 18.998 > 5 14 F 0.27154415671788 0.95942957294538 0.73130281305647 18.998 > 6 15 F 0.27154415671788 0.04057042705462 0.23130281305647 18.998 > 7 16 F 0.22845584328212 0.54057042705462 0.26869718694353 18.998 > 8 *17 Al 0.75000000000000 0.25000000000000 0.00000000000000 26.982 > 9 18 Al 0.75000000000000 0.75000000000000 0.50000000000000 26.982 > 10 19 Al 0.25000000000000 0.75000000000000 0.00000000000000 26.982 > 9 20 Al 0.25000000000000 0.25000000000000 0.50000000000000 26.982 > 10 *21 Tl 0.00000000000000 0.73815103618148 0.25000000000000 204.383 > 11 22 Tl 0.00000000000000 0.26184896381852 0.75000000000000 204.383 > 12 23 Tl 0.50000000000000 0.23815103618148 0.25000000000000 204.383 > 11 24 Tl 0.50000000000000 0.76184896381852 0.75000000000000 204.383 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 13.561909087185734 0.000000000000000 0.000000000000000 b 0.000000000000000 15.193554870000000 0.000000000000000 c -3.713772753031974 0.000000000000000 9.484517979243440 Atomic positions (fractional): *1 F 0.61158538515530 0.10477442341152 0.42766160902115 18.998 > 1 2 F 0.61158538515530 0.43810775674485 0.42766160902115 18.998 > 1 3 F 0.61158538515530 0.77144109007819 0.42766160902115 18.998 > 1 4 F 0.61158538515530 0.10477442341152 0.92766160902115 18.998 > 1 5 F 0.61158538515530 0.43810775674485 0.92766160902115 18.998 > 1 6 F 0.61158538515530 0.77144109007819 0.92766160902115 18.998 > 1 7 F 0.88841461484470 0.27144109007819 0.32233839097885 18.998 > 2 8 F 0.88841461484470 0.60477442341152 0.32233839097885 18.998 > 2 9 F 0.88841461484470 0.93810775674485 0.32233839097885 18.998 > 2 10 F 0.88841461484470 0.27144109007819 0.82233839097885 18.998 > 2 11 F 0.88841461484470 0.60477442341152 0.82233839097885 18.998 > 2 12 F 0.88841461484470 0.93810775674485 0.82233839097885 18.998 > 2 13 F 0.88841461484470 0.06189224325515 0.07233839097885 18.998 > 3 14 F 0.88841461484470 0.39522557658848 0.07233839097885 18.998 > 3 15 F 0.88841461484470 0.72855890992181 0.07233839097885 18.998 > 3 16 F 0.88841461484470 0.06189224325515 0.57233839097885 18.998 > 3 17 F 0.88841461484470 0.39522557658848 0.57233839097885 18.998 > 3 18 F 0.88841461484470 0.72855890992181 0.57233839097885 18.998 > 3 19 F 0.61158538515530 0.22855890992181 0.17766160902115 18.998 > 4 20 F 0.61158538515530 0.56189224325515 0.17766160902115 18.998 > 4 21 F 0.61158538515530 0.89522557658848 0.17766160902115 18.998 > 4 22 F 0.61158538515530 0.22855890992181 0.67766160902115 18.998 > 4 23 F 0.61158538515530 0.56189224325515 0.67766160902115 18.998 > 4 24 F 0.61158538515530 0.89522557658848 0.67766160902115 18.998 > 4 *25 F 0.72845584328212 0.31980985764846 0.38434859347177 18.998 > 5 26 F 0.72845584328212 0.65314319098179 0.38434859347177 18.998 > 5 27 F 0.72845584328212 0.98647652431513 0.38434859347177 18.998 > 5 28 F 0.72845584328212 0.31980985764846 0.88434859347177 18.998 > 5 29 F 0.72845584328212 0.65314319098179 0.88434859347177 18.998 > 5 30 F 0.72845584328212 0.98647652431513 0.88434859347177 18.998 > 5 31 F 0.77154415671788 0.15314319098179 0.36565140652823 18.998 > 6 32 F 0.77154415671788 0.48647652431513 0.36565140652823 18.998 > 6 33 F 0.77154415671788 0.81980985764846 0.36565140652823 18.998 > 6 34 F 0.77154415671788 0.15314319098179 0.86565140652823 18.998 > 6 35 F 0.77154415671788 0.48647652431513 0.86565140652823 18.998 > 6 36 F 0.77154415671788 0.81980985764846 0.86565140652823 18.998 > 6 37 F 0.77154415671788 0.18019014235154 0.11565140652823 18.998 > 7 38 F 0.77154415671788 0.51352347568487 0.11565140652823 18.998 > 7 39 F 0.77154415671788 0.84685680901821 0.11565140652823 18.998 > 7 40 F 0.77154415671788 0.18019014235154 0.61565140652823 18.998 > 7 41 F 0.77154415671788 0.51352347568487 0.61565140652823 18.998 > 7 42 F 0.77154415671788 0.84685680901821 0.61565140652823 18.998 > 7 43 F 0.72845584328212 0.01352347568487 0.13434859347177 18.998 > 8 44 F 0.72845584328212 0.34685680901821 0.13434859347177 18.998 > 8 45 F 0.72845584328212 0.68019014235154 0.13434859347177 18.998 > 8 46 F 0.72845584328212 0.01352347568487 0.63434859347177 18.998 > 8 47 F 0.72845584328212 0.34685680901821 0.63434859347177 18.998 > 8 48 F 0.72845584328212 0.68019014235154 0.63434859347177 18.998 > 8 49 F 0.11158538515530 0.27144109007819 0.42766160902115 18.998 > 1 50 F 0.11158538515530 0.60477442341152 0.42766160902115 18.998 > 1 51 F 0.11158538515530 0.93810775674485 0.42766160902115 18.998 > 1 52 F 0.11158538515530 0.27144109007819 0.92766160902115 18.998 > 1 53 F 0.11158538515530 0.60477442341152 0.92766160902115 18.998 > 1 54 F 0.11158538515530 0.93810775674485 0.92766160902115 18.998 > 1 55 F 0.38841461484470 0.10477442341152 0.32233839097885 18.998 > 2 56 F 0.38841461484470 0.43810775674485 0.32233839097885 18.998 > 2 57 F 0.38841461484470 0.77144109007819 0.32233839097885 18.998 > 2 58 F 0.38841461484470 0.10477442341152 0.82233839097885 18.998 > 2 59 F 0.38841461484470 0.43810775674485 0.82233839097885 18.998 > 2 60 F 0.38841461484470 0.77144109007819 0.82233839097885 18.998 > 2 61 F 0.38841461484470 0.22855890992181 0.07233839097885 18.998 > 3 62 F 0.38841461484470 0.56189224325515 0.07233839097885 18.998 > 3 63 F 0.38841461484470 0.89522557658848 0.07233839097885 18.998 > 3 64 F 0.38841461484470 0.22855890992181 0.57233839097885 18.998 > 3 65 F 0.38841461484470 0.56189224325515 0.57233839097885 18.998 > 3 66 F 0.38841461484470 0.89522557658848 0.57233839097885 18.998 > 3 67 F 0.11158538515530 0.06189224325515 0.17766160902115 18.998 > 4 68 F 0.11158538515530 0.39522557658848 0.17766160902115 18.998 > 4 69 F 0.11158538515530 0.72855890992181 0.17766160902115 18.998 > 4 70 F 0.11158538515530 0.06189224325515 0.67766160902115 18.998 > 4 71 F 0.11158538515530 0.39522557658848 0.67766160902115 18.998 > 4 72 F 0.11158538515530 0.72855890992181 0.67766160902115 18.998 > 4 73 F 0.22845584328212 0.15314319098179 0.38434859347177 18.998 > 5 74 F 0.22845584328212 0.48647652431513 0.38434859347177 18.998 > 5 75 F 0.22845584328212 0.81980985764846 0.38434859347177 18.998 > 5 76 F 0.22845584328212 0.15314319098179 0.88434859347177 18.998 > 5 77 F 0.22845584328212 0.48647652431513 0.88434859347177 18.998 > 5 78 F 0.22845584328212 0.81980985764846 0.88434859347177 18.998 > 5 79 F 0.27154415671788 0.31980985764846 0.36565140652823 18.998 > 6 80 F 0.27154415671788 0.65314319098179 0.36565140652823 18.998 > 6 81 F 0.27154415671788 0.98647652431513 0.36565140652823 18.998 > 6 82 F 0.27154415671788 0.31980985764846 0.86565140652823 18.998 > 6 83 F 0.27154415671788 0.65314319098179 0.86565140652823 18.998 > 6 84 F 0.27154415671788 0.98647652431513 0.86565140652823 18.998 > 6 85 F 0.27154415671788 0.01352347568487 0.11565140652823 18.998 > 7 86 F 0.27154415671788 0.34685680901821 0.11565140652823 18.998 > 7 87 F 0.27154415671788 0.68019014235154 0.11565140652823 18.998 > 7 88 F 0.27154415671788 0.01352347568487 0.61565140652823 18.998 > 7 89 F 0.27154415671788 0.34685680901821 0.61565140652823 18.998 > 7 90 F 0.27154415671788 0.68019014235154 0.61565140652823 18.998 > 7 91 F 0.22845584328212 0.18019014235154 0.13434859347177 18.998 > 8 92 F 0.22845584328212 0.51352347568487 0.13434859347177 18.998 > 8 93 F 0.22845584328212 0.84685680901821 0.13434859347177 18.998 > 8 94 F 0.22845584328212 0.18019014235154 0.63434859347177 18.998 > 8 95 F 0.22845584328212 0.51352347568487 0.63434859347177 18.998 > 8 96 F 0.22845584328212 0.84685680901821 0.63434859347177 18.998 > 8 *97 Al 0.75000000000000 0.08333333333333 0.00000000000000 26.982 > 9 98 Al 0.75000000000000 0.41666666666667 0.00000000000000 26.982 > 9 99 Al 0.75000000000000 0.75000000000000 0.00000000000000 26.982 > 9 100 Al 0.75000000000000 0.08333333333333 0.50000000000000 26.982 > 9 101 Al 0.75000000000000 0.41666666666667 0.50000000000000 26.982 > 9 102 Al 0.75000000000000 0.75000000000000 0.50000000000000 26.982 > 9 103 Al 0.75000000000000 0.25000000000000 0.25000000000000 26.982 > 10 104 Al 0.75000000000000 0.58333333333333 0.25000000000000 26.982 > 10 105 Al 0.75000000000000 0.91666666666667 0.25000000000000 26.982 > 10 106 Al 0.75000000000000 0.25000000000000 0.75000000000000 26.982 > 10 107 Al 0.75000000000000 0.58333333333333 0.75000000000000 26.982 > 10 108 Al 0.75000000000000 0.91666666666667 0.75000000000000 26.982 > 10 109 Al 0.25000000000000 0.25000000000000 0.00000000000000 26.982 > 9 110 Al 0.25000000000000 0.58333333333333 0.00000000000000 26.982 > 9 111 Al 0.25000000000000 0.91666666666667 0.00000000000000 26.982 > 9 112 Al 0.25000000000000 0.25000000000000 0.50000000000000 26.982 > 9 113 Al 0.25000000000000 0.58333333333333 0.50000000000000 26.982 > 9 114 Al 0.25000000000000 0.91666666666667 0.50000000000000 26.982 > 9 115 Al 0.25000000000000 0.08333333333333 0.25000000000000 26.982 > 10 116 Al 0.25000000000000 0.41666666666667 0.25000000000000 26.982 > 10 117 Al 0.25000000000000 0.75000000000000 0.25000000000000 26.982 > 10 118 Al 0.25000000000000 0.08333333333333 0.75000000000000 26.982 > 10 119 Al 0.25000000000000 0.41666666666667 0.75000000000000 26.982 > 10 120 Al 0.25000000000000 0.75000000000000 0.75000000000000 26.982 > 10 *121 Tl 0.00000000000000 0.24605034539383 0.12500000000000 204.383 > 11 122 Tl 0.00000000000000 0.57938367872716 0.12500000000000 204.383 > 11 123 Tl 0.00000000000000 0.91271701206049 0.12500000000000 204.383 > 11 124 Tl 0.00000000000000 0.24605034539383 0.62500000000000 204.383 > 11 125 Tl 0.00000000000000 0.57938367872716 0.62500000000000 204.383 > 11 126 Tl 0.00000000000000 0.91271701206049 0.62500000000000 204.383 > 11 127 Tl 0.00000000000000 0.08728298793951 0.37500000000000 204.383 > 12 128 Tl 0.00000000000000 0.42061632127284 0.37500000000000 204.383 > 12 129 Tl 0.00000000000000 0.75394965460617 0.37500000000000 204.383 > 12 130 Tl 0.00000000000000 0.08728298793951 0.87500000000000 204.383 > 12 131 Tl 0.00000000000000 0.42061632127284 0.87500000000000 204.383 > 12 132 Tl 0.00000000000000 0.75394965460617 0.87500000000000 204.383 > 12 133 Tl 0.50000000000000 0.07938367872716 0.12500000000000 204.383 > 11 134 Tl 0.50000000000000 0.41271701206049 0.12500000000000 204.383 > 11 135 Tl 0.50000000000000 0.74605034539383 0.12500000000000 204.383 > 11 136 Tl 0.50000000000000 0.07938367872716 0.62500000000000 204.383 > 11 137 Tl 0.50000000000000 0.41271701206049 0.62500000000000 204.383 > 11 138 Tl 0.50000000000000 0.74605034539383 0.62500000000000 204.383 > 11 139 Tl 0.50000000000000 0.25394965460617 0.37500000000000 204.383 > 12 140 Tl 0.50000000000000 0.58728298793951 0.37500000000000 204.383 > 12 141 Tl 0.50000000000000 0.92061632127284 0.37500000000000 204.383 > 12 142 Tl 0.50000000000000 0.25394965460617 0.87500000000000 204.383 > 12 143 Tl 0.50000000000000 0.58728298793951 0.87500000000000 204.383 > 12 144 Tl 0.50000000000000 0.92061632127284 0.87500000000000 204.383 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.7074198 0.0000000 -0.1362204 0.0000000 3.0465611 0.0000000 -0.1362201 0.0000000 2.9840878 -------------------------- Born effective charges -------------------------- 1 F -1.3905333 0.1633328 -0.1031758 0.1924101 -1.2970760 0.0846734 -0.1006940 0.0529266 -1.2336040 2 F -1.3905333 -0.1633328 -0.1031758 -0.1924101 -1.2970760 -0.0846734 -0.1006940 -0.0529266 -1.2336040 3 F -1.3905333 0.1633328 -0.1031758 0.1924101 -1.2970760 0.0846734 -0.1006940 0.0529266 -1.2336040 4 F -1.3905333 -0.1633328 -0.1031758 -0.1924101 -1.2970760 -0.0846734 -0.1006940 -0.0529266 -1.2336040 5 F -1.0590458 0.1262294 0.0849540 0.1295754 -1.1844070 -0.4110909 0.0741456 -0.4094988 -1.1377178 6 F -1.0590458 -0.1262294 0.0849540 -0.1295754 -1.1844070 0.4110909 0.0741456 0.4094988 -1.1377178 7 F -1.0590458 0.1262294 0.0849540 0.1295754 -1.1844070 -0.4110909 0.0741456 -0.4094988 -1.1377178 8 F -1.0590458 -0.1262294 0.0849540 -0.1295754 -1.1844070 0.4110909 0.0741456 0.4094988 -1.1377178 9 Al 3.3606708 0.0563902 0.1546128 -0.0041912 2.9581445 -0.0652250 0.1810176 0.0740030 3.0068440 10 Al 3.3606708 -0.0563902 0.1546128 0.0041912 2.9581445 0.0652250 0.1810176 -0.0740030 3.0068440 11 Tl 1.5384874 0.0000000 -0.1181693 0.0000000 2.0048215 0.0000000 -0.1279208 0.0000000 1.7357994 12 Tl 1.5384874 0.0000000 -0.1181693 0.0000000 2.0048215 0.0000000 -0.1279208 0.0000000 1.7357994 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 432/432 Permutation basis: 9972/9972 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2046 Number of blocks in projector: 2046 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 428 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 428 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 250 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 250 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 250 Use standard eigh solver. Tree of FC basis block matrices: - (2046, 2015), data: False |-- (250, 246), data: True |-- (250, 246), data: True |-- (250, 246), data: True |-- (428, 422), data: True |-- (428, 422), data: True |-- (440, 433), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.006 Solver_block: 100 / 400 - Time: 4.603 Solver_block: 200 / 400 - Time: 4.740 Solver_block: 300 / 400 - Time: 4.728 Solver_block: 400 / 400 - Time: 4.720 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 18.849 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 432/432 Permutation basis: 9972/9972 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2046 Number of blocks in projector: 2046 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 428 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 428 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 250 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 250 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 250 Use standard eigh solver. Tree of FC basis block matrices: - (2046, 2015), data: False |-- (250, 246), data: True |-- (250, 246), data: True |-- (250, 246), data: True |-- (428, 422), data: True |-- (428, 422), data: True |-- (440, 433), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 19:44:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 19:44:30]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 3 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.780954543592867 -2.532259145000000 0.000000000000000 b 6.780954543592867 2.532259145000000 0.000000000000000 c -1.856886376515987 0.000000000000000 4.742258989621720 Atomic positions (fractional): 1 F 0.29726211492073 0.92590865538986 0.85532321804230 18.998 2 F 0.07409134461014 0.70273788507927 0.64467678195770 18.998 3 F 0.70273788507927 0.07409134461014 0.14467678195770 18.998 4 F 0.92590865538986 0.29726211492073 0.35532321804230 18.998 5 F 0.76902627033674 0.68788541622750 0.76869718694353 18.998 6 F 0.31211458377250 0.23097372966326 0.73130281305647 18.998 7 F 0.23097372966326 0.31211458377250 0.23130281305647 18.998 8 F 0.68788541622750 0.76902627033674 0.26869718694353 18.998 9 Al 0.50000000000000 0.00000000000000 0.00000000000000 26.982 10 Al 0.00000000000000 0.50000000000000 0.50000000000000 26.982 11 Tl 0.26184896381852 0.73815103618148 0.25000000000000 204.383 12 Tl 0.73815103618148 0.26184896381852 0.75000000000000 204.383 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.561909087185734 0.000000000000000 0.000000000000000 b 0.000000000000000 15.193554870000000 0.000000000000000 c -3.713772753031974 0.000000000000000 9.484517979243440 Atomic positions (fractional): 1 F 0.61158538515530 0.10477442341152 0.42766160902115 18.998 > 1 2 F 0.61158538515530 0.43810775674485 0.42766160902115 18.998 > 1 3 F 0.61158538515530 0.77144109007819 0.42766160902115 18.998 > 1 4 F 0.61158538515530 0.10477442341152 0.92766160902115 18.998 > 1 5 F 0.61158538515530 0.43810775674485 0.92766160902115 18.998 > 1 6 F 0.61158538515530 0.77144109007819 0.92766160902115 18.998 > 1 7 F 0.88841461484470 0.27144109007819 0.32233839097885 18.998 > 7 8 F 0.88841461484470 0.60477442341152 0.32233839097885 18.998 > 7 9 F 0.88841461484470 0.93810775674485 0.32233839097885 18.998 > 7 10 F 0.88841461484470 0.27144109007819 0.82233839097885 18.998 > 7 11 F 0.88841461484470 0.60477442341152 0.82233839097885 18.998 > 7 12 F 0.88841461484470 0.93810775674485 0.82233839097885 18.998 > 7 13 F 0.88841461484470 0.06189224325515 0.07233839097885 18.998 > 13 14 F 0.88841461484470 0.39522557658848 0.07233839097885 18.998 > 13 15 F 0.88841461484470 0.72855890992181 0.07233839097885 18.998 > 13 16 F 0.88841461484470 0.06189224325515 0.57233839097885 18.998 > 13 17 F 0.88841461484470 0.39522557658848 0.57233839097885 18.998 > 13 18 F 0.88841461484470 0.72855890992181 0.57233839097885 18.998 > 13 19 F 0.61158538515530 0.22855890992181 0.17766160902115 18.998 > 19 20 F 0.61158538515530 0.56189224325515 0.17766160902115 18.998 > 19 21 F 0.61158538515530 0.89522557658848 0.17766160902115 18.998 > 19 22 F 0.61158538515530 0.22855890992181 0.67766160902115 18.998 > 19 23 F 0.61158538515530 0.56189224325515 0.67766160902115 18.998 > 19 24 F 0.61158538515530 0.89522557658848 0.67766160902115 18.998 > 19 25 F 0.72845584328212 0.31980985764846 0.38434859347177 18.998 > 25 26 F 0.72845584328212 0.65314319098179 0.38434859347177 18.998 > 25 27 F 0.72845584328212 0.98647652431513 0.38434859347177 18.998 > 25 28 F 0.72845584328212 0.31980985764846 0.88434859347177 18.998 > 25 29 F 0.72845584328212 0.65314319098179 0.88434859347177 18.998 > 25 30 F 0.72845584328212 0.98647652431513 0.88434859347177 18.998 > 25 31 F 0.77154415671788 0.15314319098179 0.36565140652823 18.998 > 31 32 F 0.77154415671788 0.48647652431513 0.36565140652823 18.998 > 31 33 F 0.77154415671788 0.81980985764846 0.36565140652823 18.998 > 31 34 F 0.77154415671788 0.15314319098179 0.86565140652823 18.998 > 31 35 F 0.77154415671788 0.48647652431513 0.86565140652823 18.998 > 31 36 F 0.77154415671788 0.81980985764846 0.86565140652823 18.998 > 31 37 F 0.77154415671788 0.18019014235154 0.11565140652823 18.998 > 37 38 F 0.77154415671788 0.51352347568487 0.11565140652823 18.998 > 37 39 F 0.77154415671788 0.84685680901821 0.11565140652823 18.998 > 37 40 F 0.77154415671788 0.18019014235154 0.61565140652823 18.998 > 37 41 F 0.77154415671788 0.51352347568487 0.61565140652823 18.998 > 37 42 F 0.77154415671788 0.84685680901821 0.61565140652823 18.998 > 37 43 F 0.72845584328212 0.01352347568487 0.13434859347177 18.998 > 43 44 F 0.72845584328212 0.34685680901821 0.13434859347177 18.998 > 43 45 F 0.72845584328212 0.68019014235154 0.13434859347177 18.998 > 43 46 F 0.72845584328212 0.01352347568487 0.63434859347177 18.998 > 43 47 F 0.72845584328212 0.34685680901821 0.63434859347177 18.998 > 43 48 F 0.72845584328212 0.68019014235154 0.63434859347177 18.998 > 43 49 F 0.11158538515530 0.27144109007819 0.42766160902115 18.998 > 1 50 F 0.11158538515530 0.60477442341152 0.42766160902115 18.998 > 1 51 F 0.11158538515530 0.93810775674485 0.42766160902115 18.998 > 1 52 F 0.11158538515530 0.27144109007819 0.92766160902115 18.998 > 1 53 F 0.11158538515530 0.60477442341152 0.92766160902115 18.998 > 1 54 F 0.11158538515530 0.93810775674485 0.92766160902115 18.998 > 1 55 F 0.38841461484470 0.10477442341152 0.32233839097885 18.998 > 7 56 F 0.38841461484470 0.43810775674485 0.32233839097885 18.998 > 7 57 F 0.38841461484470 0.77144109007819 0.32233839097885 18.998 > 7 58 F 0.38841461484470 0.10477442341152 0.82233839097885 18.998 > 7 59 F 0.38841461484470 0.43810775674485 0.82233839097885 18.998 > 7 60 F 0.38841461484470 0.77144109007819 0.82233839097885 18.998 > 7 61 F 0.38841461484470 0.22855890992181 0.07233839097885 18.998 > 13 62 F 0.38841461484470 0.56189224325515 0.07233839097885 18.998 > 13 63 F 0.38841461484470 0.89522557658848 0.07233839097885 18.998 > 13 64 F 0.38841461484470 0.22855890992181 0.57233839097885 18.998 > 13 65 F 0.38841461484470 0.56189224325515 0.57233839097885 18.998 > 13 66 F 0.38841461484470 0.89522557658848 0.57233839097885 18.998 > 13 67 F 0.11158538515530 0.06189224325515 0.17766160902115 18.998 > 19 68 F 0.11158538515530 0.39522557658848 0.17766160902115 18.998 > 19 69 F 0.11158538515530 0.72855890992181 0.17766160902115 18.998 > 19 70 F 0.11158538515530 0.06189224325515 0.67766160902115 18.998 > 19 71 F 0.11158538515530 0.39522557658848 0.67766160902115 18.998 > 19 72 F 0.11158538515530 0.72855890992181 0.67766160902115 18.998 > 19 73 F 0.22845584328212 0.15314319098179 0.38434859347177 18.998 > 25 74 F 0.22845584328212 0.48647652431513 0.38434859347177 18.998 > 25 75 F 0.22845584328212 0.81980985764846 0.38434859347177 18.998 > 25 76 F 0.22845584328212 0.15314319098179 0.88434859347177 18.998 > 25 77 F 0.22845584328212 0.48647652431513 0.88434859347177 18.998 > 25 78 F 0.22845584328212 0.81980985764846 0.88434859347177 18.998 > 25 79 F 0.27154415671788 0.31980985764846 0.36565140652823 18.998 > 31 80 F 0.27154415671788 0.65314319098179 0.36565140652823 18.998 > 31 81 F 0.27154415671788 0.98647652431513 0.36565140652823 18.998 > 31 82 F 0.27154415671788 0.31980985764846 0.86565140652823 18.998 > 31 83 F 0.27154415671788 0.65314319098179 0.86565140652823 18.998 > 31 84 F 0.27154415671788 0.98647652431513 0.86565140652823 18.998 > 31 85 F 0.27154415671788 0.01352347568487 0.11565140652823 18.998 > 37 86 F 0.27154415671788 0.34685680901821 0.11565140652823 18.998 > 37 87 F 0.27154415671788 0.68019014235154 0.11565140652823 18.998 > 37 88 F 0.27154415671788 0.01352347568487 0.61565140652823 18.998 > 37 89 F 0.27154415671788 0.34685680901821 0.61565140652823 18.998 > 37 90 F 0.27154415671788 0.68019014235154 0.61565140652823 18.998 > 37 91 F 0.22845584328212 0.18019014235154 0.13434859347177 18.998 > 43 92 F 0.22845584328212 0.51352347568487 0.13434859347177 18.998 > 43 93 F 0.22845584328212 0.84685680901821 0.13434859347177 18.998 > 43 94 F 0.22845584328212 0.18019014235154 0.63434859347177 18.998 > 43 95 F 0.22845584328212 0.51352347568487 0.63434859347177 18.998 > 43 96 F 0.22845584328212 0.84685680901821 0.63434859347177 18.998 > 43 97 Al 0.75000000000000 0.08333333333333 0.00000000000000 26.982 > 97 98 Al 0.75000000000000 0.41666666666667 0.00000000000000 26.982 > 97 99 Al 0.75000000000000 0.75000000000000 0.00000000000000 26.982 > 97 100 Al 0.75000000000000 0.08333333333333 0.50000000000000 26.982 > 97 101 Al 0.75000000000000 0.41666666666667 0.50000000000000 26.982 > 97 102 Al 0.75000000000000 0.75000000000000 0.50000000000000 26.982 > 97 103 Al 0.75000000000000 0.25000000000000 0.25000000000000 26.982 > 103 104 Al 0.75000000000000 0.58333333333333 0.25000000000000 26.982 > 103 105 Al 0.75000000000000 0.91666666666667 0.25000000000000 26.982 > 103 106 Al 0.75000000000000 0.25000000000000 0.75000000000000 26.982 > 103 107 Al 0.75000000000000 0.58333333333333 0.75000000000000 26.982 > 103 108 Al 0.75000000000000 0.91666666666667 0.75000000000000 26.982 > 103 109 Al 0.25000000000000 0.25000000000000 0.00000000000000 26.982 > 97 110 Al 0.25000000000000 0.58333333333333 0.00000000000000 26.982 > 97 111 Al 0.25000000000000 0.91666666666667 0.00000000000000 26.982 > 97 112 Al 0.25000000000000 0.25000000000000 0.50000000000000 26.982 > 97 113 Al 0.25000000000000 0.58333333333333 0.50000000000000 26.982 > 97 114 Al 0.25000000000000 0.91666666666667 0.50000000000000 26.982 > 97 115 Al 0.25000000000000 0.08333333333333 0.25000000000000 26.982 > 103 116 Al 0.25000000000000 0.41666666666667 0.25000000000000 26.982 > 103 117 Al 0.25000000000000 0.75000000000000 0.25000000000000 26.982 > 103 118 Al 0.25000000000000 0.08333333333333 0.75000000000000 26.982 > 103 119 Al 0.25000000000000 0.41666666666667 0.75000000000000 26.982 > 103 120 Al 0.25000000000000 0.75000000000000 0.75000000000000 26.982 > 103 121 Tl 0.00000000000000 0.24605034539383 0.12500000000000 204.383 > 121 122 Tl 0.00000000000000 0.57938367872716 0.12500000000000 204.383 > 121 123 Tl 0.00000000000000 0.91271701206049 0.12500000000000 204.383 > 121 124 Tl 0.00000000000000 0.24605034539383 0.62500000000000 204.383 > 121 125 Tl 0.00000000000000 0.57938367872716 0.62500000000000 204.383 > 121 126 Tl 0.00000000000000 0.91271701206049 0.62500000000000 204.383 > 121 127 Tl 0.00000000000000 0.08728298793951 0.37500000000000 204.383 > 127 128 Tl 0.00000000000000 0.42061632127284 0.37500000000000 204.383 > 127 129 Tl 0.00000000000000 0.75394965460617 0.37500000000000 204.383 > 127 130 Tl 0.00000000000000 0.08728298793951 0.87500000000000 204.383 > 127 131 Tl 0.00000000000000 0.42061632127284 0.87500000000000 204.383 > 127 132 Tl 0.00000000000000 0.75394965460617 0.87500000000000 204.383 > 127 133 Tl 0.50000000000000 0.07938367872716 0.12500000000000 204.383 > 121 134 Tl 0.50000000000000 0.41271701206049 0.12500000000000 204.383 > 121 135 Tl 0.50000000000000 0.74605034539383 0.12500000000000 204.383 > 121 136 Tl 0.50000000000000 0.07938367872716 0.62500000000000 204.383 > 121 137 Tl 0.50000000000000 0.41271701206049 0.62500000000000 204.383 > 121 138 Tl 0.50000000000000 0.74605034539383 0.62500000000000 204.383 > 121 139 Tl 0.50000000000000 0.25394965460617 0.37500000000000 204.383 > 127 140 Tl 0.50000000000000 0.58728298793951 0.37500000000000 204.383 > 127 141 Tl 0.50000000000000 0.92061632127284 0.37500000000000 204.383 > 127 142 Tl 0.50000000000000 0.25394965460617 0.87500000000000 204.383 > 127 143 Tl 0.50000000000000 0.58728298793951 0.87500000000000 204.383 > 127 144 Tl 0.50000000000000 0.92061632127284 0.87500000000000 204.383 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.7074198 0.0000000 -0.1362204 0.0000000 3.0465611 0.0000000 -0.1362201 0.0000000 2.9840878 -------------------------- Born effective charges -------------------------- 1 F -1.3905333 0.1633328 -0.1031758 0.1924101 -1.2970760 0.0846734 -0.1006940 0.0529266 -1.2336040 2 F -1.3905333 -0.1633328 -0.1031758 -0.1924101 -1.2970760 -0.0846734 -0.1006940 -0.0529266 -1.2336040 3 F -1.3905333 0.1633328 -0.1031758 0.1924101 -1.2970760 0.0846734 -0.1006940 0.0529266 -1.2336040 4 F -1.3905333 -0.1633328 -0.1031758 -0.1924101 -1.2970760 -0.0846734 -0.1006940 -0.0529266 -1.2336040 5 F -1.0590458 0.1262294 0.0849540 0.1295754 -1.1844070 -0.4110909 0.0741456 -0.4094988 -1.1377178 6 F -1.0590458 -0.1262294 0.0849540 -0.1295754 -1.1844070 0.4110909 0.0741456 0.4094988 -1.1377178 7 F -1.0590458 0.1262294 0.0849540 0.1295754 -1.1844070 -0.4110909 0.0741456 -0.4094988 -1.1377178 8 F -1.0590458 -0.1262294 0.0849540 -0.1295754 -1.1844070 0.4110909 0.0741456 0.4094988 -1.1377178 9 Al 3.3606708 0.0563902 0.1546128 -0.0041912 2.9581445 -0.0652250 0.1810176 0.0740030 3.0068440 10 Al 3.3606708 -0.0563902 0.1546128 0.0041912 2.9581445 0.0652250 0.1810176 -0.0740030 3.0068440 11 Tl 1.5384874 0.0000000 -0.1181693 0.0000000 2.0048215 0.0000000 -0.1279208 0.0000000 1.7357994 12 Tl 1.5384874 0.0000000 -0.1181693 0.0000000 2.0048215 0.0000000 -0.1279208 0.0000000 1.7357994 ---------------------------------------------------------------------------- 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] [-0.0036 0.0000 0.0093] [ 0.0036 0.0000 -0.0093] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0036 0.0000 0.0093] [ 0.0036 0.0000 -0.0093] Computing fc3[ 97, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0036 0.0000 0.0093] [ 0.0036 0.0000 -0.0093] Computing fc3[ 121, 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] [-0.0036 0.0000 0.0093] [ 0.0036 0.0000 -0.0093] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (zx) 0.00000000 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 19:44:55]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 19:44:56]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 3 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.780954543592867 -2.532259145000000 0.000000000000000 b 6.780954543592867 2.532259145000000 0.000000000000000 c -1.856886376515987 0.000000000000000 4.742258989621720 Atomic positions (fractional): 1 F 0.29726211492073 0.92590865538986 0.85532321804230 18.998 2 F 0.07409134461014 0.70273788507927 0.64467678195770 18.998 3 F 0.70273788507927 0.07409134461014 0.14467678195770 18.998 4 F 0.92590865538986 0.29726211492073 0.35532321804230 18.998 5 F 0.76902627033674 0.68788541622750 0.76869718694353 18.998 6 F 0.31211458377250 0.23097372966326 0.73130281305647 18.998 7 F 0.23097372966326 0.31211458377250 0.23130281305647 18.998 8 F 0.68788541622750 0.76902627033674 0.26869718694353 18.998 9 Al 0.50000000000000 0.00000000000000 0.00000000000000 26.982 10 Al 0.00000000000000 0.50000000000000 0.50000000000000 26.982 11 Tl 0.26184896381852 0.73815103618148 0.25000000000000 204.383 12 Tl 0.73815103618148 0.26184896381852 0.75000000000000 204.383 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.561909087185734 0.000000000000000 0.000000000000000 b 0.000000000000000 15.193554870000000 0.000000000000000 c -3.713772753031974 0.000000000000000 9.484517979243440 Atomic positions (fractional): 1 F 0.61158538515530 0.10477442341152 0.42766160902115 18.998 > 1 2 F 0.61158538515530 0.43810775674485 0.42766160902115 18.998 > 1 3 F 0.61158538515530 0.77144109007819 0.42766160902115 18.998 > 1 4 F 0.61158538515530 0.10477442341152 0.92766160902115 18.998 > 1 5 F 0.61158538515530 0.43810775674485 0.92766160902115 18.998 > 1 6 F 0.61158538515530 0.77144109007819 0.92766160902115 18.998 > 1 7 F 0.88841461484470 0.27144109007819 0.32233839097885 18.998 > 7 8 F 0.88841461484470 0.60477442341152 0.32233839097885 18.998 > 7 9 F 0.88841461484470 0.93810775674485 0.32233839097885 18.998 > 7 10 F 0.88841461484470 0.27144109007819 0.82233839097885 18.998 > 7 11 F 0.88841461484470 0.60477442341152 0.82233839097885 18.998 > 7 12 F 0.88841461484470 0.93810775674485 0.82233839097885 18.998 > 7 13 F 0.88841461484470 0.06189224325515 0.07233839097885 18.998 > 13 14 F 0.88841461484470 0.39522557658848 0.07233839097885 18.998 > 13 15 F 0.88841461484470 0.72855890992181 0.07233839097885 18.998 > 13 16 F 0.88841461484470 0.06189224325515 0.57233839097885 18.998 > 13 17 F 0.88841461484470 0.39522557658848 0.57233839097885 18.998 > 13 18 F 0.88841461484470 0.72855890992181 0.57233839097885 18.998 > 13 19 F 0.61158538515530 0.22855890992181 0.17766160902115 18.998 > 19 20 F 0.61158538515530 0.56189224325515 0.17766160902115 18.998 > 19 21 F 0.61158538515530 0.89522557658848 0.17766160902115 18.998 > 19 22 F 0.61158538515530 0.22855890992181 0.67766160902115 18.998 > 19 23 F 0.61158538515530 0.56189224325515 0.67766160902115 18.998 > 19 24 F 0.61158538515530 0.89522557658848 0.67766160902115 18.998 > 19 25 F 0.72845584328212 0.31980985764846 0.38434859347177 18.998 > 25 26 F 0.72845584328212 0.65314319098179 0.38434859347177 18.998 > 25 27 F 0.72845584328212 0.98647652431513 0.38434859347177 18.998 > 25 28 F 0.72845584328212 0.31980985764846 0.88434859347177 18.998 > 25 29 F 0.72845584328212 0.65314319098179 0.88434859347177 18.998 > 25 30 F 0.72845584328212 0.98647652431513 0.88434859347177 18.998 > 25 31 F 0.77154415671788 0.15314319098179 0.36565140652823 18.998 > 31 32 F 0.77154415671788 0.48647652431513 0.36565140652823 18.998 > 31 33 F 0.77154415671788 0.81980985764846 0.36565140652823 18.998 > 31 34 F 0.77154415671788 0.15314319098179 0.86565140652823 18.998 > 31 35 F 0.77154415671788 0.48647652431513 0.86565140652823 18.998 > 31 36 F 0.77154415671788 0.81980985764846 0.86565140652823 18.998 > 31 37 F 0.77154415671788 0.18019014235154 0.11565140652823 18.998 > 37 38 F 0.77154415671788 0.51352347568487 0.11565140652823 18.998 > 37 39 F 0.77154415671788 0.84685680901821 0.11565140652823 18.998 > 37 40 F 0.77154415671788 0.18019014235154 0.61565140652823 18.998 > 37 41 F 0.77154415671788 0.51352347568487 0.61565140652823 18.998 > 37 42 F 0.77154415671788 0.84685680901821 0.61565140652823 18.998 > 37 43 F 0.72845584328212 0.01352347568487 0.13434859347177 18.998 > 43 44 F 0.72845584328212 0.34685680901821 0.13434859347177 18.998 > 43 45 F 0.72845584328212 0.68019014235154 0.13434859347177 18.998 > 43 46 F 0.72845584328212 0.01352347568487 0.63434859347177 18.998 > 43 47 F 0.72845584328212 0.34685680901821 0.63434859347177 18.998 > 43 48 F 0.72845584328212 0.68019014235154 0.63434859347177 18.998 > 43 49 F 0.11158538515530 0.27144109007819 0.42766160902115 18.998 > 1 50 F 0.11158538515530 0.60477442341152 0.42766160902115 18.998 > 1 51 F 0.11158538515530 0.93810775674485 0.42766160902115 18.998 > 1 52 F 0.11158538515530 0.27144109007819 0.92766160902115 18.998 > 1 53 F 0.11158538515530 0.60477442341152 0.92766160902115 18.998 > 1 54 F 0.11158538515530 0.93810775674485 0.92766160902115 18.998 > 1 55 F 0.38841461484470 0.10477442341152 0.32233839097885 18.998 > 7 56 F 0.38841461484470 0.43810775674485 0.32233839097885 18.998 > 7 57 F 0.38841461484470 0.77144109007819 0.32233839097885 18.998 > 7 58 F 0.38841461484470 0.10477442341152 0.82233839097885 18.998 > 7 59 F 0.38841461484470 0.43810775674485 0.82233839097885 18.998 > 7 60 F 0.38841461484470 0.77144109007819 0.82233839097885 18.998 > 7 61 F 0.38841461484470 0.22855890992181 0.07233839097885 18.998 > 13 62 F 0.38841461484470 0.56189224325515 0.07233839097885 18.998 > 13 63 F 0.38841461484470 0.89522557658848 0.07233839097885 18.998 > 13 64 F 0.38841461484470 0.22855890992181 0.57233839097885 18.998 > 13 65 F 0.38841461484470 0.56189224325515 0.57233839097885 18.998 > 13 66 F 0.38841461484470 0.89522557658848 0.57233839097885 18.998 > 13 67 F 0.11158538515530 0.06189224325515 0.17766160902115 18.998 > 19 68 F 0.11158538515530 0.39522557658848 0.17766160902115 18.998 > 19 69 F 0.11158538515530 0.72855890992181 0.17766160902115 18.998 > 19 70 F 0.11158538515530 0.06189224325515 0.67766160902115 18.998 > 19 71 F 0.11158538515530 0.39522557658848 0.67766160902115 18.998 > 19 72 F 0.11158538515530 0.72855890992181 0.67766160902115 18.998 > 19 73 F 0.22845584328212 0.15314319098179 0.38434859347177 18.998 > 25 74 F 0.22845584328212 0.48647652431513 0.38434859347177 18.998 > 25 75 F 0.22845584328212 0.81980985764846 0.38434859347177 18.998 > 25 76 F 0.22845584328212 0.15314319098179 0.88434859347177 18.998 > 25 77 F 0.22845584328212 0.48647652431513 0.88434859347177 18.998 > 25 78 F 0.22845584328212 0.81980985764846 0.88434859347177 18.998 > 25 79 F 0.27154415671788 0.31980985764846 0.36565140652823 18.998 > 31 80 F 0.27154415671788 0.65314319098179 0.36565140652823 18.998 > 31 81 F 0.27154415671788 0.98647652431513 0.36565140652823 18.998 > 31 82 F 0.27154415671788 0.31980985764846 0.86565140652823 18.998 > 31 83 F 0.27154415671788 0.65314319098179 0.86565140652823 18.998 > 31 84 F 0.27154415671788 0.98647652431513 0.86565140652823 18.998 > 31 85 F 0.27154415671788 0.01352347568487 0.11565140652823 18.998 > 37 86 F 0.27154415671788 0.34685680901821 0.11565140652823 18.998 > 37 87 F 0.27154415671788 0.68019014235154 0.11565140652823 18.998 > 37 88 F 0.27154415671788 0.01352347568487 0.61565140652823 18.998 > 37 89 F 0.27154415671788 0.34685680901821 0.61565140652823 18.998 > 37 90 F 0.27154415671788 0.68019014235154 0.61565140652823 18.998 > 37 91 F 0.22845584328212 0.18019014235154 0.13434859347177 18.998 > 43 92 F 0.22845584328212 0.51352347568487 0.13434859347177 18.998 > 43 93 F 0.22845584328212 0.84685680901821 0.13434859347177 18.998 > 43 94 F 0.22845584328212 0.18019014235154 0.63434859347177 18.998 > 43 95 F 0.22845584328212 0.51352347568487 0.63434859347177 18.998 > 43 96 F 0.22845584328212 0.84685680901821 0.63434859347177 18.998 > 43 97 Al 0.75000000000000 0.08333333333333 0.00000000000000 26.982 > 97 98 Al 0.75000000000000 0.41666666666667 0.00000000000000 26.982 > 97 99 Al 0.75000000000000 0.75000000000000 0.00000000000000 26.982 > 97 100 Al 0.75000000000000 0.08333333333333 0.50000000000000 26.982 > 97 101 Al 0.75000000000000 0.41666666666667 0.50000000000000 26.982 > 97 102 Al 0.75000000000000 0.75000000000000 0.50000000000000 26.982 > 97 103 Al 0.75000000000000 0.25000000000000 0.25000000000000 26.982 > 103 104 Al 0.75000000000000 0.58333333333333 0.25000000000000 26.982 > 103 105 Al 0.75000000000000 0.91666666666667 0.25000000000000 26.982 > 103 106 Al 0.75000000000000 0.25000000000000 0.75000000000000 26.982 > 103 107 Al 0.75000000000000 0.58333333333333 0.75000000000000 26.982 > 103 108 Al 0.75000000000000 0.91666666666667 0.75000000000000 26.982 > 103 109 Al 0.25000000000000 0.25000000000000 0.00000000000000 26.982 > 97 110 Al 0.25000000000000 0.58333333333333 0.00000000000000 26.982 > 97 111 Al 0.25000000000000 0.91666666666667 0.00000000000000 26.982 > 97 112 Al 0.25000000000000 0.25000000000000 0.50000000000000 26.982 > 97 113 Al 0.25000000000000 0.58333333333333 0.50000000000000 26.982 > 97 114 Al 0.25000000000000 0.91666666666667 0.50000000000000 26.982 > 97 115 Al 0.25000000000000 0.08333333333333 0.25000000000000 26.982 > 103 116 Al 0.25000000000000 0.41666666666667 0.25000000000000 26.982 > 103 117 Al 0.25000000000000 0.75000000000000 0.25000000000000 26.982 > 103 118 Al 0.25000000000000 0.08333333333333 0.75000000000000 26.982 > 103 119 Al 0.25000000000000 0.41666666666667 0.75000000000000 26.982 > 103 120 Al 0.25000000000000 0.75000000000000 0.75000000000000 26.982 > 103 121 Tl 0.00000000000000 0.24605034539383 0.12500000000000 204.383 > 121 122 Tl 0.00000000000000 0.57938367872716 0.12500000000000 204.383 > 121 123 Tl 0.00000000000000 0.91271701206049 0.12500000000000 204.383 > 121 124 Tl 0.00000000000000 0.24605034539383 0.62500000000000 204.383 > 121 125 Tl 0.00000000000000 0.57938367872716 0.62500000000000 204.383 > 121 126 Tl 0.00000000000000 0.91271701206049 0.62500000000000 204.383 > 121 127 Tl 0.00000000000000 0.08728298793951 0.37500000000000 204.383 > 127 128 Tl 0.00000000000000 0.42061632127284 0.37500000000000 204.383 > 127 129 Tl 0.00000000000000 0.75394965460617 0.37500000000000 204.383 > 127 130 Tl 0.00000000000000 0.08728298793951 0.87500000000000 204.383 > 127 131 Tl 0.00000000000000 0.42061632127284 0.87500000000000 204.383 > 127 132 Tl 0.00000000000000 0.75394965460617 0.87500000000000 204.383 > 127 133 Tl 0.50000000000000 0.07938367872716 0.12500000000000 204.383 > 121 134 Tl 0.50000000000000 0.41271701206049 0.12500000000000 204.383 > 121 135 Tl 0.50000000000000 0.74605034539383 0.12500000000000 204.383 > 121 136 Tl 0.50000000000000 0.07938367872716 0.62500000000000 204.383 > 121 137 Tl 0.50000000000000 0.41271701206049 0.62500000000000 204.383 > 121 138 Tl 0.50000000000000 0.74605034539383 0.62500000000000 204.383 > 121 139 Tl 0.50000000000000 0.25394965460617 0.37500000000000 204.383 > 127 140 Tl 0.50000000000000 0.58728298793951 0.37500000000000 204.383 > 127 141 Tl 0.50000000000000 0.92061632127284 0.37500000000000 204.383 > 127 142 Tl 0.50000000000000 0.25394965460617 0.87500000000000 204.383 > 127 143 Tl 0.50000000000000 0.58728298793951 0.87500000000000 204.383 > 127 144 Tl 0.50000000000000 0.92061632127284 0.87500000000000 204.383 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.7074198 0.0000000 -0.1362204 0.0000000 3.0465611 0.0000000 -0.1362201 0.0000000 2.9840878 -------------------------- Born effective charges -------------------------- 1 F -1.3905333 0.1633328 -0.1031758 0.1924101 -1.2970760 0.0846734 -0.1006940 0.0529266 -1.2336040 2 F -1.3905333 -0.1633328 -0.1031758 -0.1924101 -1.2970760 -0.0846734 -0.1006940 -0.0529266 -1.2336040 3 F -1.3905333 0.1633328 -0.1031758 0.1924101 -1.2970760 0.0846734 -0.1006940 0.0529266 -1.2336040 4 F -1.3905333 -0.1633328 -0.1031758 -0.1924101 -1.2970760 -0.0846734 -0.1006940 -0.0529266 -1.2336040 5 F -1.0590458 0.1262294 0.0849540 0.1295754 -1.1844070 -0.4110909 0.0741456 -0.4094988 -1.1377178 6 F -1.0590458 -0.1262294 0.0849540 -0.1295754 -1.1844070 0.4110909 0.0741456 0.4094988 -1.1377178 7 F -1.0590458 0.1262294 0.0849540 0.1295754 -1.1844070 -0.4110909 0.0741456 -0.4094988 -1.1377178 8 F -1.0590458 -0.1262294 0.0849540 -0.1295754 -1.1844070 0.4110909 0.0741456 0.4094988 -1.1377178 9 Al 3.3606708 0.0563902 0.1546128 -0.0041912 2.9581445 -0.0652250 0.1810176 0.0740030 3.0068440 10 Al 3.3606708 -0.0563902 0.1546128 0.0041912 2.9581445 0.0652250 0.1810176 -0.0740030 3.0068440 11 Tl 1.5384874 0.0000000 -0.1181693 0.0000000 2.0048215 0.0000000 -0.1279208 0.0000000 1.7357994 12 Tl 1.5384874 0.0000000 -0.1181693 0.0000000 2.0048215 0.0000000 -0.1279208 0.0000000 1.7357994 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 11 11 11 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.76, Number of G-points: 309, Lambda: 0.14 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/366) ======================= 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 2.00e-05 2.00e-05 Number of triplets: 366 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 0.725 ( 0.000 0.000 0.000) 0.000 0.740 ( 0.000 0.000 0.000) 0.000 1.632 ( 0.000 0.000 0.000) 0.000 1.701 ( 0.000 0.000 0.000) 0.000 1.805 ( 0.000 0.000 0.000) 0.000 2.030 ( 0.000 0.000 0.000) 0.000 2.379 ( 0.000 0.000 0.000) 0.000 2.384 ( 0.000 0.000 0.000) 0.000 3.711 ( 0.000 0.000 0.000) 0.000 5.525 ( 0.000 0.000 0.000) 0.000 5.840 ( 0.000 0.000 0.000) 0.000 6.301 ( 0.000 0.000 0.000) 0.000 6.452 ( 0.000 0.000 0.000) 0.000 6.591 ( 0.000 0.000 0.000) 0.000 7.007 ( 0.000 0.000 0.000) 0.000 7.648 ( 0.000 0.000 0.000) 0.000 8.517 ( 0.000 0.000 0.000) 0.000 9.395 ( 0.000 0.000 0.000) 0.000 9.571 ( 0.000 0.000 0.000) 0.000 9.617 ( 0.000 0.000 0.000) 0.000 9.835 ( 0.000 0.000 0.000) 0.000 10.234 ( 0.000 0.000 0.000) 0.000 11.356 ( 0.000 0.000 0.000) 0.000 12.028 ( 0.000 0.000 0.000) 0.000 13.275 ( 0.000 0.000 0.000) 0.000 15.309 ( 0.000 0.000 0.000) 0.000 15.438 ( 0.000 0.000 0.000) 0.000 15.596 ( 0.000 0.000 0.000) 0.000 17.291 ( 0.000 0.000 0.000) 0.000 17.613 ( 0.000 0.000 0.000) 0.000 18.803 ( 0.000 0.000 0.000) 0.000 19.004 ( 0.000 0.000 0.000) 0.000 19.302 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/366) ======================= q-point: ( 0.09 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.395 ( 10.059 -14.869 10.753) 20.926 0.414 ( 0.582 -12.706 0.831) 12.746 0.664 ( 0.272 -21.876 1.316) 21.917 0.751 ( 7.673 -11.662 1.767) 14.071 1.117 ( 1.170 -35.155 3.992) 35.400 1.617 ( 0.010 1.712 0.007) 1.712 1.730 ( -0.279 -3.488 0.280) 3.510 2.152 ( 1.230 -12.297 5.189) 13.404 2.307 ( -12.015 -10.618 -1.987) 16.157 2.428 ( 2.881 -3.796 -1.633) 5.038 2.900 ( 21.407 8.178 5.553) 23.580 3.980 ( -1.364 -27.092 0.458) 27.130 5.500 ( 0.039 2.851 0.017) 2.851 5.954 ( -3.592 3.404 -0.662) 4.993 6.072 ( -1.161 13.676 -3.842) 14.252 6.583 ( 1.712 0.618 -3.431) 3.883 6.682 ( -3.402 -8.975 3.187) 10.113 6.986 ( -1.798 1.706 0.454) 2.520 7.777 ( -0.876 -7.096 -2.547) 7.590 8.481 ( -1.473 6.047 -1.705) 6.453 9.449 ( 0.210 -5.251 -0.219) 5.260 9.600 ( 0.572 1.641 0.971) 1.990 9.924 ( 0.562 -8.937 0.228) 8.958 10.169 ( 0.577 6.994 -0.515) 7.037 11.198 ( -42.544 -18.175 -7.931) 46.938 11.793 ( -19.550 -11.182 -13.562) 26.290 12.081 ( 5.064 -3.413 2.696) 6.675 13.312 ( -0.269 -3.732 0.223) 3.748 15.113 ( -10.843 15.131 -3.772) 18.993 15.408 ( -5.100 6.389 8.025) 11.456 15.501 ( 10.927 16.462 -8.911) 21.675 17.233 ( 0.090 6.309 -0.172) 6.312 18.510 ( -48.667 -36.810 -21.324) 64.639 18.902 ( -0.023 -10.226 -0.079) 10.227 19.248 ( 6.914 3.967 3.121) 8.561 20.210 ( 97.143 46.007 41.569) 115.245 ======================= Grid point 2 (3/366) ======================= q-point: ( 0.18 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.600 ( 0.215 -9.432 0.193) 9.437 0.687 ( 7.362 -6.583 5.878) 11.493 0.775 ( -0.893 -8.044 1.128) 8.171 1.235 ( 7.165 -19.422 3.501) 20.995 1.568 ( -0.008 3.282 0.020) 3.282 1.802 ( -4.424 -24.565 18.201) 30.891 1.829 ( 7.623 -16.267 -11.494) 21.327 2.430 ( 5.345 -2.772 6.536) 8.886 2.494 ( 3.958 -4.659 -7.154) 9.410 2.511 ( -0.223 -23.012 12.318) 26.103 3.037 ( -0.544 -15.383 -2.363) 15.573 4.557 ( -5.292 -37.245 -1.763) 37.660 5.418 ( 0.346 6.695 -0.801) 6.752 5.629 ( -1.610 21.608 -1.580) 21.725 5.990 ( -4.818 0.540 -4.700) 6.753 6.569 ( 1.475 1.613 -0.792) 2.325 6.799 ( -0.223 -5.755 -0.938) 5.835 6.935 ( -2.500 2.049 2.652) 4.181 7.936 ( -0.275 -10.632 -3.169) 11.097 8.345 ( -1.602 5.736 -1.910) 6.255 9.463 ( 0.806 6.122 1.249) 6.300 9.657 ( 0.772 -5.352 0.344) 5.418 10.035 ( 1.386 4.449 -1.385) 4.862 10.136 ( -0.135 -13.799 -0.309) 13.803 11.222 ( -14.912 -6.616 2.396) 16.489 11.862 ( -14.294 -13.066 -10.979) 22.261 12.227 ( 8.555 -6.563 4.488) 11.679 13.369 ( -0.864 -1.257 0.708) 1.682 14.683 ( -12.228 21.065 -4.740) 24.814 15.131 ( 1.233 25.792 5.759) 26.456 15.278 ( 1.995 7.721 -6.966) 10.589 17.069 ( 0.001 11.822 0.078) 11.823 18.836 ( -10.464 -23.308 -4.963) 26.027 19.126 ( -0.495 -13.432 -0.367) 13.446 19.227 ( -0.233 0.839 0.397) 0.957 20.113 ( 38.736 23.883 16.740) 48.489 ======================= Grid point 3 (4/366) ======================= q-point: ( 0.27 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.773 ( 0.184 -9.633 0.008) 9.634 0.802 ( 2.350 -4.674 1.395) 5.414 0.955 ( 2.351 -7.838 2.900) 8.682 1.491 ( -0.164 4.963 0.384) 4.981 1.522 ( 4.773 -7.779 2.229) 9.395 1.900 ( 0.267 -2.552 0.745) 2.672 2.380 ( 3.863 -9.647 10.313) 14.641 2.476 ( 7.868 -13.161 1.748) 15.433 2.629 ( -3.893 -9.044 -3.851) 10.573 3.050 ( -0.273 -30.876 11.285) 32.875 3.374 ( -3.585 -22.852 -4.322) 23.532 5.027 ( -4.719 3.108 -1.778) 5.924 5.241 ( -0.228 -0.113 -10.031) 10.035 5.383 ( -3.798 -4.814 4.488) 7.599 5.885 ( -5.685 4.953 -6.779) 10.139 6.551 ( 1.117 1.136 3.200) 3.575 6.838 ( 0.832 -0.103 -7.339) 7.387 6.984 ( 2.179 -6.462 7.220) 9.931 8.040 ( -1.634 -0.235 -1.381) 2.153 8.346 ( -0.943 -9.718 -2.831) 10.166 9.286 ( 0.964 14.982 1.854) 15.127 9.569 ( 1.472 13.310 0.603) 13.404 10.225 ( 2.039 -22.368 -2.389) 22.587 10.394 ( -1.695 -15.467 -1.435) 15.626 11.241 ( -3.491 -0.981 6.986) 7.872 12.025 ( -12.229 -18.354 -10.543) 24.446 12.449 ( 10.112 -9.604 5.464) 14.978 13.280 ( -2.208 11.866 1.871) 12.214 14.211 ( -10.500 20.972 -5.058) 23.992 14.629 ( 2.837 31.532 0.195) 31.660 15.213 ( 0.002 -2.454 -1.339) 2.795 16.814 ( -0.029 16.561 0.171) 16.562 19.110 ( 3.755 -7.375 1.194) 8.361 19.201 ( -4.346 -3.543 -1.844) 5.903 19.377 ( 0.263 -12.331 0.656) 12.351 19.974 ( 13.272 13.741 5.853) 19.980 ======================= Grid point 4 (5/366) ======================= q-point: ( 0.36 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.916 ( 0.695 -6.374 0.377) 6.423 0.946 ( 0.201 -9.370 -0.135) 9.373 1.078 ( 2.633 -3.260 2.159) 4.714 1.387 ( -0.117 6.465 0.110) 6.467 1.613 ( 0.993 -0.207 0.700) 1.232 1.918 ( 0.628 0.638 0.149) 0.908 2.387 ( 6.346 2.797 5.062) 8.586 2.676 ( -9.683 -2.472 -5.501) 11.408 2.981 ( 4.960 -26.197 7.432) 27.679 3.607 ( -1.514 -26.465 13.048) 29.545 3.738 ( -2.538 -20.549 -6.506) 21.703 4.622 ( -2.429 24.783 -7.566) 26.026 5.153 ( 3.973 8.321 3.398) 9.827 5.519 ( -5.162 6.202 -6.138) 10.138 5.884 ( -11.261 -18.072 -7.102) 22.446 6.554 ( 3.385 2.758 6.244) 7.619 6.901 ( 2.152 -9.780 -5.797) 11.571 7.143 ( 4.754 -5.572 4.784) 8.748 8.012 ( -2.710 -1.419 0.198) 3.065 8.580 ( -1.078 -15.667 -2.954) 15.980 8.939 ( 1.023 24.078 0.894) 24.116 9.334 ( 1.883 13.721 1.503) 13.931 10.642 ( -4.971 -15.093 1.553) 15.966 10.707 ( 4.995 -25.595 -7.821) 27.225 11.268 ( 0.744 -2.821 9.496) 9.934 12.293 ( -7.059 -20.372 -10.448) 23.959 12.709 ( 8.556 -6.801 6.779) 12.862 12.938 ( -3.896 19.103 2.938) 19.717 13.777 ( -9.722 18.160 -4.964) 21.188 14.066 ( 4.566 33.219 -0.363) 33.533 15.373 ( -0.090 -14.910 -0.410) 14.916 16.482 ( -0.041 20.217 0.211) 20.218 19.139 ( -1.726 -0.109 -0.863) 1.933 19.273 ( 6.526 1.149 2.862) 7.218 19.576 ( 1.017 -8.766 0.836) 8.865 19.857 ( -1.639 3.829 -0.662) 4.217 ======================= Grid point 5 (6/366) ======================= q-point: ( 0.45 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.023 ( -0.668 -4.715 -0.324) 4.774 1.107 ( 0.931 -7.138 -1.449) 7.343 1.120 ( 1.233 -0.569 2.632) 2.962 1.260 ( -0.110 7.546 0.023) 7.547 1.586 ( -0.624 1.668 -0.213) 1.793 1.906 ( 0.272 0.641 -0.040) 0.697 2.433 ( 7.477 -0.551 5.039) 9.033 2.590 ( -9.654 1.362 -5.792) 11.340 3.480 ( 3.613 -22.234 6.473) 23.437 3.934 ( -4.284 -5.170 4.372) 8.012 4.026 ( 2.061 -9.924 2.926) 10.549 4.171 ( -2.423 15.913 -11.190) 19.604 5.095 ( 4.682 1.242 6.929) 8.454 5.269 ( -4.172 10.946 -8.257) 14.332 6.071 ( -6.311 -8.374 -3.178) 10.957 6.523 ( 2.551 3.142 2.699) 4.865 7.122 ( 0.373 -10.203 -2.858) 10.602 7.242 ( 3.487 -0.751 2.988) 4.653 8.125 ( -2.111 -14.272 0.412) 14.433 8.488 ( 0.913 25.200 0.514) 25.222 8.848 ( -1.312 -15.459 -3.138) 15.829 9.102 ( 1.754 14.325 2.347) 14.622 10.846 ( -5.761 -11.207 -0.378) 12.607 10.957 ( 6.527 1.957 -2.018) 7.107 11.594 ( 0.260 -31.066 5.149) 31.491 12.211 ( 0.317 31.255 -4.565) 31.588 12.731 ( -3.743 -14.562 1.171) 15.080 13.065 ( 3.537 -14.365 3.734) 15.258 13.420 ( -10.359 10.534 -4.278) 15.381 13.539 ( 7.343 27.756 0.285) 28.713 15.704 ( -0.015 -20.928 -0.258) 20.929 16.099 ( -0.030 21.986 0.230) 21.987 19.135 ( -1.718 -1.001 -0.833) 2.156 19.257 ( 4.319 3.690 1.994) 6.020 19.702 ( 1.972 -3.580 0.989) 4.205 19.804 ( -3.935 0.168 -1.710) 4.293 ======================= Grid point 12 (7/366) ======================= q-point: ( 0.09 0.09 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.183 ( 5.763 -0.000 16.525) 17.501 0.252 ( 14.065 -0.000 9.370) 16.900 0.531 ( 30.857 -0.000 20.313) 36.942 0.736 ( 1.741 -0.000 -0.006) 1.741 0.770 ( 2.354 -0.000 5.735) 6.199 1.632 ( 0.034 -0.000 -0.056) 0.066 1.726 ( 2.983 -0.000 1.431) 3.309 1.807 ( -0.163 0.000 1.798) 1.805 2.085 ( 5.589 -0.000 5.724) 8.000 2.386 ( 1.046 -0.000 0.028) 1.046 3.687 ( 0.518 -0.000 -8.449) 8.465 3.771 ( -0.836 0.000 5.173) 5.240 5.526 ( 0.778 -0.000 -1.972) 2.120 5.820 ( -2.332 0.000 -1.682) 2.876 6.284 ( -1.628 0.000 -2.164) 2.708 6.429 ( -4.029 0.000 1.914) 4.461 6.580 ( 0.338 -0.000 -4.954) 4.965 6.984 ( -4.290 0.000 1.654) 4.598 7.638 ( -0.691 0.000 -2.043) 2.157 8.498 ( -1.519 0.000 -3.013) 3.374 9.397 ( -2.872 0.000 7.656) 8.177 9.571 ( 0.729 -0.000 -1.725) 1.872 9.633 ( 0.809 -0.000 3.298) 3.396 9.851 ( 1.837 -0.000 0.829) 2.015 10.239 ( 0.794 -0.000 -0.095) 0.800 11.657 ( 2.354 -0.000 -2.566) 3.482 12.094 ( 7.789 -0.000 4.546) 9.018 13.274 ( -0.029 0.000 0.009) 0.030 15.287 ( -2.305 0.000 -2.259) 3.227 15.435 ( -0.433 0.000 0.125) 0.451 15.727 ( 1.542 -0.000 -4.584) 4.836 17.291 ( 0.697 -0.000 -1.751) 1.885 17.613 ( -0.053 0.000 -0.008) 0.053 18.804 ( 0.055 -0.000 0.192) 0.200 19.265 ( -4.901 0.000 -1.440) 5.108 22.385 ( -1.016 0.000 5.410) 5.504 ======================= Grid point 13 (8/366) ======================= q-point: ( 0.18 0.09 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.434 ( 1.039 -10.184 1.946) 10.420 0.576 ( 5.646 -14.151 7.297) 16.893 0.721 ( 6.200 -0.108 3.600) 7.170 0.967 ( 19.215 -17.526 10.613) 28.090 1.185 ( 3.304 -34.905 10.093) 36.485 1.617 ( 0.010 1.710 -0.037) 1.711 1.744 ( 2.218 -3.046 1.165) 3.944 2.172 ( -7.296 -21.859 9.205) 24.815 2.257 ( 7.742 -12.366 0.712) 14.607 2.445 ( 1.595 -5.998 -0.997) 6.286 3.202 ( 15.488 28.766 4.223) 32.942 3.953 ( -3.116 -23.274 1.046) 23.505 5.501 ( -0.005 2.777 0.202) 2.784 5.867 ( -7.079 -0.866 -2.592) 7.588 6.025 ( -1.382 16.274 -6.341) 17.520 6.569 ( 0.419 -2.829 -9.643) 10.058 6.644 ( -5.628 -10.027 7.710) 13.844 6.944 ( -4.558 1.156 0.078) 4.703 7.738 ( -1.313 -9.019 -5.403) 10.596 8.435 ( -2.669 5.068 -3.797) 6.872 9.453 ( 0.565 -5.509 -0.596) 5.570 9.624 ( 1.478 1.811 2.488) 3.414 9.939 ( 1.318 -8.101 0.591) 8.229 10.178 ( 1.750 6.410 -2.993) 7.287 10.440 ( -41.615 -56.160 -6.223) 70.175 11.671 ( 0.285 -1.015 -2.985) 3.166 12.210 ( 10.784 -3.969 6.011) 12.968 13.310 ( -0.222 -3.512 0.235) 3.527 14.985 ( -5.545 21.944 -3.068) 22.841 15.393 ( -2.489 5.827 4.188) 7.595 15.556 ( 4.252 16.702 -6.355) 18.369 17.234 ( 0.079 6.308 -0.109) 6.309 18.116 ( -11.216 -40.777 -5.278) 42.620 18.901 ( -0.127 -9.974 0.100) 9.975 19.217 ( -6.208 0.410 -1.832) 6.485 21.401 ( 47.697 71.299 21.061) 88.329 ======================= Grid point 14 (9/366) ======================= q-point: ( 0.27 0.09 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.605 ( 0.355 -9.148 0.197) 9.157 0.749 ( -0.123 -3.870 0.221) 3.878 0.858 ( 8.707 -7.124 7.366) 13.447 1.389 ( 11.255 -13.180 6.106) 18.376 1.568 ( -0.020 3.384 -0.003) 3.384 1.827 ( -1.777 -7.196 9.398) 11.969 1.912 ( 7.439 -33.326 1.687) 34.188 2.451 ( -1.439 -8.222 -1.246) 8.439 2.574 ( 2.231 -14.151 11.354) 18.280 2.617 ( 8.179 -10.780 5.840) 14.738 3.022 ( 0.522 -3.875 -1.730) 4.276 4.457 ( -7.128 -34.865 -2.616) 35.682 5.418 ( 0.499 7.759 -1.469) 7.912 5.587 ( -2.988 19.501 -2.425) 19.877 5.885 ( -5.790 0.953 -6.404) 8.686 6.560 ( -1.041 0.455 -4.618) 4.755 6.800 ( 0.854 -6.347 -0.282) 6.410 6.906 ( -4.367 -2.021 4.576) 6.640 7.908 ( -0.434 -11.088 -5.203) 12.256 8.306 ( -2.195 4.965 -2.781) 6.099 9.485 ( 1.210 5.542 1.757) 5.938 9.674 ( 1.379 -5.054 0.700) 5.285 10.050 ( 2.512 4.424 -2.728) 5.773 10.132 ( -0.082 -12.294 -0.383) 12.300 10.941 ( -24.937 -29.354 1.215) 38.536 11.695 ( -3.271 -4.906 -6.863) 9.048 12.400 ( 12.683 -6.428 6.537) 15.650 13.361 ( -0.877 -0.761 0.815) 1.419 14.518 ( -8.296 22.726 -4.204) 24.555 15.167 ( -1.250 25.325 8.560) 26.762 15.267 ( 3.065 7.851 -10.007) 13.083 17.070 ( -0.016 11.823 0.167) 11.824 18.703 ( -7.001 -31.766 -3.230) 32.688 19.103 ( -3.101 -9.105 -1.447) 9.727 19.182 ( -4.021 -4.687 -0.728) 6.218 20.709 ( 33.446 45.377 14.217) 58.137 ======================= Grid point 15 (10/366) ======================= q-point: ( 0.36 0.09 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.776 ( 0.256 -9.549 -0.076) 9.553 0.825 ( 0.616 -4.632 0.394) 4.690 1.037 ( 6.421 -5.107 5.035) 9.627 1.491 ( -0.109 5.062 0.124) 5.065 1.600 ( 4.471 -3.630 2.417) 6.246 1.912 ( 0.839 -2.522 1.155) 2.898 2.466 ( -3.870 -2.717 8.849) 10.033 2.548 ( 6.308 -19.458 -8.291) 22.071 2.632 ( 5.537 -1.777 10.096) 11.651 3.114 ( -1.479 -29.437 16.679) 33.867 3.290 ( -3.590 -23.338 -8.090) 24.959 4.940 ( -6.407 -5.393 -2.279) 8.679 5.160 ( -2.449 -1.199 -11.708) 12.021 5.381 ( -0.837 4.483 4.884) 6.682 5.768 ( -5.853 5.679 -7.427) 11.030 6.557 ( -1.519 -2.802 0.099) 3.189 6.821 ( 1.370 0.052 -4.746) 4.940 7.057 ( 2.935 -9.506 6.790) 12.045 8.007 ( -1.914 0.055 -1.780) 2.614 8.315 ( -1.115 -10.151 -3.606) 10.831 9.312 ( 1.149 15.354 2.137) 15.545 9.596 ( 1.916 12.854 0.890) 13.027 10.243 ( 2.799 -22.425 -3.235) 22.830 10.361 ( -1.767 -13.893 -1.972) 14.143 11.220 ( -6.825 -11.653 10.429) 17.062 11.809 ( -9.619 -16.928 -12.188) 22.970 12.637 ( 12.657 -8.311 6.203) 16.363 13.260 ( -2.225 12.747 1.974) 13.089 14.056 ( -8.269 21.077 -4.737) 23.131 14.668 ( 2.663 30.871 0.462) 30.989 15.206 ( 0.020 -2.728 -1.443) 3.086 16.814 ( -0.047 16.567 0.229) 16.569 19.081 ( -6.738 -4.243 -2.678) 8.401 19.148 ( -2.350 -16.469 -1.049) 16.668 19.386 ( 0.450 -12.703 0.673) 12.729 20.220 ( 16.474 31.392 6.972) 36.131 ======================= Grid point 16 (11/366) ======================= q-point: ( 0.45 0.09 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.921 ( 0.031 -5.579 -0.050) 5.579 0.948 ( 0.219 -9.301 -0.111) 9.305 1.149 ( 5.494 -1.381 3.864) 6.857 1.386 ( -0.113 6.478 0.084) 6.479 1.619 ( -0.774 2.174 0.252) 2.321 1.931 ( 1.184 1.109 0.254) 1.642 2.427 ( -6.846 -0.446 -3.827) 7.856 2.577 ( 2.273 2.225 2.473) 4.029 3.099 ( 5.783 -24.966 9.092) 27.192 3.625 ( -7.487 -22.782 9.671) 25.857 3.696 ( 2.785 -24.834 -2.799) 25.146 4.545 ( -2.926 25.433 -7.788) 26.759 5.222 ( 4.010 5.384 1.915) 6.981 5.409 ( -5.740 4.620 -6.567) 9.870 5.714 ( -8.904 -15.741 -5.350) 18.860 6.619 ( 1.480 -0.735 5.815) 6.045 6.883 ( 1.031 -9.336 -7.222) 11.848 7.246 ( 5.894 -5.603 5.190) 9.647 7.975 ( -2.894 -1.540 0.283) 3.291 8.549 ( -1.103 -15.615 -3.234) 15.984 8.957 ( 0.996 24.481 0.736) 24.512 9.370 ( 2.010 13.605 1.702) 13.857 10.581 ( -4.432 -13.372 -0.089) 14.087 10.737 ( 4.957 -27.460 -6.839) 28.730 11.338 ( 1.216 -3.000 12.164) 12.587 12.126 ( -8.730 -27.203 -11.206) 30.688 12.840 ( 2.480 13.992 5.952) 15.406 12.931 ( 3.878 2.810 2.380) 5.347 13.630 ( -8.209 18.868 -4.087) 20.979 14.127 ( 4.504 31.421 -0.156) 31.743 15.370 ( -0.074 -15.067 -0.409) 15.073 16.482 ( -0.062 20.215 0.229) 20.216 19.058 ( -6.685 -1.841 -2.856) 7.499 19.380 ( 4.497 -4.971 2.017) 7.000 19.596 ( 1.418 -9.236 1.101) 9.409 19.858 ( 2.038 15.430 0.728) 15.581 ======================= Grid point 17 (12/366) ======================= q-point: ( 0.55 0.09 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.012 ( -0.725 -4.379 -0.348) 4.452 1.110 ( 0.351 -8.377 -0.520) 8.401 1.169 ( 3.772 3.806 2.943) 6.113 1.259 ( -0.092 7.562 0.002) 7.562 1.573 ( -1.495 0.500 0.283) 1.602 1.912 ( 0.782 1.200 -0.188) 1.444 2.351 ( -11.339 -0.231 -7.145) 13.405 2.632 ( 8.557 -2.584 5.693) 10.598 3.572 ( 4.559 -18.132 7.098) 19.998 3.883 ( -4.382 -6.535 -0.280) 7.873 4.073 ( -0.312 -0.981 -2.500) 2.704 4.085 ( -1.020 4.556 -0.575) 4.705 5.137 ( -3.296 9.570 -4.763) 11.187 5.215 ( 2.905 1.742 1.406) 3.667 5.967 ( -6.056 -15.446 -3.069) 16.872 6.604 ( 5.659 5.881 5.255) 9.707 7.055 ( -4.468 -8.858 -6.456) 11.837 7.335 ( 5.339 2.114 4.262) 7.151 8.099 ( -1.952 -15.274 0.276) 15.401 8.502 ( 0.776 25.065 0.260) 25.079 8.815 ( -1.203 -15.386 -2.761) 15.678 9.137 ( 1.618 14.441 2.123) 14.686 10.767 ( -5.057 -10.865 -0.799) 12.011 11.037 ( 6.479 0.849 -1.881) 6.800 11.626 ( 0.151 -29.122 5.739) 29.682 12.192 ( 0.297 30.717 -4.103) 30.992 12.671 ( -5.237 -21.474 0.321) 22.106 13.140 ( 4.246 -8.721 2.607) 10.044 13.266 ( -8.477 12.182 -3.731) 15.303 13.644 ( 7.035 24.082 1.515) 25.134 15.703 ( 0.033 -21.015 -0.210) 21.016 16.100 ( -0.076 21.987 0.193) 21.988 19.052 ( -6.453 -3.179 -2.911) 7.761 19.370 ( 7.522 9.080 3.397) 12.271 19.688 ( -3.843 -1.703 -1.261) 4.389 19.789 ( 1.965 -4.327 0.580) 4.788 ======================= Grid point 18 (13/366) ======================= q-point: (-0.36 0.09 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.031 ( 0.256 4.108 0.137) 4.118 1.100 ( -0.386 3.354 0.788) 3.467 1.108 ( 0.123 8.070 -0.817) 8.112 1.261 ( 0.087 -7.526 -0.021) 7.527 1.594 ( 0.207 -1.995 0.754) 2.143 1.905 ( 0.203 -0.067 -0.077) 0.227 2.284 ( -8.234 -2.000 -5.613) 10.164 2.763 ( 9.303 -2.177 5.633) 11.091 3.411 ( -2.232 25.773 -4.555) 26.267 3.936 ( 1.444 9.497 -8.701) 12.961 4.011 ( -0.321 1.760 2.736) 3.269 4.257 ( 1.887 -15.245 9.901) 18.276 4.994 ( -4.432 -1.885 -6.804) 8.336 5.359 ( 3.195 -11.442 5.870) 13.251 6.146 ( 2.649 -5.120 0.996) 5.850 6.528 ( 4.001 7.097 1.910) 8.369 7.034 ( -8.757 4.389 -4.954) 10.977 7.254 ( 2.355 9.605 2.519) 10.206 8.149 ( 1.621 13.303 -0.359) 13.406 8.474 ( -0.764 -25.293 -0.585) 25.312 8.879 ( 1.004 15.577 2.539) 15.814 9.069 ( -1.339 -14.241 -1.868) 14.426 10.876 ( -3.185 -2.386 -0.659) 4.033 10.933 ( 3.163 11.160 2.220) 11.810 11.567 ( -0.296 32.355 -3.369) 32.531 12.230 ( -0.241 -31.709 3.674) 31.922 12.745 ( -0.626 11.803 -1.283) 11.888 13.028 ( 1.322 16.245 -3.936) 16.768 13.432 ( -6.596 -31.297 0.129) 31.985 13.588 ( 8.879 -9.471 4.329) 13.685 15.706 ( 0.049 20.924 0.219) 20.925 16.098 ( -0.015 -22.065 -0.189) 22.066 19.062 ( -7.086 -3.600 -3.141) 8.546 19.282 ( 3.833 4.520 1.695) 6.164 19.663 ( -2.399 2.261 -0.996) 3.443 19.871 ( 3.996 -1.338 1.601) 4.508 ======================= Grid point 19 (14/366) ======================= q-point: (-0.27 0.09 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.902 ( -0.843 7.872 -0.471) 7.931 0.944 ( -0.104 9.408 0.039) 9.408 1.051 ( -0.624 3.909 -0.666) 4.015 1.388 ( 0.080 -6.456 -0.085) 6.457 1.594 ( -1.092 2.873 -0.523) 3.118 1.912 ( -0.223 -0.371 -0.061) 0.438 2.286 ( -4.512 -3.885 -3.437) 6.875 2.811 ( 6.622 5.067 2.207) 8.626 2.897 ( -3.341 27.307 -2.802) 27.653 3.565 ( 0.352 26.999 -7.005) 27.895 3.795 ( 1.946 19.434 2.845) 19.738 4.684 ( 1.483 -24.220 5.133) 24.802 5.089 ( -2.600 -10.660 -2.961) 11.365 5.601 ( 2.874 -7.737 3.612) 9.010 6.078 ( 11.314 20.783 7.362) 24.782 6.463 ( -5.407 -3.575 -6.084) 8.890 6.874 ( -3.983 3.651 1.314) 5.560 7.089 ( -0.973 8.989 -1.324) 9.138 8.042 ( 1.650 1.215 -0.080) 2.051 8.605 ( 0.679 15.732 1.757) 15.844 8.923 ( -0.671 -23.798 -0.652) 23.816 9.307 ( -1.142 -13.818 -0.861) 13.892 10.678 ( 0.992 23.130 -3.125) 23.361 10.701 ( -0.748 17.320 6.839) 18.636 11.221 ( -0.364 2.607 -5.186) 5.815 12.414 ( 3.416 14.186 8.448) 16.861 12.579 ( -5.254 9.663 -6.293) 12.672 12.976 ( 3.360 -18.307 -2.392) 18.765 13.921 ( 7.399 -18.785 3.564) 20.502 14.015 ( -3.092 -34.528 0.485) 34.670 15.376 ( 0.070 14.769 0.271) 14.771 16.481 ( 0.017 -20.226 -0.125) 20.227 19.058 ( -7.783 -2.272 -3.219) 8.724 19.263 ( 2.175 1.009 0.892) 2.558 19.560 ( -0.751 7.849 -0.505) 7.901 19.890 ( 2.096 1.842 0.792) 2.901 ======================= Grid point 20 (15/366) ======================= q-point: (-0.18 0.09 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.762 ( -1.642 6.518 -1.130) 6.816 0.771 ( -0.079 9.668 0.005) 9.669 0.935 ( -0.019 8.452 -0.612) 8.474 1.464 ( -1.946 10.190 -1.254) 10.450 1.492 ( -0.055 -5.016 0.141) 5.019 1.896 ( -0.024 2.530 -0.266) 2.544 2.298 ( -2.126 7.091 -3.457) 8.170 2.392 ( -2.728 18.744 -1.615) 19.010 2.684 ( 1.450 11.744 2.089) 12.016 3.010 ( 0.095 31.612 -4.217) 31.892 3.423 ( 1.342 22.619 1.397) 22.702 5.078 ( 1.686 -7.502 0.788) 7.729 5.266 ( -0.690 -9.147 2.529) 9.516 5.423 ( 2.592 17.908 -0.466) 18.101 5.975 ( 2.917 -3.710 3.214) 5.710 6.510 ( -1.596 -3.954 -2.302) 4.846 6.870 ( -0.188 -1.439 6.314) 6.478 6.928 ( -0.730 6.048 -5.935) 8.505 8.061 ( 0.653 0.441 0.530) 0.949 8.366 ( 0.377 9.335 1.073) 9.404 9.270 ( -0.381 -14.746 -0.745) 14.769 9.553 ( -0.553 -13.598 -0.208) 13.611 10.214 ( -0.737 22.326 0.861) 22.354 10.417 ( 0.722 16.448 0.547) 16.473 11.246 ( 1.022 -3.324 -2.375) 4.211 12.208 ( 7.745 13.467 6.340) 16.779 12.317 ( -6.064 10.833 -4.316) 13.144 13.296 ( 1.009 -11.323 -0.806) 11.397 14.358 ( 6.505 -23.215 2.560) 24.245 14.593 ( -2.096 -31.193 -0.104) 31.264 15.219 ( 0.020 2.194 0.621) 2.280 16.813 ( 0.009 -16.559 -0.062) 16.559 19.022 ( -4.982 0.392 -1.836) 5.324 19.251 ( 1.650 2.794 0.739) 3.328 19.373 ( -0.073 12.323 -0.287) 12.326 19.839 ( -3.867 3.022 -1.813) 5.232 ======================= Grid point 21 (16/366) ======================= q-point: (-0.09 0.09 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.598 ( -0.000 9.648 0.000) 9.648 0.610 ( -0.000 11.067 0.000) 11.067 0.783 ( -0.000 6.424 0.000) 6.424 1.175 ( -0.000 21.812 0.000) 21.812 1.568 ( 0.000 -3.216 -0.000) 3.216 1.775 ( -0.000 35.084 0.000) 35.084 1.816 ( -0.000 5.596 0.000) 5.596 2.359 ( 0.000 -1.376 -0.000) 1.376 2.479 ( -0.000 24.976 0.000) 24.976 2.496 ( -0.000 8.207 0.000) 8.207 3.049 ( -0.000 18.604 0.000) 18.604 4.600 ( -0.000 38.109 0.000) 38.109 5.417 ( 0.000 -6.455 -0.000) 6.455 5.645 ( 0.000 -22.134 -0.000) 22.134 6.040 ( 0.000 -0.594 -0.000) 0.594 6.555 ( 0.000 -2.019 -0.000) 2.019 6.806 ( -0.000 5.278 0.000) 5.278 6.944 ( 0.000 -3.382 -0.000) 3.382 7.946 ( -0.000 10.435 0.000) 10.435 8.362 ( 0.000 -6.146 -0.000) 6.146 9.453 ( 0.000 -6.300 -0.000) 6.300 9.651 ( -0.000 5.421 0.000) 5.421 10.029 ( 0.000 -4.446 -0.000) 4.446 10.138 ( -0.000 14.405 0.000) 14.405 11.307 ( 0.000 -2.727 -0.000) 2.727 12.055 ( -0.000 9.502 0.000) 9.502 12.128 ( -0.000 5.845 0.000) 5.845 13.374 ( -0.000 1.441 0.000) 1.441 14.815 ( 0.000 -22.990 -0.000) 22.990 15.091 ( 0.000 -24.981 -0.000) 24.981 15.284 ( 0.000 -7.605 -0.000) 7.605 17.069 ( 0.000 -11.821 -0.000) 11.821 19.003 ( -0.000 0.308 0.000) 0.308 19.131 ( -0.000 13.738 0.000) 13.738 19.156 ( -0.000 8.356 0.000) 8.356 19.746 ( -0.000 2.885 0.000) 2.885 ======================= Grid point 24 (17/366) ======================= q-point: ( 0.18 0.18 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.315 ( 3.571 -0.000 9.833) 10.461 0.459 ( 9.437 -0.000 7.525) 12.069 0.777 ( 4.590 -0.000 0.492) 4.617 0.860 ( 4.449 -0.000 11.022) 11.886 1.030 ( 27.853 -0.000 18.354) 33.357 1.632 ( 0.018 -0.000 -0.136) 0.138 1.789 ( 4.747 -0.000 2.357) 5.300 1.822 ( 0.667 -0.000 2.328) 2.422 2.227 ( 8.669 -0.000 10.253) 13.427 2.408 ( 2.172 -0.000 0.167) 2.179 3.648 ( -0.055 0.000 -7.180) 7.180 3.779 ( -3.199 0.000 7.511) 8.164 5.525 ( -0.041 0.000 -0.303) 0.306 5.763 ( -4.247 0.000 -3.008) 5.204 6.238 ( -2.779 0.000 -3.680) 4.612 6.372 ( -5.545 0.000 1.874) 5.853 6.547 ( -0.580 0.000 -7.165) 7.188 6.918 ( -5.681 0.000 -0.701) 5.724 7.611 ( -1.038 0.000 -3.368) 3.525 8.450 ( -2.345 0.000 -4.629) 5.189 9.400 ( -1.236 0.000 3.809) 4.004 9.575 ( 1.281 -0.000 -1.684) 2.116 9.668 ( 1.296 -0.000 4.216) 4.411 9.889 ( 2.933 -0.000 1.312) 3.213 10.253 ( 1.329 -0.000 -0.168) 1.340 11.683 ( 2.140 -0.000 0.553) 2.211 12.270 ( 13.081 -0.000 7.428) 15.042 13.274 ( -0.049 0.000 0.015) 0.052 15.228 ( -3.919 0.000 -3.877) 5.513 15.428 ( -0.732 0.000 0.214) 0.763 15.722 ( 0.446 -0.000 -2.235) 2.279 17.291 ( 0.249 -0.000 -0.589) 0.639 17.612 ( -0.117 0.000 -0.020) 0.119 18.806 ( 0.086 -0.000 0.297) 0.310 19.162 ( -8.515 0.000 -2.497) 8.874 22.405 ( 0.858 -0.000 2.501) 2.644 ======================= Grid point 25 (18/366) ======================= q-point: ( 0.27 0.18 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.457 ( 0.915 -7.780 1.664) 8.008 0.641 ( 1.713 -8.146 2.539) 8.702 0.844 ( 8.187 -3.657 4.097) 9.858 1.275 ( 8.089 -26.928 13.300) 31.104 1.336 ( 17.075 -14.883 12.264) 25.758 1.616 ( -0.014 1.684 -0.110) 1.688 1.796 ( 4.180 -1.517 1.420) 4.668 2.135 ( -2.980 -22.908 3.155) 23.316 2.398 ( 7.641 -8.219 8.852) 14.293 2.469 ( 2.938 -6.000 -0.015) 6.681 3.361 ( 6.346 24.731 3.292) 25.744 3.911 ( -3.735 -19.117 0.743) 19.493 5.501 ( -0.203 2.495 0.505) 2.553 5.754 ( -7.166 -0.487 -3.605) 8.037 5.971 ( -1.674 16.758 -6.347) 17.998 6.499 ( -3.360 -5.896 -7.516) 10.126 6.614 ( -3.768 -10.656 4.011) 11.993 6.872 ( -5.403 0.337 -0.946) 5.496 7.693 ( -0.995 -9.461 -5.640) 11.059 8.379 ( -2.442 4.540 -4.142) 6.612 9.458 ( 0.761 -5.799 -0.766) 5.899 9.661 ( 1.827 1.921 3.035) 4.030 9.951 ( -1.707 -12.284 -0.024) 12.402 10.061 ( -10.475 -33.849 -4.552) 35.724 10.204 ( -0.518 4.745 3.385) 5.851 11.683 ( 1.830 1.526 0.131) 2.387 12.418 ( 14.062 -3.671 7.652) 16.424 13.308 ( -0.182 -3.356 0.149) 3.364 14.907 ( -3.896 24.555 -3.379) 25.091 15.381 ( -1.950 5.636 2.627) 6.516 15.569 ( 2.084 15.753 -4.114) 16.414 17.234 ( 0.023 6.292 0.041) 6.292 18.002 ( -4.749 -35.673 -2.244) 36.058 18.899 ( -0.344 -9.383 0.029) 9.389 19.100 ( -8.861 -0.649 -2.582) 9.252 21.878 ( 18.172 50.421 8.248) 54.226 ======================= Grid point 26 (19/366) ======================= q-point: ( 0.36 0.18 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.611 ( 0.358 -8.853 0.158) 8.862 0.749 ( 0.099 -4.411 0.403) 4.431 1.010 ( 8.416 -5.647 5.415) 11.491 1.567 ( -0.082 3.440 0.228) 3.449 1.578 ( 11.387 -4.840 5.694) 13.621 1.858 ( 0.225 -4.331 5.957) 7.368 2.026 ( 5.896 -35.557 6.207) 36.573 2.418 ( -1.694 -4.602 -2.694) 5.595 2.636 ( -1.924 -19.637 9.316) 21.820 2.751 ( 7.462 -16.199 5.151) 18.564 3.047 ( 2.720 12.135 2.799) 12.748 4.353 ( -5.958 -32.235 -2.640) 32.887 5.413 ( -0.063 11.213 -1.971) 11.386 5.530 ( -3.293 13.995 -2.490) 14.591 5.779 ( -4.822 2.408 -6.017) 8.078 6.502 ( -2.708 -0.880 -6.336) 6.946 6.809 ( 0.497 -3.954 -1.378) 4.217 6.874 ( -4.222 -10.211 6.121) 12.631 7.873 ( -0.438 -11.515 -5.509) 12.772 8.263 ( -1.922 4.363 -2.550) 5.407 9.510 ( 1.151 4.628 1.452) 4.985 9.699 ( 1.602 -4.484 0.936) 4.853 10.072 ( 3.173 4.323 -3.850) 6.601 10.130 ( -0.090 -10.647 -0.160) 10.648 10.651 ( -18.303 -37.168 2.336) 41.496 11.661 ( 0.642 1.151 -2.564) 2.883 12.617 ( 13.622 -5.799 6.860) 16.318 13.354 ( -0.683 -0.291 0.627) 0.972 14.412 ( -4.946 25.030 -3.349) 25.733 15.191 ( -2.856 24.239 11.086) 26.806 15.255 ( 3.883 7.983 -12.061) 14.976 17.071 ( -0.030 11.824 0.200) 11.825 18.602 ( -5.875 -33.324 -2.493) 33.929 19.014 ( -7.396 -2.482 -2.824) 8.297 19.149 ( -1.155 -12.526 0.191) 12.581 21.124 ( 19.931 48.889 8.348) 53.452 ======================= Grid point 27 (20/366) ======================= q-point: ( 0.45 0.18 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.779 ( 0.243 -9.457 -0.128) 9.461 0.831 ( 0.180 -4.677 0.239) 4.687 1.164 ( 7.954 -3.581 5.101) 10.105 1.490 ( -0.087 5.074 0.059) 5.075 1.653 ( 1.641 1.590 1.032) 2.507 1.936 ( 1.601 -2.292 1.492) 3.169 2.379 ( -6.630 2.443 -3.996) 8.118 2.648 ( 5.654 -18.378 6.622) 20.337 2.764 ( 6.310 -1.164 6.723) 9.294 3.143 ( -8.103 -26.325 12.172) 30.113 3.240 ( 3.616 -25.228 -4.231) 25.834 4.845 ( -5.493 -11.829 -2.332) 13.249 5.071 ( -2.499 4.737 -8.741) 10.252 5.400 ( 0.494 5.039 2.693) 5.735 5.658 ( -4.955 6.153 -6.172) 10.025 6.522 ( -2.312 -5.697 -2.173) 6.521 6.821 ( 1.054 -0.835 -2.050) 2.452 7.126 ( 2.464 -12.604 5.363) 13.917 7.974 ( -1.571 0.281 -1.679) 2.317 8.282 ( -0.934 -10.376 -3.212) 10.902 9.336 ( 0.957 15.716 1.706) 15.837 9.626 ( 1.758 12.406 0.911) 12.563 10.264 ( 2.603 -22.428 -2.734) 22.744 10.329 ( -1.120 -12.301 -2.368) 12.577 11.167 ( -8.743 -27.203 9.964) 30.262 11.663 ( -3.379 -6.361 -9.619) 12.017 12.835 ( 11.568 -6.941 5.404) 14.532 13.243 ( -1.676 13.599 1.501) 13.784 13.943 ( -5.343 22.269 -3.402) 23.152 14.704 ( 2.102 29.887 0.556) 29.966 15.199 ( 0.015 -2.981 -1.205) 3.215 16.815 ( -0.051 16.577 0.213) 16.579 18.961 ( -7.909 -4.383 -3.011) 9.530 19.104 ( -3.081 -20.935 -1.233) 21.197 19.395 ( 0.382 -13.669 0.496) 13.683 20.449 ( 12.144 39.852 5.020) 41.963 ======================= Grid point 28 (21/366) ======================= q-point: ( 0.55 0.18 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.919 ( -0.188 -5.140 -0.204) 5.147 0.950 ( 0.146 -9.232 -0.028) 9.234 1.261 ( 7.597 0.434 4.731) 8.961 1.385 ( -0.074 6.487 0.030) 6.488 1.589 ( -3.534 3.362 -0.836) 4.949 1.950 ( 1.325 1.665 0.240) 2.141 2.267 ( -9.561 1.713 -6.028) 11.431 2.667 ( 5.153 1.084 4.343) 6.826 3.219 ( 4.950 -24.370 7.640) 26.015 3.552 ( -5.579 -22.186 0.245) 22.878 3.743 ( 1.712 -25.702 5.035) 26.246 4.469 ( -2.665 26.232 -6.133) 27.071 5.259 ( -0.211 1.085 -2.696) 2.914 5.326 ( -0.883 6.017 -2.250) 6.484 5.592 ( -6.008 -14.140 -2.806) 15.617 6.653 ( -0.215 -7.132 3.858) 8.111 6.866 ( 1.481 -4.883 -5.196) 7.283 7.340 ( 4.255 -6.514 3.618) 8.580 7.942 ( -2.201 -1.502 0.250) 2.677 8.520 ( -0.802 -15.575 -2.493) 15.794 8.972 ( 0.696 24.860 0.425) 24.873 9.402 ( 1.515 13.505 1.338) 13.656 10.528 ( -3.068 -12.010 -0.349) 12.401 10.765 ( 3.755 -28.778 -5.056) 29.459 11.424 ( 1.738 -2.229 12.221) 12.544 11.957 ( -7.483 -32.782 -10.604) 35.258 12.844 ( -2.116 27.539 2.271) 27.714 13.047 ( 7.582 -7.053 3.199) 10.838 13.521 ( -5.303 19.942 -2.474) 20.783 14.179 ( 3.265 29.763 0.015) 29.942 15.367 ( -0.045 -15.208 -0.297) 15.211 16.483 ( -0.059 20.223 0.174) 20.224 18.955 ( -5.858 -2.459 -2.463) 6.814 19.406 ( -0.422 -12.640 0.024) 12.647 19.624 ( 1.657 -10.158 0.968) 10.338 19.908 ( 3.763 25.932 1.462) 26.245 ======================= Grid point 29 (22/366) ======================= q-point: (-0.36 0.18 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.002 ( -0.490 -4.126 -0.243) 4.162 1.111 ( 0.157 -8.450 -0.200) 8.454 1.242 ( 4.172 7.720 2.784) 9.206 1.258 ( 0.041 7.572 -0.091) 7.573 1.549 ( -2.167 -2.243 0.156) 3.123 1.924 ( 1.043 1.613 -0.131) 1.925 2.182 ( -8.005 -1.041 -5.115) 9.557 2.757 ( 5.622 -4.645 3.702) 8.179 3.669 ( 4.453 -15.847 6.245) 17.606 3.823 ( -3.541 -7.203 -1.921) 8.253 3.996 ( -2.611 14.822 -6.729) 16.486 4.129 ( 0.824 -12.865 5.308) 13.941 5.055 ( -3.041 11.905 -5.494) 13.459 5.272 ( 2.430 -0.790 2.383) 3.494 5.888 ( -3.462 -18.141 -1.684) 18.545 6.717 ( 6.389 3.592 6.389) 9.723 6.952 ( -5.477 -4.708 -6.936) 10.014 7.410 ( 2.983 2.887 2.402) 4.796 8.079 ( -1.177 -15.998 0.096) 16.041 8.511 ( 0.441 24.926 0.067) 24.930 8.790 ( -0.715 -15.337 -1.594) 15.436 9.164 ( 0.967 14.521 1.258) 14.607 10.709 ( -2.890 -10.319 -0.530) 10.729 11.101 ( 4.058 -0.594 -1.352) 4.318 11.654 ( 0.090 -26.983 4.038) 27.284 12.178 ( 0.187 30.169 -2.465) 30.270 12.609 ( -3.538 -27.448 -0.279) 27.676 13.154 ( -4.454 11.949 -0.624) 12.768 13.204 ( 2.272 -0.736 -0.095) 2.391 13.731 ( 4.438 19.864 1.321) 20.397 15.703 ( 0.040 -21.141 -0.114) 21.142 16.100 ( -0.066 22.048 0.107) 22.049 18.962 ( -4.340 -2.653 -1.948) 5.447 19.472 ( 5.250 11.276 2.353) 12.659 19.625 ( -3.832 -1.929 -1.456) 4.530 19.822 ( 1.838 -6.648 0.675) 6.930 ======================= Grid point 30 (23/366) ======================= q-point: (-0.27 0.18 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.032 ( -0.026 2.794 -0.007) 2.794 1.104 ( 0.257 6.416 0.383) 6.432 1.106 ( 0.019 8.482 -0.171) 8.484 1.262 ( 0.033 -7.514 -0.008) 7.514 1.600 ( 0.071 -2.117 0.489) 2.174 1.909 ( 0.255 0.525 -0.032) 0.585 2.180 ( -3.428 -3.958 -2.359) 5.743 2.874 ( 3.591 -2.512 2.188) 4.898 3.374 ( -0.747 27.760 -1.641) 27.819 3.910 ( 0.038 10.171 -3.262) 10.681 4.022 ( 0.225 -1.180 0.904) 1.503 4.315 ( 0.823 -14.829 4.269) 15.453 4.921 ( -1.897 -2.447 -3.112) 4.390 5.410 ( 1.155 -11.624 2.099) 11.868 6.161 ( 0.153 -13.702 -0.167) 13.704 6.627 ( 6.141 15.558 3.600) 17.110 6.890 ( -7.146 2.472 -4.340) 8.718 7.289 ( 1.021 11.462 1.124) 11.563 8.163 ( 0.610 12.707 -0.138) 12.722 8.464 ( -0.304 -25.345 -0.268) 25.348 8.898 ( 0.375 15.734 1.001) 15.770 9.049 ( -0.500 -14.263 -0.735) 14.291 10.838 ( -1.562 -4.213 -0.025) 4.493 10.978 ( 1.686 12.751 0.561) 12.874 11.552 ( -0.134 32.977 -1.157) 32.998 12.241 ( -0.087 -32.025 1.439) 32.058 12.722 ( -1.186 13.175 -0.595) 13.242 13.043 ( 2.039 16.005 -1.837) 16.238 13.362 ( -3.254 -34.492 0.410) 34.648 13.694 ( 3.645 -9.621 1.720) 10.431 15.707 ( 0.027 20.955 0.087) 20.956 16.097 ( -0.014 -22.150 -0.073) 22.151 18.977 ( -3.060 -2.059 -1.360) 3.931 19.327 ( 1.544 5.601 0.686) 5.850 19.636 ( -0.951 1.223 -0.382) 1.596 19.916 ( 1.564 -1.884 0.619) 2.526 ======================= Grid point 31 (24/366) ======================= q-point: (-0.18 0.18 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.894 ( -0.000 8.726 0.000) 8.726 0.943 ( -0.000 9.422 0.000) 9.422 1.047 ( -0.000 3.874 0.000) 3.874 1.388 ( 0.000 -6.453 -0.000) 6.453 1.584 ( -0.000 4.090 0.000) 4.090 1.910 ( 0.000 -0.284 -0.000) 0.284 2.245 ( 0.000 -4.198 -0.000) 4.198 2.864 ( -0.000 5.833 0.000) 5.833 2.866 ( -0.000 27.941 0.000) 27.941 3.548 ( -0.000 27.119 0.000) 27.119 3.816 ( -0.000 19.077 0.000) 19.077 4.709 ( 0.000 -23.951 -0.000) 23.951 5.062 ( 0.000 -11.632 -0.000) 11.632 5.630 ( 0.000 -8.255 -0.000) 8.255 6.209 ( -0.000 28.446 0.000) 28.446 6.379 ( 0.000 -9.501 -0.000) 9.501 6.844 ( 0.000 -0.363 -0.000) 0.363 7.083 ( -0.000 10.815 0.000) 10.815 8.053 ( -0.000 1.113 0.000) 1.113 8.615 ( -0.000 15.769 0.000) 15.769 8.916 ( 0.000 -23.708 -0.000) 23.708 9.297 ( 0.000 -13.857 -0.000) 13.857 10.673 ( -0.000 24.127 0.000) 24.127 10.718 ( -0.000 16.206 0.000) 16.206 11.205 ( -0.000 2.533 0.000) 2.533 12.468 ( -0.000 12.958 0.000) 12.958 12.516 ( -0.000 8.949 0.000) 8.949 12.993 ( 0.000 -17.432 -0.000) 17.432 13.987 ( 0.000 -19.722 -0.000) 19.722 13.992 ( 0.000 -34.814 -0.000) 34.814 15.378 ( -0.000 14.704 0.000) 14.704 16.481 ( 0.000 -20.231 -0.000) 20.231 18.990 ( 0.000 -1.034 -0.000) 1.034 19.282 ( -0.000 1.023 0.000) 1.023 19.553 ( -0.000 7.507 0.000) 7.507 19.908 ( -0.000 3.269 0.000) 3.269 ======================= Grid point 36 (25/366) ======================= q-point: ( 0.27 0.27 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.387 ( 1.778 -0.000 4.561) 4.895 0.575 ( 3.682 -0.000 4.286) 5.650 0.865 ( 6.998 -0.000 1.737) 7.210 0.988 ( 4.721 -0.000 12.692) 13.542 1.457 ( 22.596 -0.000 13.417) 26.280 1.631 ( -0.012 0.000 -0.166) 0.166 1.848 ( 1.522 -0.000 2.039) 2.544 1.870 ( 5.217 -0.000 2.710) 5.879 2.408 ( 9.075 -0.000 11.681) 14.792 2.446 ( 3.263 -0.000 0.528) 3.305 3.614 ( -0.214 0.000 -4.580) 4.585 3.762 ( -4.702 0.000 6.120) 7.717 5.520 ( -0.583 0.000 0.207) 0.618 5.680 ( -5.129 0.000 -3.589) 6.260 6.177 ( -3.022 0.000 -4.023) 5.031 6.308 ( -4.895 0.000 0.853) 4.969 6.493 ( -1.651 0.000 -6.867) 7.063 6.833 ( -5.697 0.000 -1.421) 5.871 7.579 ( -0.968 0.000 -3.560) 3.689 8.393 ( -2.307 0.000 -4.525) 5.079 9.404 ( -0.608 0.000 2.373) 2.450 9.586 ( 1.433 -0.000 -1.193) 1.865 9.707 ( 1.337 -0.000 3.810) 4.038 9.937 ( 3.002 -0.000 1.330) 3.283 10.271 ( 1.442 -0.000 -0.190) 1.454 11.718 ( 2.042 -0.000 1.677) 2.642 12.500 ( 14.337 -0.000 7.865) 16.352 13.273 ( -0.055 0.000 0.017) 0.058 15.149 ( -4.331 0.000 -4.339) 6.131 15.419 ( -0.802 0.000 0.239) 0.837 15.716 ( 0.058 -0.000 -1.352) 1.353 17.292 ( 0.087 -0.000 -0.178) 0.198 17.609 ( -0.184 0.000 -0.036) 0.188 18.808 ( 0.050 -0.000 0.234) 0.240 19.023 ( -9.659 0.000 -2.788) 10.053 22.431 ( 1.423 -0.000 1.411) 2.004 ======================= Grid point 37 (26/366) ======================= q-point: ( 0.36 0.27 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.475 ( 0.612 -6.423 1.015) 6.532 0.666 ( 0.788 -5.158 1.288) 5.375 0.967 ( 6.894 -5.341 3.043) 9.237 1.401 ( 3.396 -32.872 11.318) 34.931 1.615 ( -0.052 1.687 0.079) 1.689 1.643 ( 16.457 -2.221 9.266) 19.016 1.862 ( 4.308 0.134 1.226) 4.481 2.120 ( -1.002 -20.244 1.266) 20.308 2.481 ( 2.301 -1.416 1.192) 2.953 2.578 ( 7.668 -8.859 8.891) 14.708 3.430 ( 1.965 18.913 3.470) 19.329 3.863 ( -3.543 -16.716 -0.262) 17.089 5.500 ( -0.408 1.898 0.729) 2.074 5.643 ( -6.145 0.819 -3.758) 7.250 5.917 ( -1.585 16.599 -5.323) 17.503 6.416 ( -3.623 -5.960 -5.329) 8.778 6.582 ( -3.117 -12.778 1.696) 13.261 6.798 ( -4.446 -0.569 -1.305) 4.669 7.655 ( -0.666 -9.306 -4.499) 10.358 8.329 ( -1.859 4.006 -3.344) 5.540 9.464 ( 0.724 -6.017 -0.665) 6.097 9.700 ( 1.593 1.924 2.615) 3.616 9.876 ( -5.281 -25.527 -0.572) 26.074 10.025 ( 1.243 -9.333 0.400) 9.423 10.220 ( 0.840 6.272 1.031) 6.412 11.711 ( 1.731 2.429 1.107) 3.181 12.644 ( 13.063 -3.233 6.902) 15.124 13.307 ( -0.141 -3.238 0.086) 3.242 14.842 ( -3.124 24.464 -3.170) 24.865 15.370 ( -1.456 5.528 1.657) 5.952 15.573 ( 1.128 14.995 -2.526) 15.248 17.235 ( -0.007 6.274 0.100) 6.275 17.943 ( -2.912 -31.880 -1.302) 32.039 18.886 ( -1.904 -6.876 -0.769) 7.176 18.973 ( -7.000 -3.416 -1.729) 7.979 22.071 ( 7.923 37.919 3.540) 38.899 ======================= Grid point 38 (27/366) ======================= q-point: ( 0.45 0.27 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.616 ( 0.254 -8.640 0.095) 8.644 0.754 ( 0.268 -4.302 0.355) 4.325 1.134 ( 6.342 -6.577 3.427) 9.758 1.566 ( -0.040 3.484 -0.015) 3.484 1.732 ( 7.479 3.499 3.059) 8.805 1.895 ( 1.283 -3.593 4.476) 5.881 2.124 ( 3.794 -36.564 5.655) 37.192 2.383 ( -1.336 -1.314 -2.381) 3.030 2.629 ( -2.914 -21.456 2.852) 21.840 2.870 ( 5.414 -16.162 6.270) 18.161 3.105 ( 2.314 18.213 4.272) 18.850 4.276 ( -3.610 -30.593 -2.018) 30.871 5.388 ( -1.897 17.603 -2.288) 17.852 5.487 ( -1.086 5.167 -1.561) 5.506 5.698 ( -3.220 4.367 -4.148) 6.830 6.435 ( -2.376 -1.846 -5.039) 5.869 6.793 ( -1.460 -1.733 -0.983) 2.470 6.865 ( -1.558 -17.513 4.340) 18.110 7.842 ( -0.314 -11.733 -4.121) 12.440 8.230 ( -1.274 3.967 -1.699) 4.500 9.529 ( 0.798 3.750 0.823) 3.921 9.724 ( 1.276 -3.890 0.819) 4.175 10.093 ( 3.092 4.172 -4.281) 6.730 10.127 ( -0.396 -9.614 0.515) 9.636 10.478 ( -10.043 -36.239 3.125) 37.734 11.666 ( 1.022 3.472 -0.669) 3.680 12.816 ( 10.476 -5.080 5.164) 12.737 13.349 ( -0.442 0.036 0.382) 0.585 14.345 ( -2.832 26.247 -2.301) 26.500 15.208 ( -4.034 23.221 12.971) 26.902 15.245 ( 4.574 8.078 -13.502) 16.385 17.071 ( -0.028 11.825 0.159) 11.826 18.521 ( -4.378 -32.539 -1.742) 32.879 18.904 ( -6.230 -2.463 -2.274) 7.075 19.140 ( -0.444 -13.943 0.204) 13.952 21.352 ( 9.969 47.412 4.100) 48.622 ======================= Grid point 39 (28/366) ======================= q-point: ( 0.55 0.27 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.781 ( 0.146 -9.386 -0.093) 9.387 0.834 ( 0.106 -4.467 0.160) 4.471 1.288 ( 6.464 -4.536 3.655) 8.701 1.489 ( -0.053 5.079 0.019) 5.080 1.655 ( -1.107 6.485 -0.333) 6.588 1.966 ( 1.480 -1.429 1.214) 2.389 2.282 ( -4.368 6.232 -3.229) 8.267 2.739 ( 3.017 -16.508 4.734) 17.437 2.859 ( 3.541 -2.456 3.658) 5.652 3.079 ( -4.826 -25.611 1.819) 26.125 3.291 ( 2.406 -24.916 3.132) 25.227 4.777 ( -2.952 -13.876 -1.497) 14.265 5.006 ( -1.663 7.724 -4.697) 9.192 5.418 ( 0.750 4.295 0.832) 4.438 5.578 ( -3.050 6.583 -3.313) 7.976 6.484 ( -1.485 -7.157 -1.818) 7.532 6.824 ( 0.477 -2.284 -0.692) 2.434 7.175 ( 1.328 -14.761 2.999) 15.121 7.950 ( -0.863 0.382 -1.049) 1.411 8.259 ( -0.524 -10.407 -1.862) 10.585 9.354 ( 0.530 15.958 0.911) 15.993 9.650 ( 1.046 12.098 0.580) 12.157 10.282 ( 1.206 -22.331 -0.485) 22.368 10.308 ( -0.079 -11.210 -2.746) 11.541 11.105 ( -5.855 -37.573 5.585) 38.434 11.605 ( -0.340 2.276 -4.626) 5.167 12.985 ( 6.942 -5.894 3.128) 9.629 13.232 ( -0.909 14.200 0.813) 14.253 13.876 ( -2.663 23.226 -1.772) 23.446 14.728 ( 1.163 29.114 0.373) 29.139 15.194 ( 0.007 -3.173 -0.695) 3.248 16.815 ( -0.034 16.588 0.127) 16.589 18.857 ( -5.075 -5.239 -1.905) 7.538 19.062 ( -2.048 -21.894 -0.796) 22.004 19.401 ( 0.213 -14.468 0.265) 14.472 20.590 ( 6.003 42.876 2.446) 43.363 ======================= Grid point 40 (29/366) ======================= q-point: ( 0.64 0.27 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.916 ( -0.092 -4.846 -0.095) 4.848 0.951 ( 0.050 -9.199 -0.001) 9.200 1.384 ( 0.324 6.180 0.577) 6.215 1.393 ( 7.584 0.943 3.633) 8.462 1.514 ( -6.262 4.368 -2.512) 8.038 1.965 ( 0.637 1.834 0.087) 1.943 2.147 ( -3.981 3.624 -2.546) 5.955 2.734 ( 2.038 -0.153 1.719) 2.671 3.297 ( 2.027 -24.439 3.056) 24.712 3.497 ( -2.131 -22.334 -0.367) 22.438 3.780 ( 0.593 -25.502 2.372) 25.619 4.418 ( -1.147 26.982 -2.422) 27.115 5.218 ( -1.445 1.343 -2.117) 2.893 5.339 ( 1.295 4.940 -0.249) 5.113 5.526 ( -2.349 -13.745 -0.612) 13.957 6.660 ( -0.379 -11.727 1.170) 11.792 6.865 ( 0.793 -1.500 -1.693) 2.397 7.392 ( 1.518 -7.069 1.287) 7.344 7.922 ( -0.823 -1.409 0.098) 1.635 8.503 ( -0.291 -15.553 -0.936) 15.584 8.980 ( 0.247 25.085 0.132) 25.087 9.421 ( 0.561 13.448 0.506) 13.469 10.498 ( -1.095 -11.215 -0.158) 11.269 10.782 ( 1.407 -29.457 -1.888) 29.551 11.500 ( 1.305 1.484 6.645) 6.933 11.833 ( -3.407 -38.761 -5.878) 39.352 12.831 ( -0.782 28.448 0.645) 28.466 13.133 ( 2.957 -5.942 1.265) 6.757 13.464 ( -1.874 20.708 -0.831) 20.809 14.210 ( 1.201 28.709 0.037) 28.734 15.366 ( -0.015 -15.293 -0.108) 15.294 16.483 ( -0.025 20.233 0.064) 20.233 18.889 ( -2.319 -2.792 -0.969) 3.757 19.394 ( -0.631 -14.961 -0.171) 14.976 19.644 ( 0.636 -11.461 0.339) 11.484 19.953 ( 1.641 30.116 0.651) 30.168 ======================= Grid point 41 (30/366) ======================= q-point: (-0.27 0.27 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.998 ( 0.000 -4.043 -0.000) 4.043 1.112 ( 0.000 -8.457 -0.000) 8.457 1.257 ( -0.000 7.587 0.000) 7.587 1.285 ( -0.000 10.709 0.000) 10.709 1.530 ( 0.000 -4.900 -0.000) 4.900 1.933 ( -0.000 1.761 0.000) 1.761 2.109 ( 0.000 -1.397 -0.000) 1.397 2.807 ( 0.000 -5.392 -0.000) 5.392 3.734 ( 0.000 -22.824 -0.000) 22.824 3.780 ( -0.000 0.524 0.000) 0.524 3.956 ( -0.000 14.447 0.000) 14.447 4.150 ( 0.000 -13.355 -0.000) 13.355 5.018 ( -0.000 12.285 0.000) 12.285 5.295 ( 0.000 -1.067 -0.000) 1.067 5.860 ( 0.000 -18.856 -0.000) 18.856 6.831 ( 0.000 -5.150 -0.000) 5.150 6.843 ( -0.000 4.469 0.000) 4.469 7.437 ( -0.000 3.137 0.000) 3.137 8.071 ( 0.000 -16.256 -0.000) 16.256 8.514 ( -0.000 24.865 0.000) 24.865 8.781 ( 0.000 -15.317 -0.000) 15.317 9.174 ( -0.000 14.547 0.000) 14.547 10.688 ( 0.000 -10.105 -0.000) 10.105 11.126 ( 0.000 -1.245 -0.000) 1.245 11.666 ( 0.000 -25.961 -0.000) 25.961 12.172 ( -0.000 29.904 0.000) 29.904 12.583 ( 0.000 -29.716 -0.000) 29.716 13.120 ( -0.000 14.640 0.000) 14.640 13.221 ( 0.000 -0.323 -0.000) 0.323 13.766 ( -0.000 18.099 0.000) 18.099 15.703 ( 0.000 -21.202 -0.000) 21.202 16.099 ( -0.000 22.084 0.000) 22.084 18.926 ( 0.000 -2.388 -0.000) 2.388 19.524 ( -0.000 16.284 0.000) 16.284 19.585 ( 0.000 -6.503 -0.000) 6.503 19.837 ( 0.000 -7.322 -0.000) 7.322 ======================= Grid point 48 (31/366) ======================= q-point: ( 0.36 0.36 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.419 ( 0.803 -0.000 1.899) 2.062 0.620 ( 1.135 -0.000 1.942) 2.250 0.961 ( 5.361 -0.000 1.735) 5.635 1.104 ( 3.490 -0.000 9.346) 9.976 1.630 ( -0.023 0.000 -0.128) 0.130 1.751 ( 12.384 -0.000 6.722) 14.091 1.880 ( 1.613 -0.000 1.381) 2.124 1.961 ( 6.225 -0.000 3.139) 6.972 2.499 ( 3.711 -0.000 0.975) 3.837 2.574 ( 6.907 -0.000 9.246) 11.541 3.598 ( 0.316 -0.000 -1.797) 1.825 3.719 ( -5.233 0.000 3.245) 6.158 5.512 ( -0.790 0.000 0.228) 0.822 5.597 ( -4.321 0.000 -3.037) 5.281 6.122 ( -2.237 0.000 -3.041) 3.775 6.255 ( -3.107 0.000 0.029) 3.107 6.438 ( -1.816 0.000 -4.797) 5.129 6.759 ( -4.146 0.000 -1.241) 4.327 7.551 ( -0.638 0.000 -2.642) 2.718 8.346 ( -1.621 0.000 -3.162) 3.553 9.408 ( -0.275 0.000 1.381) 1.408 9.599 ( 1.107 -0.000 -0.675) 1.297 9.740 ( 0.973 -0.000 2.589) 2.766 9.979 ( 2.178 -0.000 0.959) 2.380 10.288 ( 1.101 -0.000 -0.148) 1.111 11.751 ( 1.532 -0.000 1.613) 2.225 12.713 ( 11.121 -0.000 5.915) 12.596 13.273 ( -0.043 0.000 0.014) 0.045 15.075 ( -3.361 0.000 -3.407) 4.786 15.410 ( -0.617 0.000 0.187) 0.645 15.710 ( -0.062 0.000 -0.766) 0.769 17.292 ( 0.020 -0.000 -0.023) 0.031 17.606 ( -0.200 0.000 -0.043) 0.204 18.808 ( -0.386 0.000 -0.189) 0.430 18.892 ( -7.295 0.000 -1.889) 7.535 22.455 ( 1.198 -0.000 0.751) 1.414 ======================= Grid point 49 (32/366) ======================= q-point: ( 0.45 0.36 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.485 ( 0.300 -5.820 0.456) 5.846 0.678 ( 0.349 -4.304 0.596) 4.359 1.053 ( 3.851 -5.881 1.614) 7.213 1.485 ( 1.919 -32.417 6.527) 33.123 1.614 ( -0.050 1.696 -0.074) 1.698 1.843 ( 7.453 -1.293 4.086) 8.597 1.920 ( 3.326 2.547 0.957) 4.298 2.122 ( 0.498 -16.796 0.771) 16.821 2.513 ( 1.862 1.116 0.573) 2.245 2.706 ( 4.679 -7.806 6.129) 10.973 3.459 ( 0.170 15.671 2.666) 15.897 3.819 ( -2.256 -16.333 -0.836) 16.509 5.499 ( -0.398 1.111 0.779) 1.414 5.558 ( -3.642 1.741 -2.751) 4.885 5.877 ( -0.962 16.550 -3.098) 16.865 6.354 ( -2.159 -5.375 -2.941) 6.496 6.553 ( -1.943 -14.339 0.664) 14.485 6.746 ( -2.408 -1.479 -0.860) 2.954 7.629 ( -0.337 -9.129 -2.485) 9.468 8.296 ( -1.018 3.569 -1.839) 4.142 9.470 ( 0.440 -6.162 -0.373) 6.189 9.729 ( 0.930 1.983 1.509) 2.660 9.827 ( -2.075 -22.336 0.002) 22.432 10.045 ( 1.060 -6.400 0.366) 6.498 10.234 ( 0.601 6.410 0.398) 6.450 11.736 ( 1.035 2.883 0.894) 3.191 12.818 ( 7.884 -2.870 4.075) 9.327 13.305 ( -0.079 -3.158 0.039) 3.159 14.795 ( -1.826 23.805 -1.948) 23.954 15.361 ( -0.790 5.481 0.818) 5.598 15.574 ( 0.509 14.488 -1.216) 14.548 17.235 ( -0.011 6.261 0.074) 6.261 17.908 ( -1.538 -29.400 -0.654) 29.448 18.826 ( -4.414 -1.657 -1.602) 4.980 18.922 ( -1.072 -8.866 0.046) 8.931 22.155 ( 3.215 32.379 1.382) 32.568 ======================= Grid point 50 (33/366) ======================= q-point: ( 0.55 0.36 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.619 ( 0.091 -8.534 0.031) 8.534 0.758 ( 0.125 -4.234 0.136) 4.238 1.207 ( 2.443 -7.784 1.224) 8.250 1.566 ( -0.016 3.496 -0.009) 3.496 1.804 ( 2.089 8.806 0.551) 9.067 1.932 ( 1.059 -3.825 1.965) 4.428 2.180 ( 1.295 -37.026 2.232) 37.116 2.362 ( -0.471 1.150 -0.935) 1.555 2.607 ( -1.223 -20.378 0.542) 20.422 2.947 ( 2.046 -15.248 2.735) 15.626 3.142 ( 0.743 18.643 1.812) 18.745 4.236 ( -1.169 -29.977 -0.770) 30.009 5.354 ( -1.242 19.149 -1.094) 19.220 5.478 ( 0.089 2.090 -0.473) 2.145 5.652 ( -1.204 5.631 -1.471) 5.943 6.394 ( -0.913 -2.361 -1.892) 3.160 6.773 ( -0.797 -2.984 -0.173) 3.093 6.868 ( -0.362 -19.141 1.371) 19.193 7.824 ( -0.113 -11.790 -1.521) 11.889 8.212 ( -0.448 3.751 -0.590) 3.823 9.539 ( 0.285 3.254 0.251) 3.277 9.739 ( 0.484 -3.547 0.323) 3.595 10.107 ( 1.616 4.237 -2.567) 5.211 10.125 ( -0.517 -9.499 0.941) 9.559 10.404 ( -3.191 -34.376 1.502) 34.556 11.675 ( 0.424 4.334 -0.078) 4.355 12.934 ( 3.943 -4.612 1.919) 6.364 13.346 ( -0.155 0.204 0.129) 0.287 14.312 ( -0.953 26.692 -0.836) 26.722 15.219 ( -3.096 23.581 9.167) 25.489 15.237 ( 3.265 7.170 -9.335) 12.215 17.072 ( -0.011 11.827 0.060) 11.827 18.473 ( -1.682 -31.438 -0.648) 31.489 18.836 ( -2.351 -3.304 -0.852) 4.144 19.137 ( -0.135 -14.252 0.076) 14.253 21.450 ( 2.998 46.107 1.216) 46.221 ======================= Grid point 51 (34/366) ======================= q-point: ( 0.64 0.36 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.782 ( 0.000 -9.360 -0.000) 9.360 0.835 ( 0.000 -4.360 -0.000) 4.360 1.348 ( 0.000 -6.299 -0.000) 6.299 1.489 ( -0.000 5.086 0.000) 5.086 1.641 ( -0.000 9.368 0.000) 9.368 1.980 ( 0.000 -0.819 -0.000) 0.819 2.242 ( -0.000 7.753 0.000) 7.753 2.772 ( 0.000 -15.577 -0.000) 15.577 2.893 ( 0.000 -3.403 -0.000) 3.403 3.050 ( 0.000 -25.854 -0.000) 25.854 3.317 ( 0.000 -24.324 -0.000) 24.324 4.753 ( 0.000 -14.070 -0.000) 14.070 4.982 ( -0.000 8.374 0.000) 8.374 5.426 ( -0.000 3.936 0.000) 3.936 5.547 ( -0.000 6.785 0.000) 6.785 6.468 ( 0.000 -7.602 -0.000) 7.602 6.826 ( 0.000 -2.931 -0.000) 2.931 7.192 ( 0.000 -15.528 -0.000) 15.528 7.941 ( -0.000 0.402 0.000) 0.402 8.250 ( 0.000 -10.392 -0.000) 10.392 9.360 ( -0.000 16.040 0.000) 16.040 9.658 ( -0.000 11.991 0.000) 11.991 10.289 ( 0.000 -22.707 -0.000) 22.707 10.299 ( 0.000 -10.390 -0.000) 10.390 11.080 ( 0.000 -40.433 -0.000) 40.433 11.593 ( -0.000 4.792 0.000) 4.792 13.042 ( 0.000 -5.523 -0.000) 5.523 13.227 ( -0.000 14.436 0.000) 14.436 13.853 ( -0.000 23.573 0.000) 23.573 14.737 ( -0.000 28.825 0.000) 28.825 15.192 ( 0.000 -3.246 -0.000) 3.246 16.815 ( -0.000 16.593 0.000) 16.593 18.816 ( 0.000 -5.538 -0.000) 5.538 19.046 ( 0.000 -22.091 -0.000) 22.091 19.403 ( 0.000 -14.764 -0.000) 14.764 20.637 ( -0.000 43.584 0.000) 43.584 ======================= Grid point 61 (35/366) ======================= q-point: ( 0.45 0.45 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.432 ( 0.233 -0.000 0.521) 0.570 0.635 ( 0.270 -0.000 0.565) 0.626 1.017 ( 1.882 -0.000 0.662) 1.995 1.171 ( 1.271 -0.000 3.377) 3.609 1.629 ( -0.011 0.000 -0.047) 0.049 1.864 ( 2.667 -0.000 1.434) 3.028 1.901 ( 0.696 -0.000 0.493) 0.853 2.052 ( 3.740 -0.000 1.712) 4.113 2.545 ( 1.923 -0.000 0.624) 2.022 2.675 ( 2.599 -0.000 3.529) 4.382 3.605 ( 1.289 -0.000 -0.016) 1.289 3.666 ( -3.501 0.000 0.582) 3.549 5.504 ( -0.381 0.000 0.079) 0.389 5.543 ( -1.712 0.000 -1.216) 2.100 6.090 ( -0.803 0.000 -1.117) 1.375 6.227 ( -1.026 0.000 -0.110) 1.032 6.402 ( -0.794 0.000 -1.705) 1.881 6.715 ( -1.509 0.000 -0.483) 1.584 7.536 ( -0.218 0.000 -0.968) 0.992 8.319 ( -0.577 0.000 -1.122) 1.262 9.411 ( -0.078 0.000 0.460) 0.466 9.607 ( 0.414 -0.000 -0.215) 0.467 9.759 ( 0.353 -0.000 0.912) 0.977 10.003 ( 0.789 -0.000 0.346) 0.862 10.298 ( 0.411 -0.000 -0.056) 0.415 11.772 ( 0.575 -0.000 0.655) 0.872 12.841 ( 4.203 -0.000 2.195) 4.741 13.272 ( -0.016 0.000 0.005) 0.017 15.030 ( -1.266 0.000 -1.293) 1.810 15.405 ( -0.231 0.000 0.071) 0.242 15.707 ( -0.037 0.000 -0.251) 0.254 17.292 ( 0.002 -0.000 0.006) 0.006 17.604 ( -0.092 0.000 -0.021) 0.095 18.786 ( -1.839 0.000 -0.776) 1.996 18.832 ( -1.108 0.000 -0.030) 1.108 22.469 ( 0.460 -0.000 0.238) 0.518 ======================= Grid point 62 (36/366) ======================= q-point: ( 0.55 0.45 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.488 ( 0.000 -5.654 -0.000) 5.654 0.682 ( 0.000 -4.125 -0.000) 4.125 1.083 ( 0.000 -6.106 -0.000) 6.106 1.516 ( 0.000 -32.275 -0.000) 32.275 1.613 ( -0.000 1.774 0.000) 1.774 1.897 ( 0.000 -2.580 -0.000) 2.580 1.948 ( -0.000 3.538 0.000) 3.538 2.132 ( 0.000 -14.268 -0.000) 14.268 2.529 ( -0.000 2.387 0.000) 2.387 2.755 ( 0.000 -7.465 -0.000) 7.465 3.467 ( -0.000 14.802 0.000) 14.802 3.801 ( 0.000 -16.610 -0.000) 16.610 5.499 ( -0.000 0.566 0.000) 0.566 5.525 ( -0.000 2.221 0.000) 2.221 5.862 ( -0.000 16.582 0.000) 16.582 6.331 ( 0.000 -5.085 -0.000) 5.085 6.542 ( 0.000 -14.850 -0.000) 14.850 6.727 ( 0.000 -1.902 -0.000) 1.902 7.620 ( 0.000 -9.061 -0.000) 9.061 8.284 ( -0.000 3.408 0.000) 3.408 9.472 ( 0.000 -6.217 -0.000) 6.217 9.739 ( -0.000 2.117 0.000) 2.117 9.814 ( 0.000 -21.211 -0.000) 21.211 10.053 ( 0.000 -5.811 -0.000) 5.811 10.239 ( -0.000 6.435 0.000) 6.435 11.746 ( -0.000 3.033 0.000) 3.033 12.883 ( 0.000 -2.730 -0.000) 2.730 13.305 ( 0.000 -3.128 -0.000) 3.128 14.777 ( -0.000 23.496 0.000) 23.496 15.358 ( -0.000 5.470 0.000) 5.470 15.574 ( -0.000 14.308 0.000) 14.308 17.235 ( -0.000 6.256 0.000) 6.256 17.896 ( 0.000 -28.516 -0.000) 28.516 18.789 ( 0.000 -1.274 -0.000) 1.274 18.917 ( 0.000 -9.354 -0.000) 9.354 22.179 ( -0.000 30.835 0.000) 30.835 ======================= Grid point 125 (37/366) ======================= q-point: ( 0.00 0.00 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.370 ( 23.485 -0.000 18.376) 29.820 0.509 ( -2.611 0.000 23.215) 23.362 0.715 ( -3.485 0.000 30.664) 30.861 0.742 ( -0.973 0.000 1.786) 2.034 1.633 ( -0.036 0.000 -0.139) 0.144 1.699 ( -7.196 0.000 2.114) 7.501 1.889 ( 1.211 -0.000 9.169) 9.249 2.064 ( -37.560 0.000 13.222) 39.819 2.234 ( -2.630 0.000 19.600) 19.776 2.528 ( -7.391 0.000 15.297) 16.989 2.714 ( 43.535 -0.000 4.717) 43.790 3.864 ( -3.215 0.000 16.168) 16.485 5.764 ( -5.650 0.000 5.805) 8.101 5.786 ( -0.074 0.000 -5.614) 5.615 6.195 ( 7.562 -0.000 -19.014) 20.463 6.297 ( -4.008 0.000 -0.146) 4.010 6.660 ( -4.702 0.000 -0.054) 4.702 7.094 ( -1.729 0.000 -4.199) 4.541 7.732 ( -5.815 0.000 8.166) 10.025 8.433 ( -0.490 0.000 -7.131) 7.148 9.579 ( -1.637 0.000 3.103) 3.508 9.748 ( -1.635 0.000 8.832) 8.982 9.812 ( 2.124 -0.000 -2.393) 3.199 10.229 ( -0.473 0.000 0.691) 0.838 11.218 ( -56.946 0.000 2.263) 56.991 11.540 ( -3.786 0.000 0.481) 3.817 12.079 ( 4.465 -0.000 5.170) 6.831 13.326 ( -1.682 0.000 4.942) 5.220 15.126 ( -8.144 0.000 -17.790) 19.565 15.301 ( 5.636 -0.000 -13.798) 14.904 15.534 ( 5.260 -0.000 -6.309) 8.214 17.553 ( 2.431 -0.000 -6.232) 6.689 18.292 ( -76.767 0.000 13.522) 77.949 18.891 ( -3.139 0.000 8.712) 9.260 19.288 ( -1.550 0.000 -1.395) 2.085 20.036 ( 142.957 -0.000 -2.548) 142.980 ======================= Grid point 126 (38/366) ======================= q-point: ( 0.09 0.00 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.520 ( 0.315 -2.573 10.110) 10.438 0.652 ( 14.663 -5.864 13.056) 20.490 0.743 ( -2.991 -1.009 3.230) 4.516 0.981 ( 2.856 -13.815 20.054) 24.518 1.387 ( -0.190 -2.145 19.300) 19.419 1.613 ( -0.025 2.340 -0.060) 2.341 1.898 ( -3.356 -4.840 10.715) 12.227 2.185 ( 5.339 -12.811 5.091) 14.783 2.456 ( 3.591 -5.985 9.796) 12.028 2.601 ( -6.421 -8.611 19.551) 22.308 3.004 ( 5.066 -6.382 6.078) 10.165 4.140 ( -7.152 -26.053 16.129) 31.465 5.614 ( -3.280 7.052 7.422) 10.751 5.868 ( -2.049 0.453 -6.920) 7.231 5.954 ( -2.345 12.368 -7.900) 14.862 6.411 ( 0.760 -6.153 -8.891) 10.839 6.646 ( 0.104 -1.465 -6.933) 7.087 7.043 ( -3.782 0.931 0.672) 3.952 7.787 ( -5.591 -7.328 5.355) 10.660 8.368 ( -0.786 4.208 -7.477) 8.616 9.414 ( -0.434 5.839 0.132) 5.856 9.709 ( -0.991 3.537 7.803) 8.625 9.920 ( 1.659 -8.951 -1.033) 9.162 10.098 ( 0.128 8.850 -3.254) 9.430 11.217 ( -29.901 -18.244 6.435) 35.613 11.672 ( -17.637 -15.834 0.172) 23.703 12.162 ( 8.359 -2.910 5.812) 10.588 13.347 ( -0.529 -1.228 2.576) 2.902 14.887 ( -8.838 13.744 -18.705) 24.838 15.095 ( 9.607 17.946 -21.204) 29.393 15.629 ( -0.273 -2.772 5.106) 5.816 17.422 ( -4.526 9.612 9.079) 13.975 18.352 ( -27.812 -29.862 3.730) 40.978 18.957 ( -2.058 -6.826 5.672) 9.110 19.251 ( -2.074 1.445 -1.411) 2.895 20.419 ( 84.147 32.806 -8.169) 90.684 ======================= Grid point 127 (39/366) ======================= q-point: ( 0.18 0.00 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.572 ( 1.370 -4.089 -1.452) 4.550 0.757 ( 1.402 -2.031 1.983) 3.166 0.884 ( 5.489 -7.328 8.439) 12.451 1.373 ( 7.295 -15.852 8.406) 19.369 1.554 ( 0.798 3.158 -0.975) 3.400 1.683 ( 6.873 -16.057 0.483) 17.473 2.049 ( -0.041 -11.337 7.311) 13.490 2.512 ( 5.518 -16.447 6.616) 18.567 2.541 ( 8.173 2.369 8.222) 11.833 2.821 ( -2.323 -13.319 15.524) 20.586 3.215 ( -12.457 -18.774 17.395) 28.464 4.669 ( -12.556 -33.781 13.369) 38.439 5.429 ( 0.285 17.407 0.385) 17.414 5.602 ( -3.090 11.914 -1.487) 12.397 5.879 ( -6.919 0.875 -4.993) 8.577 6.463 ( -0.475 -2.822 -8.718) 9.175 6.683 ( 4.667 -3.494 -8.385) 10.212 7.021 ( -2.988 -0.517 2.399) 3.866 7.926 ( -2.887 -8.761 2.370) 9.524 8.273 ( -1.566 1.978 -3.558) 4.362 9.422 ( 3.238 -2.876 -8.550) 9.584 9.658 ( 0.692 1.749 2.515) 3.141 9.903 ( 1.675 12.058 -5.108) 13.202 10.129 ( 0.185 -13.398 -1.492) 13.482 11.310 ( -1.282 -2.340 2.757) 3.836 11.862 ( -27.395 -21.294 10.953) 36.386 12.323 ( 10.001 -6.486 5.429) 13.098 13.318 ( 3.337 6.938 -7.731) 10.910 14.473 ( -9.047 19.185 -16.358) 26.786 14.791 ( 7.638 14.231 -16.890) 23.369 15.604 ( -6.341 6.009 18.500) 20.459 17.220 ( -5.181 12.852 12.346) 18.559 18.754 ( -7.840 -25.605 -3.178) 26.966 19.110 ( -0.919 -8.879 -0.959) 8.978 19.214 ( -2.661 -0.697 -1.450) 3.110 20.250 ( 42.720 28.825 -1.720) 51.564 ======================= Grid point 128 (40/366) ======================= q-point: ( 0.27 0.00 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.692 ( 3.256 -8.104 -6.800) 11.069 0.824 ( 0.999 -4.136 0.997) 4.371 1.046 ( 4.676 -4.806 5.630) 8.756 1.446 ( 1.853 5.576 -4.273) 7.265 1.630 ( 1.105 -4.958 6.829) 8.511 1.911 ( 1.763 -5.233 1.308) 5.675 2.320 ( 4.395 -11.148 -6.440) 13.604 2.568 ( 7.250 0.137 8.439) 11.126 2.854 ( -2.743 -17.289 16.564) 24.100 3.160 ( -0.579 -23.552 2.150) 23.657 3.577 ( -12.319 -23.861 19.513) 33.194 5.006 ( -1.832 23.825 -1.152) 23.923 5.156 ( -7.961 -17.236 4.637) 19.544 5.454 ( -3.031 2.660 -3.611) 5.413 5.780 ( -8.593 0.380 0.886) 8.647 6.511 ( -0.733 -7.140 -7.157) 10.136 6.760 ( 4.627 -1.302 -1.000) 4.909 7.050 ( 1.486 -3.590 -0.434) 3.909 7.986 ( 0.440 0.964 -3.962) 4.101 8.348 ( -3.412 -11.991 4.429) 13.230 9.316 ( 1.479 15.612 -0.438) 15.688 9.637 ( -1.151 10.814 6.778) 12.814 9.857 ( 9.036 -16.733 -26.717) 32.794 10.380 ( -1.898 -15.359 -2.219) 15.634 11.311 ( 7.215 4.175 -2.216) 8.626 12.132 ( -20.920 -21.907 17.752) 35.110 12.555 ( 8.002 -10.634 5.947) 14.577 13.052 ( 8.194 21.432 -23.146) 32.592 14.025 ( -8.136 19.215 -13.810) 25.022 14.625 ( -0.158 7.452 4.219) 8.565 15.482 ( -8.192 5.381 22.827) 24.843 16.950 ( -5.030 17.081 12.476) 21.742 19.094 ( 0.726 -13.060 -3.073) 13.436 19.145 ( -4.495 -2.985 -3.820) 6.611 19.335 ( 2.515 -10.088 -4.873) 11.483 19.994 ( 19.570 21.380 -3.298) 29.171 ======================= Grid point 129 (41/366) ======================= q-point: ( 0.36 0.00 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.852 ( 3.530 -9.074 -7.997) 12.600 0.919 ( 0.379 -5.511 -0.089) 5.525 1.144 ( 4.400 -1.093 3.677) 5.837 1.328 ( 2.195 7.370 -5.824) 9.647 1.667 ( -2.061 1.150 3.890) 4.550 1.954 ( -0.254 0.363 3.470) 3.498 2.412 ( 0.431 -2.449 -3.004) 3.900 2.619 ( -2.119 0.165 3.524) 4.116 3.252 ( -0.274 -22.760 16.365) 28.034 3.617 ( -0.474 -25.582 -2.980) 25.759 3.960 ( -8.704 -19.804 17.745) 27.979 4.518 ( -2.655 26.816 -1.558) 26.992 5.181 ( 3.128 6.651 -2.882) 7.895 5.327 ( -3.424 9.821 -8.532) 13.452 5.911 ( -13.614 -17.559 7.972) 23.605 6.679 ( 0.832 -6.410 3.795) 7.496 6.793 ( 2.046 -5.785 -2.132) 6.496 7.157 ( 5.940 -5.036 -4.039) 8.772 7.964 ( 0.396 -1.422 -4.653) 4.881 8.589 ( -2.458 -12.835 4.343) 13.771 8.955 ( 0.835 22.461 0.708) 22.487 9.437 ( -1.796 11.936 8.294) 14.645 10.257 ( 11.809 -25.985 -32.426) 43.199 10.632 ( -3.386 -15.348 -3.434) 16.088 11.260 ( 9.410 5.582 -8.125) 13.628 12.286 ( 5.122 14.588 -13.834) 20.747 12.669 ( 5.303 -1.917 -3.646) 6.714 12.922 ( -6.772 -18.396 13.647) 23.886 13.621 ( -8.441 15.511 -10.541) 20.566 14.414 ( -7.645 19.625 28.029) 35.060 15.526 ( -5.685 -10.728 15.628) 19.790 16.609 ( -4.889 20.553 12.108) 24.350 19.102 ( -5.367 -1.157 -2.521) 6.041 19.297 ( 7.469 -2.648 -1.534) 8.072 19.509 ( 4.666 -7.920 -7.746) 12.021 19.764 ( 4.198 10.172 -8.136) 13.685 ======================= Grid point 130 (42/366) ======================= q-point: ( 0.45 0.00 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.007 ( 0.665 -5.435 -2.967) 6.227 1.019 ( 2.372 -7.157 -5.496) 9.330 1.155 ( 3.298 3.600 -0.318) 4.893 1.189 ( 2.593 7.428 -5.560) 9.634 1.633 ( -1.827 0.978 4.420) 4.882 1.946 ( -1.445 0.458 3.844) 4.132 2.414 ( -8.717 -0.826 -3.600) 9.468 2.621 ( 4.628 -0.423 6.182) 7.734 3.684 ( 0.472 -16.918 13.125) 21.417 3.971 ( -3.475 -12.196 -0.180) 12.683 4.028 ( -4.192 21.920 0.407) 22.321 4.217 ( -2.174 -8.683 9.655) 13.166 5.042 ( -1.558 7.668 -11.825) 14.179 5.171 ( 3.611 1.182 2.252) 4.417 6.116 ( -8.899 -11.046 6.551) 15.625 6.658 ( 3.038 6.860 10.601) 12.988 7.015 ( -2.791 -11.894 -6.970) 14.066 7.251 ( 5.939 -1.003 -3.311) 6.873 8.079 ( 0.681 -13.744 -4.641) 14.522 8.429 ( 2.125 24.656 -5.443) 25.339 8.918 ( -3.646 -13.415 9.642) 16.918 9.223 ( -2.639 12.941 9.100) 16.039 10.684 ( 7.814 -19.017 -23.141) 30.955 10.835 ( 1.831 -5.773 -7.050) 9.295 11.271 ( 11.023 -9.293 -25.561) 29.347 11.760 ( 14.051 33.370 -31.578) 48.043 12.906 ( 4.631 -11.148 5.194) 13.142 13.166 ( -2.570 4.466 -2.896) 5.911 13.470 ( -20.021 -21.729 22.062) 36.875 14.005 ( -8.285 27.240 37.797) 47.321 15.824 ( -4.504 -20.310 12.265) 24.150 16.220 ( -4.795 22.185 11.652) 25.513 19.094 ( -5.720 -2.905 -2.835) 7.014 19.298 ( 7.925 6.588 1.540) 10.420 19.618 ( 3.251 -2.104 -9.768) 10.507 19.680 ( 2.886 -1.620 -10.798) 11.294 ======================= Grid point 131 (43/366) ======================= q-point: (-0.45 0.00 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.012 ( 3.305 8.644 -8.020) 12.246 1.022 ( 0.785 4.118 -0.842) 4.276 1.112 ( -0.879 1.223 -0.746) 1.681 1.189 ( 2.632 -7.577 -6.575) 10.371 1.649 ( -0.111 -1.382 5.991) 6.149 1.945 ( -1.901 -0.359 3.491) 3.991 2.345 ( -9.585 -0.606 -2.472) 9.917 2.695 ( 9.184 1.289 3.475) 9.903 3.486 ( -3.835 24.315 7.349) 25.690 3.824 ( 2.803 17.292 -3.835) 17.932 4.142 ( -3.887 -5.613 10.772) 12.754 4.368 ( -1.360 -11.758 6.212) 13.368 4.955 ( -2.761 -4.366 -3.930) 6.491 5.317 ( 3.876 -11.966 -2.031) 12.741 6.217 ( 0.190 -0.655 9.799) 9.823 6.577 ( 0.886 6.672 8.597) 10.918 7.058 ( -6.359 0.832 -7.886) 10.164 7.212 ( 2.609 7.869 -1.320) 8.395 8.050 ( 3.723 14.852 -6.879) 16.786 8.428 ( 1.506 -23.208 -4.812) 23.749 8.988 ( -4.025 12.747 9.452) 16.371 9.167 ( -3.765 -13.527 9.329) 16.858 10.724 ( 9.393 16.808 -18.357) 26.603 10.895 ( 0.493 -6.096 -8.979) 10.864 11.165 ( 11.338 23.623 -23.855) 35.435 11.760 ( 13.470 -32.825 -36.858) 51.160 12.840 ( -6.432 12.953 -4.987) 15.298 13.144 ( 0.270 3.609 9.281) 9.961 13.647 ( 2.229 10.826 25.462) 27.758 13.954 ( -18.858 -30.150 34.515) 49.558 15.827 ( -4.918 20.331 11.846) 24.039 16.216 ( -4.418 -22.165 11.896) 25.540 19.108 ( -6.020 -3.515 -3.214) 7.676 19.244 ( 3.622 3.069 0.269) 4.755 19.586 ( 1.516 3.066 -10.914) 11.437 19.738 ( 8.229 -1.240 -8.561) 11.939 ======================= Grid point 132 (44/366) ======================= q-point: (-0.36 0.00 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.847 ( 3.454 9.340 -8.899) 13.355 0.908 ( -0.804 7.015 -0.418) 7.073 1.062 ( -1.794 3.988 -0.455) 4.397 1.327 ( 2.304 -7.200 -5.679) 9.455 1.666 ( -2.199 1.727 6.008) 6.627 1.940 ( -1.484 1.000 2.069) 2.736 2.317 ( -5.506 -2.495 -1.304) 6.184 2.611 ( 5.958 15.383 -6.830) 17.854 3.099 ( -3.124 18.712 12.081) 22.491 3.419 ( 5.364 26.113 -2.897) 26.815 3.991 ( -4.098 17.990 18.225) 25.934 4.713 ( -1.282 -22.205 -0.589) 22.250 5.107 ( -2.542 -12.474 0.935) 12.765 5.547 ( 3.748 -8.684 -2.890) 9.890 6.152 ( 7.489 16.756 19.515) 26.789 6.470 ( -3.887 2.712 -2.578) 5.396 6.931 ( -5.978 3.757 -5.321) 8.841 7.060 ( 0.414 8.298 -0.580) 8.328 7.937 ( 4.876 0.349 -7.406) 8.874 8.654 ( -1.265 8.732 3.185) 9.381 8.943 ( -1.969 -17.926 1.908) 18.134 9.401 ( -3.895 -12.797 8.481) 15.839 10.327 ( 11.881 25.192 -30.321) 41.172 10.721 ( 4.278 18.020 -1.999) 18.628 11.069 ( 0.770 -4.874 -8.860) 10.141 12.363 ( 10.767 -29.118 -34.416) 46.349 12.560 ( -4.553 8.704 -3.199) 10.331 12.885 ( -3.340 20.900 23.533) 31.651 13.830 ( 11.048 -15.270 2.533) 19.017 14.405 ( -13.261 -20.816 26.576) 36.269 15.532 ( -6.292 10.396 14.922) 19.244 16.605 ( -4.565 -20.574 12.316) 24.409 19.112 ( -6.773 -2.410 -3.645) 8.060 19.231 ( 2.321 1.227 -1.110) 2.851 19.477 ( 2.736 7.577 -9.280) 12.289 19.777 ( 5.688 -0.504 -8.875) 10.553 ======================= Grid point 133 (45/366) ======================= q-point: (-0.27 0.00 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.684 ( 2.962 8.481 -7.792) 11.892 0.778 ( -2.643 5.980 -0.671) 6.572 0.936 ( -0.418 8.914 0.164) 8.926 1.439 ( 1.378 -4.446 -4.242) 6.298 1.570 ( -4.895 7.502 6.016) 10.790 1.857 ( 1.084 10.331 -3.121) 10.846 2.249 ( 1.985 19.224 -2.211) 19.452 2.348 ( -4.790 -2.416 -4.247) 6.842 2.734 ( 1.141 23.723 -0.482) 23.756 3.047 ( 0.361 19.104 14.096) 23.745 3.643 ( -5.180 21.439 20.475) 30.094 5.058 ( 1.465 -11.292 -1.290) 11.460 5.280 ( -2.759 -3.611 2.253) 5.072 5.524 ( 0.788 8.479 8.687) 12.165 6.003 ( 1.604 1.018 8.267) 8.482 6.465 ( 0.862 -2.903 -4.101) 5.098 6.799 ( 0.217 7.557 -10.627) 13.042 6.979 ( -0.834 0.743 5.630) 5.739 7.998 ( 3.035 -4.227 -5.991) 7.936 8.432 ( -3.310 11.446 5.844) 13.271 9.273 ( 0.299 -15.139 -0.515) 15.151 9.616 ( -3.062 -10.263 6.149) 12.349 9.924 ( 8.868 16.215 -25.124) 31.189 10.424 ( 1.769 17.002 -0.516) 17.102 11.137 ( 3.126 -3.204 -5.203) 6.863 12.280 ( -3.727 9.771 -1.930) 10.634 12.505 ( -4.264 17.755 23.775) 29.978 12.987 ( 12.476 -23.459 -26.186) 37.305 14.235 ( 11.669 -20.006 -1.734) 23.225 14.625 ( -3.014 -7.361 4.177) 8.984 15.501 ( -9.603 -6.523 21.871) 24.761 16.948 ( -4.693 -17.230 12.811) 21.978 19.061 ( -4.974 3.310 -3.275) 6.813 19.214 ( 3.537 2.391 -0.689) 4.325 19.310 ( 2.408 10.336 -6.046) 12.214 19.784 ( -4.177 -2.498 -12.853) 13.744 ======================= Grid point 134 (46/366) ======================= q-point: (-0.18 0.00 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.556 ( 1.567 6.168 -2.459) 6.822 0.615 ( -1.985 11.212 -0.706) 11.408 0.788 ( 1.343 6.127 1.640) 6.483 1.270 ( -5.816 19.474 5.688) 21.105 1.527 ( 3.048 13.145 -3.884) 14.041 1.566 ( 0.541 3.757 -0.290) 3.807 2.007 ( -2.627 8.847 7.224) 11.720 2.317 ( 3.038 13.435 -0.698) 13.792 2.377 ( -1.783 5.603 -2.773) 6.502 2.770 ( -4.870 14.319 17.341) 23.010 3.299 ( -7.623 17.434 20.996) 28.335 4.727 ( -1.992 35.752 15.374) 38.968 5.439 ( -0.827 -12.259 -1.052) 12.332 5.656 ( -0.389 -14.255 1.140) 14.306 6.047 ( -1.222 -1.191 1.851) 2.518 6.507 ( 0.453 -0.517 -5.425) 5.468 6.665 ( 4.976 4.046 -9.613) 11.556 7.005 ( 0.714 -1.259 4.764) 4.979 7.994 ( -3.130 5.813 1.543) 6.780 8.332 ( 0.272 -2.221 -1.901) 2.936 9.421 ( 2.578 0.268 -6.290) 6.803 9.628 ( -0.033 0.591 0.814) 1.006 9.929 ( 0.719 -11.446 -5.334) 12.649 10.140 ( 0.340 14.800 -1.151) 14.849 11.204 ( 7.654 -1.473 -2.195) 8.098 12.123 ( 0.640 6.479 2.308) 6.907 12.243 ( -2.106 14.741 16.250) 22.040 13.291 ( 4.428 -8.191 -9.048) 12.983 14.655 ( 13.112 -18.067 -6.791) 23.334 14.800 ( 3.932 -15.643 -14.003) 21.360 15.637 ( -9.231 -6.900 16.962) 20.507 17.225 ( -4.612 -13.268 12.833) 19.026 18.937 ( 12.209 11.010 5.358) 17.291 19.121 ( 0.034 10.096 -1.057) 10.151 19.183 ( -6.397 0.417 -4.507) 7.836 19.716 ( -15.900 -1.181 -19.111) 24.888 ======================= Grid point 135 (47/366) ======================= q-point: (-0.09 0.00 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.345 ( 12.246 16.739 8.297) 22.338 0.493 ( -2.046 6.073 10.410) 12.224 0.739 ( 1.111 1.769 2.902) 3.576 0.940 ( -9.375 13.335 19.464) 25.388 1.316 ( -4.203 -4.694 19.368) 20.367 1.613 ( 0.012 -2.452 -0.057) 2.453 1.888 ( -3.445 4.425 10.821) 12.188 2.085 ( 6.628 10.907 2.105) 12.935 2.362 ( 2.796 -0.202 1.277) 3.081 2.581 ( -4.213 7.651 13.724) 16.268 2.993 ( -10.795 19.154 15.010) 26.621 4.130 ( -4.067 29.253 16.190) 33.680 5.611 ( -1.954 -8.163 7.002) 10.931 5.885 ( 4.304 -4.607 -7.348) 9.682 6.048 ( -4.391 -6.359 -6.407) 10.038 6.435 ( 2.098 6.411 -7.313) 9.949 6.669 ( 0.491 -1.505 -3.350) 3.706 7.052 ( 1.254 -2.449 2.515) 3.727 7.835 ( -5.487 7.514 5.249) 10.683 8.409 ( 0.734 -4.671 -7.092) 8.524 9.420 ( -0.626 -5.864 0.403) 5.911 9.685 ( -1.641 -3.492 7.574) 8.500 9.912 ( 0.471 9.706 -1.306) 9.805 10.112 ( 0.258 -9.016 -2.992) 9.503 11.287 ( 10.838 -1.212 -0.838) 10.937 11.975 ( -6.184 18.294 3.028) 19.547 12.068 ( 0.885 1.962 2.326) 3.169 13.340 ( -0.750 0.803 2.344) 2.589 15.031 ( 11.916 -15.733 -13.529) 23.928 15.089 ( 1.636 -16.421 -17.750) 24.236 15.647 ( -6.812 3.400 3.007) 8.185 17.433 ( -3.425 -9.917 8.368) 13.420 18.944 ( 0.643 6.303 5.738) 8.548 18.981 ( -48.357 2.325 -19.466) 52.180 19.034 ( 40.924 2.305 19.869) 45.550 19.528 ( 8.755 10.285 -8.262) 15.833 ======================= Grid point 137 (48/366) ======================= q-point: ( 0.09 0.09 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.608 ( -3.254 0.000 17.247) 17.551 0.615 ( 0.170 -0.000 19.007) 19.008 0.757 ( 2.133 -0.000 2.609) 3.370 0.951 ( 18.996 -0.000 21.567) 28.740 1.586 ( -15.870 0.000 28.319) 32.463 1.632 ( -0.005 0.000 -0.081) 0.081 1.874 ( -9.355 0.000 17.928) 20.223 1.949 ( -1.089 0.000 12.934) 12.980 2.340 ( 2.958 -0.000 18.887) 19.117 2.517 ( -5.486 0.000 14.917) 15.894 3.173 ( 29.317 -0.000 -18.393) 34.609 3.908 ( -3.258 0.000 15.670) 16.005 5.699 ( -8.632 0.000 9.264) 12.663 5.739 ( -2.046 0.000 -6.604) 6.914 6.181 ( 5.392 -0.000 -19.077) 19.824 6.255 ( -2.301 0.000 -1.024) 2.518 6.586 ( -5.126 0.000 -2.282) 5.611 7.008 ( -7.012 0.000 -2.859) 7.573 7.692 ( -5.915 0.000 7.292) 9.390 8.382 ( -1.224 0.000 -7.349) 7.450 9.578 ( -0.921 0.000 3.234) 3.363 9.774 ( -1.248 0.000 8.175) 8.270 9.840 ( 3.391 -0.000 -1.650) 3.771 10.232 ( 0.418 -0.000 0.499) 0.651 10.360 ( -64.152 0.000 42.025) 76.692 11.597 ( 6.299 -0.000 -3.787) 7.350 12.219 ( 10.599 -0.000 8.099) 13.339 13.331 ( -1.818 0.000 5.198) 5.507 14.953 ( 0.485 -0.000 -24.993) 24.998 15.302 ( 5.193 -0.000 -13.524) 14.487 15.587 ( 6.162 -0.000 -8.389) 10.409 17.553 ( 2.378 -0.000 -6.234) 6.672 17.824 ( -28.122 0.000 35.194) 45.050 18.895 ( -3.183 0.000 8.798) 9.356 19.226 ( -6.028 0.000 -2.536) 6.540 21.385 ( 79.263 -0.000 -48.591) 92.971 ======================= Grid point 138 (49/366) ======================= q-point: ( 0.18 0.09 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.558 ( -2.216 1.367 9.242) 9.601 0.718 ( -3.333 -2.516 5.338) 6.777 0.842 ( 6.254 -5.265 10.415) 13.241 1.232 ( 17.385 -9.228 14.594) 24.503 1.503 ( 1.913 -5.607 19.033) 19.934 1.613 ( 0.010 2.062 0.567) 2.138 1.913 ( -2.459 -5.210 9.924) 11.475 2.269 ( 0.927 -17.920 9.038) 20.092 2.534 ( -0.556 -6.866 12.705) 14.452 2.617 ( -7.025 -14.902 23.924) 29.048 3.153 ( 14.552 10.662 -5.145) 18.760 4.111 ( -9.263 -20.859 15.338) 27.499 5.602 ( -3.857 4.806 6.539) 8.985 5.772 ( -6.229 -2.333 -5.104) 8.384 5.907 ( 0.357 17.681 -7.190) 19.090 6.364 ( -0.263 -5.968 -9.726) 11.414 6.603 ( -0.190 -4.578 -8.792) 9.915 6.969 ( -6.768 -1.698 -0.286) 6.984 7.746 ( -4.964 -7.739 6.502) 11.261 8.318 ( -1.035 3.695 -6.570) 7.608 9.411 ( 0.034 5.853 -0.163) 5.856 9.737 ( -0.673 3.482 7.093) 7.930 9.944 ( 2.602 -7.550 -1.018) 8.051 10.079 ( -0.789 6.772 -2.656) 7.317 10.761 ( -39.370 -40.985 25.672) 62.360 11.616 ( 3.061 0.432 -3.245) 4.482 12.342 ( 12.658 -2.594 7.552) 14.966 13.350 ( -1.111 -1.272 3.026) 3.465 14.718 ( -0.757 16.903 -21.871) 27.651 15.102 ( 8.327 17.475 -21.072) 28.613 15.653 ( -0.257 -1.800 4.671) 5.012 17.412 ( -4.344 9.331 9.924) 14.298 18.139 ( -13.035 -31.448 9.181) 35.258 18.957 ( -2.401 -6.439 5.548) 8.832 19.172 ( -7.107 -0.043 -2.600) 7.568 21.252 ( 52.850 40.980 -23.562) 70.906 ======================= Grid point 139 (50/366) ======================= q-point: ( 0.27 0.09 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.583 ( 1.282 -4.027 -1.111) 4.370 0.766 ( -0.484 -3.212 1.553) 3.601 1.013 ( 6.483 -5.441 8.372) 11.905 1.509 ( 6.035 -2.747 1.436) 6.784 1.576 ( 3.222 -1.442 3.917) 5.273 1.779 ( 6.622 -11.982 1.644) 13.789 2.091 ( 1.046 -13.855 5.710) 15.022 2.601 ( -1.463 -12.592 14.061) 18.932 2.651 ( 3.528 -7.436 3.883) 9.101 2.912 ( 4.109 -5.545 12.820) 14.559 3.142 ( -9.986 -14.022 13.560) 21.914 4.561 ( -13.386 -31.818 13.560) 37.086 5.436 ( -0.437 20.209 2.486) 20.366 5.543 ( -3.580 8.710 -3.402) 10.013 5.771 ( -5.526 1.135 -3.144) 6.458 6.400 ( -1.231 -2.465 -9.747) 10.129 6.703 ( 4.966 -7.170 -8.911) 12.469 6.977 ( -4.660 -3.497 0.820) 5.884 7.908 ( -2.572 -9.444 4.553) 10.795 8.237 ( -1.390 1.297 -2.319) 2.998 9.420 ( 3.733 -3.598 -9.795) 11.083 9.680 ( 0.861 2.775 1.856) 3.448 9.904 ( 2.268 11.819 -4.775) 12.947 10.126 ( 0.576 -11.462 -1.392) 11.561 11.237 ( -19.151 -25.086 20.559) 37.666 11.636 ( -9.055 -7.705 1.765) 12.020 12.515 ( 13.494 -4.913 5.329) 15.317 13.318 ( 2.488 7.145 -7.189) 10.436 14.304 ( -3.076 20.728 -17.072) 27.029 14.801 ( 7.232 13.723 -17.249) 23.198 15.620 ( -6.172 6.326 18.989) 20.945 17.217 ( -4.957 12.734 12.192) 18.313 18.649 ( -6.270 -29.467 -1.865) 30.184 19.064 ( -5.305 -3.671 -2.289) 6.846 19.165 ( -2.269 -7.023 -0.976) 7.445 20.749 ( 33.963 40.629 -8.021) 53.559 ======================= Grid point 140 (51/366) ======================= q-point: ( 0.36 0.09 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.701 ( 3.158 -7.874 -6.180) 10.496 0.835 ( 0.166 -4.229 0.608) 4.276 1.156 ( 6.621 -3.166 6.312) 9.680 1.448 ( 1.683 5.886 -4.251) 7.453 1.666 ( -0.051 -1.210 3.201) 3.423 1.946 ( 1.678 -3.532 2.934) 4.888 2.320 ( -0.090 -5.898 -4.770) 7.586 2.699 ( 6.196 3.891 5.864) 9.376 2.904 ( -2.941 -18.001 16.402) 24.530 3.148 ( -0.902 -22.585 -3.244) 22.834 3.519 ( -11.069 -25.549 18.945) 33.678 4.969 ( -5.002 18.596 4.006) 19.670 5.077 ( -6.922 -17.389 5.449) 19.493 5.399 ( -0.743 7.029 -7.048) 9.981 5.691 ( -6.555 1.169 4.085) 7.812 6.459 ( -0.709 -8.976 -7.854) 11.948 6.818 ( 3.478 -2.006 1.373) 4.244 7.058 ( 2.107 -7.507 -5.554) 9.573 7.971 ( -0.046 1.417 -2.653) 3.008 8.335 ( -3.109 -12.700 7.206) 14.929 9.331 ( 1.421 15.316 -1.333) 15.440 9.658 ( -0.656 10.907 5.560) 12.260 9.844 ( 10.043 -16.390 -27.042) 33.178 10.345 ( -1.465 -13.471 -2.240) 13.734 11.398 ( 6.999 3.148 -1.131) 7.757 11.922 ( -25.767 -31.162 25.186) 47.637 12.723 ( 12.184 -7.125 2.799) 14.390 13.035 ( 7.663 22.959 -23.644) 33.836 13.872 ( -3.678 19.869 -13.843) 24.493 14.646 ( 0.241 6.441 3.303) 7.242 15.495 ( -8.295 5.763 23.946) 25.989 16.948 ( -4.950 17.067 12.260) 21.589 19.022 ( -7.354 -5.424 -3.336) 9.728 19.083 ( -1.415 -16.460 -5.526) 17.420 19.342 ( 2.453 -10.944 -5.047) 12.299 20.240 ( 18.659 33.265 -4.329) 38.386 ======================= Grid point 141 (52/366) ======================= q-point: ( 0.45 0.09 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.859 ( 3.475 -8.910 -7.481) 12.142 0.920 ( -0.007 -4.988 -0.384) 5.003 1.238 ( 6.386 0.891 4.135) 7.660 1.327 ( 2.198 7.358 -5.783) 9.614 1.645 ( -3.791 1.562 2.011) 4.567 1.972 ( -0.010 1.294 3.709) 3.928 2.320 ( -8.735 -0.768 -3.542) 9.457 2.671 ( 4.112 1.788 5.123) 6.808 3.328 ( -0.124 -23.271 11.950) 26.160 3.574 ( -2.907 -25.012 -3.709) 25.452 3.938 ( -7.355 -21.715 14.150) 26.942 4.482 ( -2.892 27.525 2.285) 27.771 5.187 ( 3.423 10.207 -12.171) 16.249 5.269 ( -2.460 2.630 3.205) 4.821 5.793 ( -11.174 -16.092 10.757) 22.349 6.672 ( -0.982 -14.736 -3.278) 15.128 6.842 ( 2.819 1.227 5.990) 6.733 7.206 ( 6.395 -6.603 -9.225) 13.023 7.941 ( -0.378 -1.351 -3.778) 4.030 8.586 ( -2.448 -12.243 7.008) 14.318 8.970 ( 0.709 22.267 0.808) 22.293 9.455 ( -1.450 12.155 6.431) 13.828 10.250 ( 12.759 -26.196 -32.989) 44.015 10.575 ( -2.088 -14.664 -3.879) 15.311 11.335 ( 8.321 6.809 -9.496) 14.345 12.283 ( 1.563 6.318 -3.700) 7.487 12.646 ( -6.633 -5.141 1.562) 8.536 12.967 ( 5.572 -11.446 3.486) 13.198 13.478 ( -4.266 17.247 -11.073) 20.935 14.460 ( -7.237 17.955 27.048) 33.262 15.533 ( -5.940 -10.418 16.527) 20.420 16.607 ( -4.849 20.583 11.852) 24.241 19.004 ( -6.497 -1.916 -2.619) 7.262 19.344 ( 2.698 -10.386 -6.247) 12.416 19.533 ( 4.969 -8.880 -7.600) 12.700 19.810 ( 7.090 21.768 -4.919) 23.416 ======================= Grid point 142 (53/366) ======================= q-point: ( 0.55 0.09 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.998 ( -0.137 -4.367 -1.298) 4.558 1.025 ( 3.235 -8.212 -6.990) 11.259 1.179 ( 3.080 8.139 -7.121) 11.244 1.221 ( 3.659 6.460 0.982) 7.489 1.625 ( -3.126 -1.778 4.641) 5.871 1.952 ( -0.690 1.202 3.949) 4.185 2.253 ( -10.393 -0.792 -2.147) 10.642 2.738 ( 6.169 -2.850 4.947) 8.405 3.753 ( 0.382 -18.348 9.276) 20.563 3.917 ( -6.019 -11.775 3.939) 13.799 3.987 ( -1.826 21.929 1.910) 22.088 4.214 ( -3.319 -9.512 3.167) 10.561 4.985 ( 0.343 8.057 -5.784) 9.924 5.219 ( 2.708 0.698 -0.346) 2.818 6.041 ( -8.130 -14.440 8.972) 18.844 6.769 ( 4.350 5.181 11.016) 12.928 6.936 ( -3.886 -7.889 -5.330) 10.283 7.298 ( 5.533 -0.614 -8.043) 9.782 8.061 ( 0.171 -14.569 -3.991) 15.107 8.429 ( 2.306 24.178 -5.799) 24.971 8.925 ( -3.900 -12.440 12.255) 17.893 9.231 ( -2.452 13.259 7.012) 15.198 10.653 ( 3.695 -16.018 -16.969) 23.626 10.844 ( 7.971 -12.433 -15.327) 21.284 11.283 ( 10.637 -4.758 -25.782) 28.294 11.780 ( 12.850 33.107 -29.917) 46.435 12.964 ( -2.228 -5.716 9.201) 11.059 13.134 ( 1.996 3.700 -5.923) 7.263 13.344 ( -16.588 -26.244 23.917) 39.191 14.087 ( -8.756 24.331 36.083) 44.392 15.828 ( -4.650 -20.277 12.698) 24.373 16.217 ( -4.725 22.247 11.345) 25.416 18.999 ( -5.555 -2.685 -2.443) 6.636 19.405 ( 6.845 7.847 -0.205) 10.415 19.571 ( -0.336 0.588 -10.239) 10.261 19.704 ( 6.440 -5.590 -9.410) 12.699 ======================= Grid point 143 (54/366) ======================= q-point: (-0.36 0.09 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.015 ( 3.380 8.938 -8.203) 12.594 1.025 ( 0.449 3.080 -0.908) 3.242 1.105 ( 0.053 4.684 -0.180) 4.688 1.190 ( 2.636 -7.806 -6.784) 10.673 1.670 ( -1.940 -2.067 6.359) 6.962 1.945 ( -0.942 0.363 3.867) 3.996 2.223 ( -6.356 -2.860 -0.483) 6.986 2.813 ( 6.201 2.429 0.325) 6.668 3.490 ( -3.248 24.318 11.499) 27.095 3.859 ( 3.855 16.627 0.274) 17.071 4.144 ( -3.883 -8.901 9.566) 13.632 4.342 ( -3.727 -12.327 -2.452) 13.109 4.926 ( -0.865 -3.534 2.645) 4.498 5.338 ( 2.305 -11.815 -6.158) 13.522 6.241 ( -2.558 -9.512 7.366) 12.299 6.682 ( 4.866 13.251 13.693) 19.666 6.923 ( -7.900 1.778 -6.295) 10.257 7.228 ( 2.301 8.806 -5.317) 10.541 8.065 ( 4.021 13.698 -7.301) 16.035 8.424 ( 1.479 -23.756 -4.258) 24.180 8.978 ( -3.828 13.127 6.898) 15.316 9.171 ( -3.993 -12.591 11.656) 17.617 10.728 ( 6.179 14.257 -19.479) 24.917 10.874 ( 3.711 -3.263 -9.381) 10.603 11.203 ( 11.131 24.301 -20.445) 33.652 11.744 ( 13.664 -33.540 -38.287) 52.703 12.741 ( -3.404 14.389 -6.080) 15.987 13.198 ( -0.564 5.299 11.380) 12.566 13.780 ( -1.880 3.762 21.806) 22.208 13.895 ( -17.228 -28.967 36.287) 49.524 15.824 ( -4.729 20.415 11.430) 23.870 16.220 ( -4.561 -22.193 12.205) 25.735 19.006 ( -5.168 -2.632 -2.456) 6.299 19.299 ( 3.210 5.134 -0.044) 6.055 19.552 ( 2.124 1.615 -10.394) 10.731 19.796 ( 6.984 -1.791 -9.296) 11.764 ======================= Grid point 144 (55/366) ======================= q-point: (-0.27 0.09 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.848 ( 3.530 9.444 -8.836) 13.406 0.897 ( -0.429 8.207 -0.084) 8.219 1.050 ( -0.190 3.770 0.190) 3.780 1.328 ( 2.305 -7.170 -5.676) 9.431 1.664 ( -3.001 3.316 6.915) 8.236 1.936 ( -0.968 1.196 2.394) 2.846 2.261 ( -1.896 -3.758 0.366) 4.225 2.653 ( 5.361 18.907 -5.935) 20.529 3.121 ( -3.612 18.906 13.072) 23.267 3.491 ( 5.078 24.722 1.995) 25.317 4.018 ( -6.095 17.047 17.857) 25.429 4.674 ( -1.637 -23.226 -5.826) 24.001 5.096 ( -1.026 -12.504 3.632) 13.062 5.556 ( 1.489 -10.334 -7.341) 12.763 6.335 ( 1.081 25.558 17.573) 31.036 6.397 ( -2.436 -4.241 -0.686) 4.939 6.839 ( -3.158 1.462 -4.619) 5.784 7.061 ( 0.522 7.778 -1.595) 7.957 7.961 ( 4.510 0.512 -7.485) 8.754 8.647 ( -1.724 10.217 1.898) 10.534 8.931 ( -1.068 -19.387 1.587) 19.481 9.398 ( -3.781 -12.296 9.917) 16.243 10.319 ( 10.686 25.345 -30.398) 40.995 10.752 ( 1.348 17.459 -1.420) 17.568 11.060 ( 4.824 -4.466 -8.756) 10.949 12.320 ( 7.840 -19.569 -28.189) 35.200 12.510 ( 2.487 -0.725 -9.787) 10.124 12.956 ( -4.356 18.234 21.669) 28.653 13.949 ( 4.322 -15.898 0.911) 16.500 14.373 ( -12.658 -21.658 27.754) 37.411 15.526 ( -6.006 10.656 14.377) 18.876 16.609 ( -4.701 -20.600 12.522) 24.561 19.005 ( -4.182 -1.409 -2.015) 4.851 19.264 ( 1.855 1.351 -0.923) 2.473 19.469 ( 3.203 6.759 -8.812) 11.558 19.805 ( 5.083 2.665 -9.441) 11.048 ======================= Grid point 145 (56/366) ======================= q-point: (-0.18 0.09 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.684 ( 3.061 8.501 -7.743) 11.899 0.763 ( 0.495 6.564 1.235) 6.698 0.946 ( 0.911 7.984 1.602) 8.194 1.437 ( 1.686 -3.751 -3.859) 5.639 1.554 ( -2.615 7.882 7.553) 11.225 1.864 ( 1.917 9.288 -2.066) 9.706 2.261 ( 2.600 16.773 -5.867) 17.959 2.330 ( 2.225 2.387 5.693) 6.562 2.761 ( 0.944 22.456 4.859) 22.995 3.111 ( -1.320 21.024 12.690) 24.592 3.660 ( -8.166 21.475 19.810) 30.337 5.055 ( 0.681 -18.694 -4.634) 19.272 5.258 ( -3.168 1.329 3.753) 5.088 5.547 ( -2.190 7.856 3.799) 8.997 6.006 ( -5.851 2.695 3.135) 7.164 6.484 ( 3.647 -1.977 -0.053) 4.149 6.750 ( 0.458 5.108 -9.542) 10.833 7.000 ( 0.068 0.039 4.370) 4.371 8.004 ( 2.414 -2.595 -6.121) 7.073 8.410 ( -3.686 11.204 3.806) 12.393 9.280 ( 0.910 -15.484 0.205) 15.512 9.612 ( -2.645 -10.463 7.124) 12.932 9.905 ( 8.238 16.671 -25.460) 31.528 10.432 ( 0.002 17.510 -1.046) 17.541 11.170 ( 5.731 -5.034 -5.329) 9.305 12.237 ( 0.282 7.702 -2.799) 8.200 12.538 ( -9.443 15.155 21.045) 27.599 13.024 ( 12.326 -21.060 -24.080) 34.283 14.316 ( 1.963 -21.989 -6.412) 22.989 14.608 ( -2.966 -7.473 5.240) 9.596 15.486 ( -9.413 -5.708 21.347) 24.019 16.952 ( -4.939 -17.285 12.906) 22.130 18.999 ( -0.295 -0.254 -0.433) 0.582 19.233 ( 0.794 3.697 -2.729) 4.664 19.317 ( 2.759 9.860 -5.206) 11.486 19.732 ( 3.985 5.109 -8.578) 10.750 ======================= Grid point 146 (57/366) ======================= q-point: (-0.09 0.09 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.563 ( 1.200 4.485 -1.983) 5.049 0.673 ( 6.646 7.069 5.232) 11.024 0.814 ( 0.967 6.980 3.258) 7.763 1.270 ( 0.837 20.343 7.870) 21.829 1.548 ( 1.550 -1.239 -2.059) 2.859 1.598 ( 4.976 16.804 0.019) 17.526 2.019 ( -1.489 9.499 7.809) 12.387 2.387 ( 6.996 -1.512 4.762) 8.597 2.413 ( 5.214 18.526 3.243) 19.516 2.792 ( -5.217 15.444 17.015) 23.564 3.279 ( -11.133 18.777 19.629) 29.357 4.738 ( -7.981 35.300 14.152) 38.860 5.428 ( 0.098 -15.137 -1.166) 15.182 5.641 ( -2.119 -13.370 -0.006) 13.537 5.991 ( -5.742 -0.766 -3.542) 6.790 6.495 ( 1.268 1.975 -5.650) 6.118 6.672 ( 3.898 1.876 -9.244) 10.206 7.030 ( -0.767 -1.371 3.945) 4.246 7.958 ( -3.119 7.452 1.121) 8.156 8.311 ( -1.052 -2.408 -3.524) 4.396 9.422 ( 2.854 1.557 -7.103) 7.812 9.638 ( 0.343 -0.460 2.089) 2.166 9.912 ( 1.052 -11.864 -5.291) 13.033 10.135 ( 0.056 14.694 -1.381) 14.759 11.278 ( 5.483 -3.537 -3.109) 7.228 12.111 ( -8.498 7.775 4.162) 12.247 12.236 ( -6.422 13.786 10.845) 18.679 13.308 ( 4.602 -7.264 -8.548) 12.125 14.679 ( -5.989 -20.941 -13.406) 25.576 14.772 ( 7.285 -13.732 -15.562) 21.996 15.604 ( -8.233 -5.605 17.606) 20.228 17.225 ( -5.246 -13.170 12.582) 18.955 18.914 ( -12.739 12.020 -6.192) 18.577 19.114 ( 1.156 9.652 -0.660) 9.744 19.198 ( 6.781 0.873 1.610) 7.024 19.741 ( 26.257 -2.385 -0.790) 26.377 ======================= Grid point 149 (58/366) ======================= q-point: ( 0.18 0.18 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.604 ( -7.773 0.000 15.601) 17.431 0.677 ( -1.627 0.000 9.187) 9.330 0.841 ( 5.513 -0.000 7.278) 9.130 1.321 ( 20.025 -0.000 13.512) 24.157 1.591 ( -11.103 0.000 37.967) 39.557 1.632 ( -0.003 0.000 0.080) 0.080 1.881 ( -1.132 0.000 8.490) 8.565 1.998 ( -2.646 0.000 15.463) 15.687 2.491 ( 5.256 -0.000 15.621) 16.482 2.535 ( -3.032 0.000 13.443) 13.781 3.373 ( 15.470 -0.000 -14.166) 20.976 3.927 ( -5.531 0.000 13.271) 14.377 5.643 ( -6.798 0.000 8.467) 10.858 5.666 ( -3.316 0.000 -6.799) 7.564 6.144 ( 3.916 -0.000 -18.035) 18.455 6.217 ( -3.305 0.000 1.064) 3.471 6.506 ( -4.314 0.000 -3.402) 5.494 6.896 ( -7.138 0.000 -2.611) 7.601 7.655 ( -5.246 0.000 7.474) 9.131 8.329 ( -1.033 0.000 -6.784) 6.862 9.588 ( -0.214 0.000 3.302) 3.309 9.798 ( -1.174 0.000 6.882) 6.981 9.868 ( -4.104 0.000 6.166) 7.406 9.956 ( -25.408 0.000 29.351) 38.820 10.245 ( 1.067 -0.000 0.387) 1.135 11.655 ( 5.257 -0.000 -3.387) 6.254 12.429 ( 13.346 -0.000 8.694) 15.928 13.332 ( -2.102 0.000 5.425) 5.818 14.852 ( 4.781 -0.000 -28.403) 28.802 15.298 ( 4.778 -0.000 -13.206) 14.044 15.612 ( 4.370 -0.000 -8.305) 9.385 17.551 ( 2.308 -0.000 -6.232) 6.645 17.713 ( -17.995 0.000 33.845) 38.331 18.897 ( -3.404 0.000 8.531) 9.185 19.109 ( -8.753 0.000 -2.774) 9.182 21.892 ( 37.728 -0.000 -38.887) 54.181 ======================= Grid point 150 (59/366) ======================= q-point: ( 0.27 0.18 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.565 ( -3.211 1.212 8.211) 8.900 0.711 ( -1.687 -2.493 4.277) 5.230 0.966 ( 4.952 -6.227 8.675) 11.771 1.518 ( 14.270 -3.491 7.288) 16.399 1.604 ( 0.899 -0.678 4.408) 4.550 1.645 ( 2.053 -5.109 15.642) 16.583 1.934 ( -1.465 -4.668 7.668) 9.096 2.298 ( -5.073 -21.709 13.604) 26.117 2.573 ( -2.743 -2.459 12.223) 12.766 2.683 ( -0.235 -13.279 17.337) 21.840 3.304 ( 11.642 13.054 -5.680) 18.390 4.056 ( -10.325 -17.054 14.309) 24.540 5.577 ( -3.570 2.970 2.353) 5.207 5.667 ( -6.232 -0.857 -1.588) 6.488 5.882 ( 0.343 17.823 -3.923) 18.253 6.308 ( -0.518 -5.512 -9.043) 10.603 6.553 ( 0.043 -7.396 -9.196) 11.801 6.874 ( -6.773 -3.179 -0.210) 7.485 7.723 ( -4.177 -8.483 8.091) 12.444 8.275 ( -0.510 3.092 -5.482) 6.314 9.413 ( 0.496 5.866 -0.400) 5.900 9.762 ( -0.729 3.354 5.690) 6.645 9.976 ( 2.918 -6.074 -1.281) 6.859 10.048 ( -2.888 0.834 0.489) 3.045 10.491 ( -22.437 -33.112 25.783) 47.588 11.651 ( 4.229 2.900 -3.619) 6.276 12.561 ( 13.378 -2.202 7.004) 15.260 13.350 ( -1.348 -1.186 3.270) 3.731 14.621 ( 3.481 18.471 -23.194) 29.854 15.100 ( 7.701 17.134 -20.593) 27.874 15.670 ( -0.859 -1.870 4.681) 5.113 17.408 ( -4.227 9.177 10.219) 14.370 18.046 ( -8.901 -29.598 9.533) 32.344 18.946 ( -3.653 -4.974 4.007) 7.358 19.055 ( -7.697 -1.848 -1.196) 8.005 21.664 ( 30.083 35.096 -24.047) 52.106 ======================= Grid point 151 (60/366) ======================= q-point: ( 0.36 0.18 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.594 ( 1.025 -4.237 -0.941) 4.460 0.768 ( -0.426 -3.543 1.553) 3.892 1.138 ( 5.614 -5.961 7.539) 11.130 1.539 ( 1.474 4.141 -2.551) 5.083 1.667 ( 5.123 -0.698 2.002) 5.545 1.875 ( 5.329 -7.307 3.473) 9.688 2.132 ( 1.144 -15.687 3.846) 16.192 2.615 ( -7.435 -7.731 16.482) 19.664 2.693 ( 0.457 -17.346 1.325) 17.402 3.018 ( -0.494 -12.238 14.255) 18.794 3.107 ( -1.623 3.914 4.226) 5.984 4.465 ( -11.615 -30.581 14.446) 35.760 5.426 ( -3.130 21.907 0.224) 22.131 5.495 ( -0.995 5.327 0.197) 5.422 5.702 ( -3.550 1.940 -0.154) 4.048 6.340 ( -0.155 -2.429 -8.527) 8.868 6.718 ( 4.714 -10.816 -10.449) 15.761 6.914 ( -5.008 -5.749 0.638) 7.651 7.906 ( -2.176 -9.581 6.869) 11.988 8.213 ( -1.029 0.476 -0.776) 1.374 9.420 ( 4.221 -3.640 -10.486) 11.875 9.698 ( 0.769 3.296 0.517) 3.424 9.913 ( 2.672 11.251 -4.495) 12.407 10.129 ( 0.833 -9.608 -1.263) 9.726 11.069 ( -24.169 -38.127 31.693) 55.157 11.597 ( 2.067 3.826 -4.651) 6.367 12.718 ( 12.413 -4.019 3.663) 13.552 13.312 ( 2.250 7.650 -6.988) 10.603 14.205 ( 1.332 22.263 -16.898) 27.982 14.805 ( 6.916 13.034 -17.224) 22.680 15.636 ( -6.427 6.246 19.385) 21.357 17.215 ( -4.858 12.714 12.074) 18.194 18.563 ( -5.384 -29.825 -0.987) 30.323 18.961 ( -7.118 -1.661 -2.577) 7.750 19.145 ( -0.676 -10.168 -0.407) 10.199 21.072 ( 22.484 42.758 -12.004) 49.778 ======================= Grid point 152 (61/366) ======================= q-point: ( 0.45 0.18 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.711 ( 2.869 -7.777 -5.760) 10.094 0.838 ( -0.064 -4.119 0.490) 4.149 1.281 ( 6.757 -3.061 6.235) 9.690 1.447 ( 1.608 6.023 -4.215) 7.525 1.657 ( -2.131 2.458 -0.848) 3.362 1.982 ( 1.083 -1.969 3.361) 4.043 2.279 ( -2.744 0.472 -1.710) 3.267 2.785 ( 2.850 3.359 3.185) 5.436 2.939 ( -2.814 -18.274 11.114) 21.572 3.103 ( -2.392 -21.738 -5.010) 22.436 3.480 ( -8.519 -25.846 15.672) 31.403 4.918 ( -7.134 4.541 9.261) 12.541 5.039 ( -3.468 -6.042 6.341) 9.420 5.367 ( 1.720 8.625 -7.156) 11.338 5.643 ( -5.020 1.546 6.491) 8.350 6.419 ( 0.603 -9.442 -6.510) 11.485 6.864 ( 1.484 -3.274 3.373) 4.929 7.049 ( 2.932 -11.211 -10.670) 15.752 7.959 ( -0.020 2.512 -1.776) 3.076 8.339 ( -3.075 -13.439 10.158) 17.125 9.339 ( 1.199 14.901 -2.207) 15.111 9.675 ( -0.626 10.846 4.182) 11.641 9.843 ( 11.087 -15.818 -27.130) 33.304 10.319 ( -0.607 -11.843 -2.033) 12.031 11.480 ( 6.563 4.745 -3.826) 8.957 11.731 ( -24.608 -37.873 32.887) 55.870 12.884 ( 10.078 -4.714 -0.567) 11.141 13.014 ( 7.898 23.644 -23.419) 34.203 13.780 ( 0.280 20.986 -12.965) 24.670 14.665 ( 0.180 5.254 2.627) 5.877 15.510 ( -8.688 6.088 24.840) 27.011 16.946 ( -4.898 17.098 12.093) 21.507 18.907 ( -6.773 -5.427 -2.605) 9.062 19.036 ( -0.972 -18.873 -5.486) 19.679 19.347 ( 2.314 -11.881 -5.287) 13.209 20.427 ( 13.202 38.365 -6.674) 41.119 ======================= Grid point 153 (62/366) ======================= q-point: ( 0.55 0.18 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.866 ( 3.265 -8.832 -7.242) 11.879 0.916 ( -0.091 -4.640 -0.447) 4.663 1.323 ( 2.581 7.365 -5.561) 9.583 1.355 ( 6.933 2.977 3.075) 8.148 1.582 ( -6.634 0.739 0.284) 6.681 1.990 ( -0.188 1.646 3.663) 4.021 2.199 ( -6.672 2.353 -0.029) 7.075 2.740 ( 2.281 0.058 3.235) 3.959 3.360 ( -2.147 -23.359 5.402) 24.071 3.512 ( -2.963 -25.250 -3.759) 25.699 3.906 ( -6.715 -22.147 10.016) 25.217 4.472 ( -1.784 27.558 6.820) 28.445 5.172 ( 3.803 11.930 -9.432) 15.676 5.276 ( -0.596 -1.764 5.443) 5.753 5.721 ( -8.783 -14.583 12.240) 20.967 6.640 ( -0.599 -14.803 -4.313) 15.430 6.911 ( 1.387 0.243 8.744) 8.857 7.230 ( 6.093 -7.922 -13.457) 16.762 7.917 ( -0.405 -1.014 -3.367) 3.540 8.595 ( -2.533 -11.188 8.886) 14.510 8.982 ( 0.285 21.537 1.239) 21.574 9.464 ( -1.570 12.465 4.698) 13.413 10.252 ( 13.235 -25.779 -32.708) 43.698 10.540 ( 0.292 -14.671 -4.582) 15.373 11.376 ( 5.624 7.551 -11.077) 14.538 12.295 ( -1.345 -3.603 7.937) 8.819 12.556 ( -5.627 -1.854 -1.888) 6.218 13.057 ( 6.047 -7.279 -1.847) 9.642 13.391 ( -0.270 18.745 -10.136) 21.312 14.499 ( -7.869 16.561 26.008) 31.821 15.540 ( -6.292 -10.115 17.206) 20.928 16.604 ( -4.777 20.624 11.652) 24.165 18.917 ( -4.321 -2.451 -1.465) 5.179 19.329 ( 1.576 -13.496 -8.039) 15.788 19.556 ( 4.369 -10.308 -8.041) 13.784 19.876 ( 5.649 27.422 -4.391) 28.340 ======================= Grid point 154 (63/366) ======================= q-point: (-0.36 0.18 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.992 ( 0.099 -4.010 -0.811) 4.092 1.029 ( 3.071 -8.611 -7.417) 11.772 1.180 ( 2.914 8.313 -7.453) 11.539 1.266 ( 2.101 9.539 -0.561) 9.783 1.596 ( -4.214 -4.766 4.186) 7.616 1.970 ( -0.135 1.408 4.665) 4.875 2.147 ( -4.202 -1.015 1.551) 4.592 2.812 ( 1.460 -4.162 2.406) 5.024 3.765 ( -3.193 -22.704 0.301) 22.929 3.866 ( -4.356 -7.650 5.369) 10.312 4.013 ( 1.140 17.971 9.285) 20.260 4.171 ( -3.655 -7.726 -0.144) 8.549 4.992 ( 2.882 7.630 -0.549) 8.175 5.237 ( 0.975 1.941 -2.178) 3.076 5.997 ( -5.969 -15.934 10.586) 20.039 6.823 ( -3.063 -6.279 -4.111) 8.106 6.915 ( 2.259 4.344 11.250) 12.269 7.314 ( 4.472 -0.115 -11.363) 12.211 8.044 ( 0.403 -15.397 -3.768) 15.857 8.431 ( 2.479 23.556 -5.926) 24.417 8.940 ( -4.236 -11.505 14.068) 18.660 9.229 ( -2.687 13.495 5.270) 14.734 10.619 ( 3.347 -13.655 -13.024) 19.165 10.878 ( 10.982 -16.512 -20.938) 28.838 11.281 ( 8.693 -3.171 -24.832) 26.500 11.789 ( 11.920 33.527 -29.945) 46.507 12.956 ( -3.520 3.803 5.613) 7.640 13.155 ( 0.467 -8.890 6.116) 10.801 13.273 ( -10.940 -22.846 18.217) 31.201 14.140 ( -11.097 22.630 34.148) 42.443 15.832 ( -4.844 -20.266 12.942) 24.529 16.213 ( -4.589 22.299 11.161) 25.355 18.936 ( -2.146 -2.321 -0.740) 3.246 19.475 ( 5.263 5.277 -3.461) 8.218 19.519 ( -0.339 3.942 -7.987) 8.913 19.733 ( 5.089 -6.845 -9.914) 13.078 ======================= Grid point 155 (64/366) ======================= q-point: (-0.27 0.18 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.014 ( 2.652 7.771 -7.353) 11.022 1.027 ( 0.932 3.879 -1.867) 4.405 1.105 ( -0.031 6.122 -0.153) 6.124 1.189 ( 2.686 -8.170 -6.961) 11.065 1.663 ( -3.349 -2.964 5.085) 6.772 1.954 ( -1.275 1.247 4.408) 4.755 2.189 ( 0.727 -3.720 2.862) 4.749 2.854 ( 0.262 2.191 -1.835) 2.870 3.515 ( -2.916 23.961 13.675) 27.742 3.927 ( 4.239 16.216 4.131) 17.263 4.139 ( -3.834 -11.530 8.181) 14.648 4.259 ( -4.485 -12.723 -6.193) 14.844 4.954 ( 1.376 -1.994 5.840) 6.323 5.313 ( 0.254 -11.342 -9.714) 14.935 6.242 ( -2.600 -11.433 6.640) 13.475 6.745 ( -8.915 11.469 3.572) 14.959 6.869 ( 6.043 5.408 6.598) 10.455 7.218 ( 1.416 9.002 -7.959) 12.099 8.080 ( 3.755 12.869 -7.106) 15.173 8.423 ( 1.692 -24.287 -4.026) 24.676 8.959 ( -3.700 13.575 5.469) 15.095 9.181 ( -4.088 -12.055 12.663) 17.955 10.702 ( 5.515 11.419 -18.847) 22.716 10.883 ( 5.069 1.380 -10.970) 12.163 11.239 ( 9.302 23.973 -18.549) 31.706 11.728 ( 14.313 -34.924 -38.916) 54.213 12.696 ( 1.197 14.649 -4.785) 15.457 13.240 ( -1.996 6.010 10.180) 11.989 13.815 ( -9.738 -10.032 24.366) 28.092 13.875 ( -13.926 -17.248 32.368) 39.232 15.821 ( -4.564 20.461 11.242) 23.788 16.222 ( -4.693 -22.207 12.348) 25.839 18.965 ( 0.233 -1.699 0.149) 1.722 19.320 ( 0.410 5.480 -1.401) 5.671 19.539 ( 3.766 0.933 -9.652) 10.403 19.820 ( 4.137 -2.025 -10.480) 11.447 ======================= Grid point 156 (65/366) ======================= q-point: (-0.18 0.18 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.848 ( 3.418 9.427 -8.796) 13.339 0.898 ( 0.502 7.871 0.352) 7.895 1.056 ( 0.759 3.282 1.025) 3.521 1.329 ( 2.281 -7.214 -5.714) 9.481 1.662 ( -2.515 2.620 6.689) 7.612 1.937 ( -0.815 1.082 2.719) 3.038 2.276 ( 3.123 -3.150 1.958) 4.848 2.685 ( 2.756 16.354 -4.227) 17.115 3.141 ( -4.322 19.723 15.465) 25.433 3.564 ( 3.815 25.150 2.572) 25.567 4.014 ( -8.263 16.805 17.713) 25.777 4.618 ( -1.529 -24.699 -6.702) 25.637 5.114 ( 0.674 -11.074 3.535) 11.644 5.511 ( -0.872 -11.201 -10.768) 15.562 6.240 ( -13.035 17.551 2.911) 22.055 6.509 ( 4.730 2.907 11.717) 12.965 6.805 ( 0.962 4.781 -4.129) 6.390 7.065 ( 1.653 5.824 -1.417) 6.218 7.977 ( 3.316 0.821 -6.851) 7.655 8.629 ( -2.255 11.780 1.388) 12.074 8.931 ( -0.060 -20.999 1.241) 21.036 9.404 ( -3.270 -11.946 10.378) 16.159 10.298 ( 10.244 25.354 -30.768) 41.164 10.741 ( -1.517 16.684 -1.995) 16.871 11.102 ( 7.768 -4.058 -8.170) 11.982 12.292 ( 8.348 -16.972 -23.579) 30.227 12.520 ( 6.722 -2.186 -10.077) 12.309 12.987 ( -7.016 17.075 18.897) 26.417 13.938 ( -4.891 -15.819 -3.570) 16.938 14.360 ( -11.149 -21.666 28.632) 37.597 15.522 ( -5.764 10.892 14.311) 18.885 16.611 ( -4.843 -20.593 12.530) 24.587 19.007 ( 4.537 -1.177 1.613) 4.957 19.263 ( -0.777 1.358 -2.091) 2.612 19.472 ( 3.990 6.503 -8.263) 11.246 19.806 ( 2.799 2.523 -10.294) 10.962 ======================= Grid point 157 (66/366) ======================= q-point: (-0.09 0.18 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.686 ( 3.170 8.370 -7.396) 11.611 0.794 ( 2.122 4.788 1.852) 5.555 0.977 ( 2.033 6.831 3.577) 7.974 1.442 ( 2.026 -4.730 -4.097) 6.578 1.579 ( -0.041 7.505 8.329) 11.212 1.884 ( 1.980 7.224 -0.510) 7.508 2.283 ( 5.343 12.860 -6.279) 15.276 2.430 ( 5.944 4.581 9.001) 11.719 2.805 ( -0.880 19.500 11.323) 22.566 3.146 ( -1.589 22.807 8.495) 24.389 3.634 ( -10.935 22.303 19.380) 31.505 5.034 ( -0.258 -22.565 -4.198) 22.954 5.224 ( -5.265 8.596 3.913) 10.813 5.513 ( -4.001 3.802 0.087) 5.520 5.903 ( -9.407 1.281 0.008) 9.494 6.530 ( 2.310 2.629 -1.943) 4.003 6.724 ( 2.654 2.860 -6.160) 7.292 7.026 ( 0.907 0.804 2.892) 3.136 7.999 ( 1.378 -1.375 -5.310) 5.655 8.377 ( -3.728 11.436 3.139) 12.431 9.297 ( 1.328 -15.670 0.186) 15.728 9.620 ( -1.917 -10.652 7.373) 13.096 9.880 ( 8.341 16.833 -26.115) 32.170 10.414 ( -1.467 16.887 -1.790) 17.045 11.231 ( 6.973 -5.160 -4.019) 9.561 12.240 ( -2.879 9.412 4.209) 10.705 12.496 ( -8.078 15.979 14.949) 23.325 13.052 ( 10.011 -20.386 -22.894) 32.248 14.214 ( -8.358 -20.561 -11.823) 25.147 14.608 ( -1.173 -7.723 5.215) 9.393 15.477 ( -8.648 -5.177 21.799) 24.016 16.951 ( -5.091 -17.179 12.723) 21.975 19.051 ( 5.706 4.255 0.454) 7.132 19.209 ( -1.988 2.818 -3.433) 4.866 19.326 ( 2.589 9.761 -4.877) 11.214 19.798 ( 11.959 -3.533 -5.493) 13.626 ======================= Grid point 161 (67/366) ======================= q-point: ( 0.27 0.27 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.584 ( -6.462 0.000 13.457) 14.929 0.690 ( -1.834 0.000 5.489) 5.787 0.948 ( 4.563 -0.000 6.317) 7.793 1.565 ( -2.211 0.000 25.039) 25.136 1.632 ( -0.037 0.000 0.294) 0.296 1.683 ( 4.757 -0.000 18.276) 18.885 1.921 ( 2.670 -0.000 2.306) 3.528 2.040 ( -3.593 0.000 16.416) 16.805 2.576 ( -1.218 0.000 12.807) 12.865 2.625 ( 3.973 -0.000 10.190) 10.937 3.475 ( 8.828 -0.000 -7.522) 11.598 3.896 ( -8.508 0.000 11.168) 14.039 5.587 ( -3.176 0.000 -5.845) 6.652 5.601 ( -5.272 0.000 6.296) 8.212 6.104 ( 3.657 -0.000 -16.303) 16.709 6.183 ( -3.687 0.000 4.391) 5.734 6.441 ( -2.604 0.000 -2.797) 3.822 6.797 ( -5.515 0.000 -2.447) 6.034 7.633 ( -4.227 0.000 8.548) 9.536 8.287 ( -0.049 0.000 -5.814) 5.814 9.605 ( 0.101 -0.000 3.279) 3.281 9.754 ( -18.563 0.000 27.205) 32.935 9.813 ( -1.413 0.000 5.306) 5.491 9.943 ( 2.540 -0.000 0.291) 2.556 10.263 ( 1.286 -0.000 0.372) 1.339 11.700 ( 4.047 -0.000 -3.471) 5.332 12.646 ( 12.066 -0.000 6.991) 13.945 13.332 ( -2.203 0.000 5.518) 5.941 14.780 ( 6.777 -0.000 -28.210) 29.013 15.292 ( 4.506 -0.000 -12.933) 13.696 15.622 ( 3.603 -0.000 -7.848) 8.636 17.549 ( 2.242 -0.000 -6.219) 6.611 17.669 ( -14.860 0.000 32.169) 35.436 18.887 ( -4.434 0.000 6.006) 7.465 18.982 ( -7.999 0.000 0.028) 7.999 22.096 ( 21.582 -0.000 -29.995) 36.953 ======================= Grid point 162 (68/366) ======================= q-point: ( 0.36 0.27 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.563 ( -3.088 0.347 7.377) 8.005 0.712 ( -1.282 -2.450 3.385) 4.371 1.062 ( 3.159 -6.799 6.570) 9.968 1.605 ( 0.751 2.748 -0.692) 2.932 1.665 ( -0.574 -6.868 11.921) 13.770 1.795 ( 7.682 -4.630 8.560) 12.398 1.954 ( -0.255 -2.730 4.349) 5.141 2.290 ( -6.793 -20.791 14.489) 26.236 2.602 ( -2.384 0.134 11.667) 11.909 2.759 ( 0.222 -10.174 9.349) 13.819 3.399 ( 6.267 12.895 -4.684) 15.082 3.992 ( -9.939 -16.273 13.835) 23.559 5.529 ( -2.649 2.541 -3.546) 5.104 5.601 ( -4.740 -0.491 4.274) 6.401 5.878 ( 0.615 16.946 0.223) 16.959 6.262 ( 0.389 -5.438 -7.636) 9.382 6.511 ( 0.690 -8.690 -8.227) 11.986 6.795 ( -4.933 -3.887 0.578) 6.307 7.720 ( -3.403 -9.263 9.989) 14.041 8.249 ( 0.504 2.704 -4.460) 5.240 9.419 ( 0.732 5.716 -0.607) 5.795 9.776 ( -1.089 3.243 3.997) 5.261 10.005 ( 2.656 -4.988 -2.198) 6.063 10.013 ( -4.317 -6.138 5.358) 9.221 10.389 ( -12.134 -22.169 20.652) 32.638 11.683 ( 3.363 3.446 -4.152) 6.358 12.753 ( 10.109 -1.848 4.397) 11.178 13.349 ( -1.401 -1.087 3.394) 3.829 14.565 ( 6.064 18.785 -22.620) 30.022 15.094 ( 7.388 16.885 -20.147) 27.306 15.681 ( -1.196 -2.168 4.820) 5.418 17.406 ( -4.189 9.081 10.308) 14.362 17.992 ( -6.814 -27.652 9.576) 30.046 18.881 ( -6.415 -1.459 -0.889) 6.639 18.990 ( -3.638 -5.675 4.458) 8.081 21.858 ( 18.283 30.391 -22.508) 42.006 ======================= Grid point 163 (69/366) ======================= q-point: ( 0.45 0.27 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.600 ( 0.693 -4.495 -0.947) 4.646 0.770 ( -0.446 -3.632 1.366) 3.906 1.234 ( 2.778 -7.475 6.541) 10.314 1.542 ( 1.043 4.474 -2.436) 5.200 1.717 ( 3.039 3.657 -3.207) 5.735 1.944 ( 2.044 -3.939 2.700) 5.195 2.157 ( 0.067 -16.306 2.292) 16.467 2.596 ( -7.454 -5.749 15.412) 18.059 2.677 ( -3.161 -19.511 0.746) 19.779 3.043 ( -5.100 -20.066 12.173) 24.017 3.124 ( 1.598 17.135 -2.261) 17.357 4.406 ( -8.828 -30.234 15.531) 35.117 5.380 ( -2.033 15.669 -1.235) 15.848 5.507 ( -0.296 8.780 5.067) 10.142 5.672 ( -1.800 3.536 2.276) 4.574 6.313 ( 1.975 -2.674 -6.354) 7.172 6.718 ( 4.416 -14.109 -12.967) 19.665 6.859 ( -4.143 -6.118 2.773) 7.892 7.921 ( -1.744 -9.225 8.768) 12.846 8.202 ( -0.524 -0.308 0.547) 0.818 9.423 ( 4.487 -3.248 -10.690) 12.040 9.705 ( 0.448 3.241 -0.926) 3.400 9.927 ( 2.839 10.659 -4.444) 11.892 10.134 ( 0.828 -8.370 -1.257) 8.504 10.943 ( -20.555 -38.871 34.459) 55.866 11.610 ( 3.308 5.411 -5.527) 8.413 12.867 ( 7.616 -3.469 0.483) 8.383 13.306 ( 2.287 8.209 -6.980) 11.015 14.158 ( 4.352 23.134 -15.882) 28.396 14.806 ( 6.644 12.412 -17.036) 22.100 15.650 ( -6.745 6.059 19.597) 21.593 17.213 ( -4.818 12.726 11.993) 18.139 18.499 ( -3.578 -28.933 0.103) 29.154 18.867 ( -4.671 -2.356 -1.491) 5.440 19.137 ( -0.331 -10.778 -0.369) 10.789 21.241 ( 13.577 42.371 -14.445) 46.779 ======================= Grid point 164 (70/366) ======================= q-point: ( 0.55 0.27 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.716 ( 2.459 -7.777 -5.719) 9.961 0.839 ( -0.171 -3.982 0.404) 4.006 1.384 ( 2.702 -5.126 5.741) 8.157 1.447 ( 1.602 6.053 -4.181) 7.529 1.611 ( -1.814 6.694 -4.226) 8.122 2.003 ( -0.545 -1.244 2.436) 2.789 2.246 ( -1.365 4.054 0.959) 4.384 2.807 ( -1.161 -0.374 1.241) 1.741 2.940 ( -3.531 -15.453 5.328) 16.723 3.038 ( -2.566 -22.189 -6.670) 23.311 3.451 ( -7.061 -25.088 12.825) 29.047 4.886 ( -5.852 -3.904 12.143) 14.033 5.049 ( -0.978 0.485 8.924) 8.991 5.371 ( 3.315 8.842 -4.742) 10.567 5.620 ( -3.739 2.111 7.182) 8.367 6.408 ( 2.221 -8.786 -4.783) 10.247 6.894 ( -0.247 -4.458 5.168) 6.830 7.027 ( 3.501 -13.772 -14.020) 19.962 7.952 ( 0.384 3.904 -1.455) 4.185 8.357 ( -3.173 -13.968 12.156) 18.787 9.339 ( 0.822 14.530 -2.880) 14.835 9.683 ( -1.029 10.566 3.030) 11.040 9.856 ( 11.891 -15.123 -26.998) 33.151 10.308 ( 0.411 -10.974 -1.780) 11.125 11.484 ( -4.558 0.011 -3.931) 6.019 11.661 ( -11.257 -35.358 35.944) 51.661 12.964 ( 6.605 7.557 -12.502) 16.033 13.009 ( 6.402 13.060 -15.114) 20.976 13.742 ( 3.535 21.855 -11.542) 24.967 14.677 ( -0.271 4.347 2.220) 4.888 15.522 ( -9.182 6.339 25.284) 27.637 16.943 ( -4.850 17.135 11.991) 21.469 18.830 ( -2.851 -5.994 -0.947) 6.704 19.006 ( 0.615 -19.246 -4.753) 19.834 19.349 ( 2.115 -12.481 -5.539) 13.818 20.522 ( 7.057 40.115 -9.094) 41.734 ======================= Grid point 165 (71/366) ======================= q-point: ( 0.64 0.27 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.869 ( 2.942 -8.873 -7.572) 12.031 0.914 ( 0.071 -4.464 -0.249) 4.472 1.323 ( 2.225 7.492 -5.977) 9.839 1.444 ( -0.288 9.022 -3.217) 9.583 1.492 ( -2.146 -4.640 4.003) 6.493 2.003 ( -0.956 0.966 3.539) 3.791 2.162 ( 0.022 3.466 3.622) 5.013 2.755 ( -1.960 -1.011 1.036) 2.437 3.324 ( -4.859 -22.797 -0.683) 23.319 3.462 ( -0.973 -26.383 -5.139) 26.897 3.870 ( -5.959 -21.746 9.503) 24.469 4.508 ( 0.000 26.632 10.860) 28.761 5.195 ( 4.987 10.980 -5.439) 13.229 5.301 ( -0.097 -1.321 5.626) 5.780 5.686 ( -6.055 -14.335 12.887) 20.205 6.613 ( 0.012 -12.567 -4.322) 13.290 6.967 ( -0.505 -2.100 9.937) 10.169 7.229 ( 4.982 -8.759 -15.397) 18.401 7.897 ( 0.271 -0.596 -3.519) 3.579 8.609 ( -2.508 -9.975 9.280) 13.853 8.990 ( -0.415 20.385 1.830) 20.471 9.461 ( -2.043 12.842 3.605) 13.494 10.262 ( 13.332 -24.862 -31.603) 42.363 10.536 ( 2.998 -15.475 -5.525) 16.703 11.365 ( 1.681 6.969 -11.420) 13.484 12.335 ( -1.043 -7.030 13.331) 15.107 12.488 ( -1.879 0.327 -4.331) 4.732 13.092 ( 1.610 -6.123 -5.195) 8.190 13.365 ( 3.648 19.512 -8.357) 21.538 14.519 ( -9.296 15.989 25.140) 31.210 15.544 ( -6.620 -9.912 17.461) 21.141 16.601 ( -4.678 20.646 11.557) 24.119 18.883 ( -0.082 -2.774 0.363) 2.798 19.316 ( 2.886 -13.999 -7.909) 16.335 19.564 ( 3.232 -10.889 -8.618) 14.258 19.904 ( 2.174 28.775 -5.567) 29.389 ======================= Grid point 166 (72/366) ======================= q-point: (-0.27 0.27 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.993 ( 0.555 -3.909 -0.505) 3.981 1.029 ( 2.813 -8.765 -7.943) 12.158 1.179 ( 2.809 8.237 -7.350) 11.391 1.257 ( -2.198 9.242 -2.416) 9.802 1.574 ( -1.756 -4.579 3.820) 6.216 1.981 ( -2.038 1.474 4.479) 5.137 2.172 ( 4.755 -1.230 5.580) 7.434 2.797 ( -4.632 -4.384 -0.042) 6.378 3.688 ( -5.927 -20.615 -3.081) 21.671 3.851 ( -1.373 -13.049 1.536) 13.210 4.102 ( 2.722 14.738 13.133) 19.927 4.132 ( -3.149 -4.076 3.707) 6.346 5.044 ( 4.555 6.748 -0.075) 8.142 5.224 ( -0.942 4.791 -2.334) 5.412 5.996 ( -2.747 -16.368 11.477) 20.178 6.735 ( -5.421 -2.363 -4.179) 7.241 7.018 ( 2.911 0.608 11.682) 12.054 7.299 ( 2.618 0.459 -12.581) 12.858 8.034 ( 1.162 -16.072 -4.088) 16.624 8.433 ( 2.493 22.996 -5.908) 23.873 8.958 ( -4.448 -11.022 14.737) 18.933 9.215 ( -3.113 13.724 4.340) 14.727 10.611 ( 5.226 -12.875 -11.714) 18.174 10.914 ( 11.270 -16.533 -22.651) 30.223 11.253 ( 6.039 -4.503 -23.384) 24.567 11.786 ( 11.814 33.898 -31.403) 47.695 12.949 ( -1.750 5.334 5.717) 8.012 13.195 ( 0.559 -8.786 -0.072) 8.804 13.239 ( -9.096 -24.571 26.029) 36.932 14.144 ( -14.467 23.047 32.774) 42.598 15.834 ( -5.019 -20.248 12.948) 24.552 16.211 ( -4.431 22.292 11.137) 25.310 18.939 ( 2.390 -2.412 1.263) 3.622 19.470 ( -1.620 5.070 -6.681) 8.542 19.520 ( 5.219 3.977 -5.575) 8.610 19.733 ( 3.125 -6.759 -10.664) 13.007 ======================= Grid point 167 (73/366) ======================= q-point: (-0.18 0.27 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.011 ( 2.486 7.236 -6.978) 10.355 1.028 ( 0.680 5.188 -2.138) 5.652 1.105 ( 0.326 3.737 -0.082) 3.752 1.189 ( 2.702 -8.143 -6.964) 11.051 1.644 ( -2.817 -3.304 4.133) 5.995 1.954 ( -1.998 1.070 4.145) 4.725 2.265 ( 6.515 -2.369 5.455) 8.821 2.800 ( -6.368 0.535 -2.741) 6.953 3.555 ( -2.043 22.654 14.449) 26.948 4.000 ( 2.763 17.425 3.393) 17.966 4.123 ( -3.372 -17.930 3.081) 18.503 4.180 ( -4.223 -7.568 1.716) 8.835 5.017 ( 3.340 -0.398 5.271) 6.253 5.245 ( -1.700 -10.831 -12.087) 16.318 6.238 ( -3.305 -7.425 5.693) 9.923 6.632 ( -8.023 5.444 3.295) 10.241 7.004 ( 6.339 9.584 7.273) 13.599 7.187 ( 0.694 7.477 -8.316) 11.205 8.090 ( 2.921 12.654 -6.432) 14.492 8.426 ( 1.907 -24.683 -4.270) 25.122 8.939 ( -3.618 14.004 5.492) 15.471 9.194 ( -3.806 -12.130 12.372) 17.739 10.686 ( 7.575 13.113 -20.504) 25.489 10.885 ( 2.725 2.469 -8.855) 9.588 11.255 ( 8.420 21.588 -20.189) 30.733 11.724 ( 15.103 -35.446 -37.530) 53.787 12.723 ( 5.462 13.956 -2.482) 15.191 13.247 ( -3.943 4.625 7.478) 9.636 13.774 ( -14.324 7.453 17.573) 23.865 13.867 ( -13.194 -31.353 38.664) 51.498 15.820 ( -4.461 20.443 11.370) 23.813 16.223 ( -4.775 -22.185 12.264) 25.795 19.013 ( 5.617 -2.558 2.300) 6.587 19.296 ( -2.426 4.953 -2.506) 6.058 19.552 ( 5.534 1.340 -9.016) 10.663 19.797 ( 1.212 -1.754 -11.612) 11.806 ======================= Grid point 168 (74/366) ======================= q-point: (-0.09 0.27 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.849 ( 3.453 9.271 -8.483) 13.032 0.910 ( 0.805 6.528 0.291) 6.583 1.084 ( 2.207 2.583 2.335) 4.122 1.329 ( 2.235 -7.301 -5.775) 9.573 1.666 ( -1.772 0.559 5.594) 5.895 1.943 ( -0.607 0.507 3.048) 3.149 2.353 ( 6.060 -1.283 1.723) 6.430 2.668 ( -2.779 9.022 -2.301) 9.717 3.179 ( -2.627 21.479 17.553) 27.863 3.613 ( 2.177 25.884 -0.045) 25.976 3.988 ( -9.426 17.659 18.177) 27.039 4.566 ( -1.872 -25.871 -4.713) 26.363 5.147 ( 2.132 -8.625 1.608) 9.028 5.426 ( -2.647 -11.288 -12.046) 16.719 6.070 ( -14.745 17.940 4.867) 23.727 6.614 ( 3.088 0.299 8.883) 9.410 6.798 ( 1.368 10.348 -5.640) 11.865 7.098 ( 4.232 4.204 -0.891) 6.031 7.977 ( 1.759 1.194 -5.783) 6.162 8.605 ( -2.485 12.717 2.181) 13.140 8.941 ( 0.608 -22.062 0.903) 22.089 9.418 ( -2.503 -11.841 9.760) 15.547 10.274 ( 10.770 25.571 -31.529) 42.000 10.695 ( -3.221 16.112 -2.845) 16.675 11.175 ( 9.192 -4.543 -7.745) 12.850 12.288 ( 7.868 -17.923 -20.176) 28.111 12.585 ( 9.350 0.668 -7.108) 11.764 12.966 ( -10.076 18.044 17.325) 26.968 13.800 ( -9.988 -14.913 -7.935) 19.624 14.376 ( -9.082 -20.987 28.686) 36.685 15.522 ( -5.621 10.926 14.792) 19.229 16.610 ( -4.900 -20.560 12.360) 24.484 19.112 ( 6.759 -1.801 1.942) 7.259 19.232 ( -0.319 1.222 -2.306) 2.630 19.488 ( 4.531 6.964 -7.890) 11.458 19.778 ( 1.725 -0.896 -10.369) 10.549 ======================= Grid point 173 (75/366) ======================= q-point: ( 0.36 0.36 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.571 ( -5.543 0.000 12.068) 13.280 0.690 ( -1.951 0.000 4.301) 4.723 1.021 ( 2.152 -0.000 4.046) 4.583 1.587 ( -13.991 0.000 31.363) 34.342 1.634 ( -0.093 0.000 0.479) 0.488 1.827 ( 5.896 -0.000 2.283) 6.323 1.975 ( 4.999 -0.000 -2.189) 5.458 2.069 ( -4.860 0.000 15.531) 16.274 2.628 ( -1.336 0.000 12.147) 12.220 2.692 ( 0.249 -0.000 3.907) 3.915 3.534 ( 4.571 -0.000 -4.907) 6.706 3.828 ( -9.492 0.000 10.799) 14.378 5.530 ( -1.261 0.000 -3.724) 3.932 5.568 ( -3.863 0.000 4.794) 6.157 6.074 ( 4.175 -0.000 -15.170) 15.734 6.169 ( -3.069 0.000 7.624) 8.219 6.413 ( -0.239 0.000 -0.074) 0.250 6.728 ( -3.007 0.000 -1.726) 3.467 7.632 ( -3.296 0.000 10.044) 10.571 8.269 ( 1.443 -0.000 -4.580) 4.802 9.623 ( -0.079 0.000 3.155) 3.156 9.679 ( -13.032 0.000 23.807) 27.140 9.815 ( -1.882 0.000 3.808) 4.247 9.973 ( 2.133 -0.000 -1.252) 2.473 10.281 ( 1.020 -0.000 0.449) 1.114 11.725 ( 2.568 -0.000 -4.314) 5.021 12.805 ( 6.893 -0.000 3.544) 7.750 13.331 ( -2.218 0.000 5.569) 5.994 14.741 ( 8.896 -0.000 -26.365) 27.825 15.284 ( 4.450 -0.000 -12.807) 13.558 15.628 ( 3.313 -0.000 -7.399) 8.107 17.546 ( 2.245 -0.000 -6.187) 6.581 17.647 ( -13.246 0.000 31.319) 34.005 18.826 ( -5.272 0.000 -0.343) 5.283 18.926 ( -4.303 0.000 7.487) 8.636 22.185 ( 14.220 -0.000 -25.989) 29.625 ======================= Grid point 174 (76/366) ======================= q-point: ( 0.45 0.36 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.560 ( -2.993 -0.254 6.737) 7.376 0.710 ( -1.403 -2.624 2.809) 4.091 1.115 ( 0.242 -7.283 4.654) 8.647 1.608 ( 0.317 2.732 -0.556) 2.806 1.676 ( -7.024 -10.023 12.290) 17.345 1.890 ( 2.169 -3.541 1.480) 4.408 1.972 ( 0.809 0.300 0.811) 1.184 2.272 ( -6.401 -18.752 12.138) 23.237 2.626 ( -3.098 2.282 10.827) 11.491 2.777 ( -2.807 -9.388 3.827) 10.520 3.418 ( 0.936 13.520 -6.079) 14.853 3.948 ( -7.349 -17.465 14.452) 23.830 5.490 ( -0.185 2.914 -2.603) 3.912 5.574 ( -2.989 -0.916 4.847) 5.768 5.900 ( 1.048 15.645 3.630) 16.095 6.241 ( 2.140 -6.337 -6.749) 9.502 6.491 ( 1.858 -7.525 -5.671) 9.604 6.751 ( -2.365 -4.330 1.698) 5.218 7.736 ( -2.800 -9.949 11.815) 15.698 8.244 ( 1.848 2.778 -3.415) 4.774 9.425 ( 0.723 5.397 -0.762) 5.498 9.774 ( -1.654 3.189 2.487) 4.370 9.992 ( -3.906 -10.290 7.669) 13.415 10.023 ( 1.559 -4.428 -2.203) 5.186 10.358 ( -7.971 -15.653 17.258) 24.625 11.695 ( 2.099 3.359 -5.053) 6.420 12.861 ( 3.529 -1.668 0.527) 3.939 13.348 ( -1.408 -1.001 3.459) 3.866 14.546 ( 8.321 18.890 -21.024) 29.464 15.087 ( 7.338 16.713 -19.841) 26.960 15.689 ( -1.345 -2.412 4.911) 5.634 17.404 ( -4.140 9.043 10.329) 14.339 17.964 ( -4.943 -26.430 10.024) 28.696 18.807 ( -3.156 -1.179 -0.471) 3.402 18.976 ( -2.725 -6.250 5.514) 8.768 21.938 ( 11.526 28.247 -22.331) 37.807 ======================= Grid point 175 (77/366) ======================= q-point: ( 0.55 0.36 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.602 ( 0.354 -4.678 -1.184) 4.839 0.769 ( -0.648 -3.751 1.106) 3.964 1.269 ( -2.233 -8.258 4.810) 9.814 1.542 ( 0.928 4.554 -2.439) 5.249 1.723 ( 1.595 4.850 -6.050) 7.917 1.950 ( -2.477 -3.753 0.245) 4.503 2.153 ( -1.881 -16.573 0.513) 16.688 2.586 ( -5.919 -3.957 15.698) 17.237 2.625 ( -3.526 -18.455 -3.392) 19.093 3.023 ( -6.083 -18.082 9.053) 21.117 3.108 ( -1.263 15.425 -4.032) 15.993 4.391 ( -6.107 -30.193 16.365) 34.881 5.372 ( 1.019 12.904 1.070) 12.988 5.526 ( -1.278 7.516 5.664) 9.498 5.681 ( 0.416 6.516 4.957) 8.198 6.327 ( 4.345 -2.854 -4.340) 6.772 6.701 ( 4.075 -15.821 -14.884) 22.101 6.836 ( -2.480 -5.486 5.467) 8.132 7.949 ( -1.416 -8.401 9.861) 13.031 8.205 ( 0.213 -0.799 1.555) 1.761 9.427 ( 4.391 -2.620 -10.525) 11.701 9.700 ( 0.011 2.671 -2.085) 3.389 9.941 ( 2.795 10.254 -4.598) 11.580 10.137 ( 0.680 -8.012 -1.387) 8.159 10.876 ( -16.765 -37.142 34.738) 53.547 11.624 ( 2.895 4.084 -4.825) 6.953 12.916 ( 0.525 -3.423 -3.243) 4.745 13.300 ( 2.347 8.732 -7.153) 11.529 14.153 ( 6.707 23.521 -14.324) 28.345 14.804 ( 6.447 12.041 -16.825) 21.671 15.661 ( -7.048 5.970 19.560) 21.631 17.211 ( -4.785 12.752 11.963) 18.127 18.474 ( -0.617 -28.261 1.428) 28.303 18.829 ( -0.309 -3.001 0.145) 3.020 19.131 ( -0.124 -10.949 -0.465) 10.959 21.293 ( 6.578 42.064 -16.801) 45.770 ======================= Grid point 176 (78/366) ======================= q-point: (-0.36 -0.64 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.716 ( 2.093 -7.783 -6.117) 10.118 0.838 ( -0.267 -4.047 0.347) 4.071 1.371 ( -7.403 -4.538 1.392) 8.794 1.446 ( 1.562 5.972 -4.183) 7.457 1.605 ( 3.749 6.715 -2.822) 8.192 1.992 ( -2.394 -2.231 1.138) 3.465 2.255 ( 1.514 3.010 0.905) 3.489 2.777 ( -3.654 -0.733 0.965) 3.849 2.899 ( -5.587 -13.690 2.116) 14.937 2.965 ( -1.295 -23.772 -10.838) 26.158 3.433 ( -5.737 -24.571 14.098) 28.904 4.890 ( -3.661 -7.897 13.157) 15.775 5.106 ( 1.242 2.673 11.803) 12.165 5.393 ( 2.246 8.279 -2.543) 8.947 5.624 ( -0.858 3.185 7.077) 7.808 6.426 ( 3.489 -7.099 -3.645) 8.709 6.913 ( -1.179 -5.206 5.955) 7.997 6.997 ( 3.232 -14.768 -14.659) 21.058 7.954 ( 0.996 5.244 -1.686) 5.597 8.380 ( -3.161 -14.038 12.785) 19.249 9.331 ( 0.323 14.313 -3.249) 14.681 9.679 ( -1.644 10.207 2.390) 10.611 9.877 ( 12.207 -14.597 -26.633) 32.732 10.311 ( 1.444 -11.103 -1.548) 11.303 11.375 ( -10.110 -8.911 4.122) 14.093 11.749 ( -2.724 -27.154 29.546) 40.221 12.961 ( 4.776 10.899 -16.426) 20.283 12.990 ( 1.992 10.082 -14.705) 17.941 13.753 ( 6.460 22.147 -9.744) 25.044 14.680 ( -0.953 4.015 2.063) 4.613 15.528 ( -9.628 6.534 25.190) 27.748 16.942 ( -4.791 17.155 11.971) 21.460 18.827 ( 2.428 -6.230 1.003) 6.761 19.005 ( 2.719 -19.070 -3.888) 19.651 19.346 ( 1.901 -12.550 -5.773) 13.945 20.521 ( 0.991 40.134 -11.583) 41.783 ======================= Grid point 177 (79/366) ======================= q-point: (-0.27 -0.64 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.865 ( 2.716 -8.907 -8.228) 12.426 0.916 ( 0.279 -4.636 -0.083) 4.645 1.311 ( -3.064 5.167 -5.009) 7.821 1.337 ( -3.422 4.707 -4.202) 7.178 1.561 ( 4.369 1.772 2.762) 5.464 1.998 ( -2.277 0.486 3.162) 3.927 2.231 ( 6.290 1.497 4.605) 7.938 2.703 ( -5.657 -0.624 -0.398) 5.705 3.236 ( -6.450 -22.358 -2.612) 23.416 3.427 ( 0.969 -27.673 -8.690) 29.021 3.858 ( -4.460 -21.206 13.143) 25.344 4.579 ( 0.990 25.155 12.592) 28.149 5.228 ( 3.282 10.166 -5.726) 12.120 5.337 ( 0.994 1.192 7.044) 7.213 5.703 ( -1.515 -15.214 13.988) 20.722 6.592 ( 0.081 -9.173 -4.433) 10.188 7.002 ( -1.930 -4.386 10.125) 11.202 7.201 ( 2.851 -8.967 -15.172) 17.853 7.889 ( 1.498 -0.302 -4.237) 4.504 8.624 ( -2.180 -8.895 8.360) 12.400 8.989 ( -1.274 19.057 2.274) 19.235 9.448 ( -2.654 13.198 3.554) 13.923 10.278 ( 13.416 -24.192 -30.527) 41.197 10.560 ( 5.091 -16.488 -5.912) 18.241 11.305 ( -1.845 5.545 -10.410) 11.938 12.391 ( 8.038 19.269 -13.512) 24.869 12.473 ( -5.799 -23.519 21.523) 32.404 13.045 ( -3.533 -6.855 -7.355) 10.657 13.402 ( 7.500 19.203 -5.983) 21.466 14.513 ( -10.973 16.457 24.693) 31.639 15.545 ( -6.812 -9.865 17.222) 20.984 16.600 ( -4.577 20.635 11.592) 24.107 18.919 ( 4.222 -2.753 2.060) 5.445 19.324 ( 4.133 -13.337 -7.315) 15.763 19.552 ( 1.950 -10.203 -9.116) 13.820 19.876 ( -1.064 27.179 -7.216) 28.141 ======================= Grid point 178 (80/366) ======================= q-point: (-0.18 -0.64 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.001 ( 0.894 -4.016 -0.423) 4.136 1.022 ( 2.709 -8.683 -8.445) 12.412 1.174 ( 1.139 7.275 -6.202) 9.628 1.205 ( -2.079 6.295 -2.991) 7.273 1.587 ( 0.375 -1.662 3.694) 4.068 1.971 ( -2.696 1.337 4.157) 5.132 2.306 ( 9.459 -1.212 6.294) 11.426 2.698 ( -8.912 -3.334 -1.071) 9.576 3.593 ( -5.910 -21.542 -1.839) 22.414 3.836 ( 0.179 -15.655 -3.876) 16.129 4.124 ( -3.116 -2.571 9.136) 9.989 4.215 ( 2.758 14.269 14.501) 20.530 5.082 ( 1.986 3.736 -6.721) 7.942 5.211 ( 0.558 10.136 2.283) 10.405 6.045 ( 0.754 -15.069 12.176) 19.388 6.644 ( -5.695 0.787 -1.755) 6.011 7.107 ( 2.264 -3.307 8.761) 9.634 7.252 ( 0.046 0.835 -12.131) 12.160 8.032 ( 2.111 -16.299 -4.898) 17.150 8.434 ( 2.252 22.706 -5.746) 23.530 8.975 ( -4.433 -11.258 14.167) 18.630 9.194 ( -3.445 13.979 4.672) 15.137 10.635 ( 7.610 -13.275 -12.261) 19.608 10.938 ( 9.011 -11.664 -20.396) 25.164 11.202 ( 4.946 -9.255 -22.983) 25.265 11.778 ( 12.491 33.657 -33.415) 49.045 12.964 ( -2.332 0.475 8.554) 8.879 13.147 ( -2.086 -6.344 -7.187) 9.811 13.325 ( -2.543 -22.624 30.683) 38.207 14.101 ( -17.286 25.315 32.504) 44.679 15.833 ( -5.104 -20.234 12.727) 24.442 16.211 ( -4.326 22.231 11.276) 25.300 19.007 ( 5.763 -2.887 2.568) 6.938 19.395 ( -4.857 7.655 -5.541) 10.625 19.566 ( 6.796 0.035 -7.622) 10.212 19.708 ( 1.918 -5.113 -10.989) 12.271 ======================= Grid point 179 (81/366) ======================= q-point: (-0.09 0.36 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.009 ( 2.573 7.184 -6.589) 10.082 1.022 ( 0.299 5.607 -2.186) 6.025 1.119 ( 1.771 0.174 0.341) 1.812 1.188 ( 2.631 -7.971 -6.843) 10.830 1.634 ( -1.856 -2.640 4.043) 5.173 1.948 ( -1.873 0.382 3.972) 4.408 2.396 ( 7.826 -0.095 4.571) 9.063 2.669 ( -10.194 -0.788 -1.628) 10.354 3.612 ( -0.697 19.704 14.259) 24.332 4.012 ( -1.207 13.484 -2.277) 13.728 4.080 ( -3.568 -21.865 -0.148) 22.154 4.182 ( -2.190 3.436 12.643) 13.284 5.089 ( 4.340 1.694 0.270) 4.667 5.151 ( -2.673 -11.347 -9.827) 15.247 6.198 ( -6.985 3.133 4.894) 9.086 6.594 ( -1.628 -2.586 7.848) 8.422 7.069 ( 0.382 14.012 -3.671) 14.490 7.185 ( 4.526 1.521 -1.819) 5.109 8.090 ( 1.752 13.029 -5.528) 14.261 8.429 ( 2.018 -24.835 -4.853) 25.385 8.923 ( -3.574 14.009 7.055) 16.087 9.208 ( -3.203 -12.524 11.049) 17.006 10.687 ( 9.527 16.988 -23.434) 30.472 10.862 ( -0.209 2.958 -5.531) 6.276 11.260 ( 9.750 15.844 -23.569) 30.026 11.738 ( 14.997 -34.468 -34.500) 51.022 12.807 ( 7.227 12.685 0.545) 14.609 13.216 ( -4.721 0.836 3.543) 5.961 13.634 ( -19.446 14.588 18.263) 30.405 13.922 ( -9.670 -30.376 38.933) 50.319 15.821 ( -4.439 20.376 11.763) 23.943 16.223 ( -4.807 -22.163 11.997) 25.656 19.115 ( 5.633 -2.836 1.916) 6.591 19.242 ( -2.033 2.179 -2.171) 3.687 19.588 ( 6.548 2.468 -8.734) 11.192 19.737 ( -0.415 -0.995 -12.129) 12.177 ======================= Grid point 185 (82/366) ======================= q-point: ( 0.45 0.45 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.560 ( -5.298 0.000 11.265) 12.448 0.683 ( -2.254 0.000 3.746) 4.372 1.048 ( -0.745 0.000 2.503) 2.611 1.540 ( -16.151 0.000 28.807) 33.026 1.635 ( -0.138 0.000 0.566) 0.582 1.863 ( -0.304 0.000 -1.346) 1.379 2.008 ( 2.109 -0.000 -5.823) 6.193 2.068 ( -6.481 0.000 12.600) 14.169 2.655 ( -3.977 0.000 10.822) 11.530 2.672 ( -4.416 0.000 -0.655) 4.465 3.532 ( 0.207 -0.000 -8.205) 8.207 3.783 ( -6.014 0.000 13.031) 14.352 5.519 ( 1.749 -0.000 -1.328) 2.196 5.551 ( -2.261 0.000 4.608) 5.132 6.056 ( 5.087 -0.000 -15.156) 15.987 6.182 ( -1.930 0.000 10.165) 10.346 6.437 ( 2.122 -0.000 3.843) 4.390 6.700 ( -0.070 0.000 -0.820) 0.823 7.649 ( -2.665 0.000 11.473) 11.779 8.279 ( 3.044 -0.000 -3.167) 4.392 9.634 ( -0.608 0.000 2.953) 3.015 9.647 ( -10.023 0.000 22.582) 24.707 9.802 ( -2.454 0.000 2.751) 3.686 9.984 ( 0.736 -0.000 -2.125) 2.248 10.293 ( 0.354 -0.000 0.602) 0.699 11.724 ( 1.171 -0.000 -5.500) 5.623 12.855 ( -0.886 0.000 -0.664) 1.107 13.331 ( -2.197 0.000 5.637) 6.050 14.743 ( 11.191 -0.000 -24.195) 26.657 15.277 ( 4.640 -0.000 -12.897) 13.707 15.634 ( 3.258 -0.000 -7.022) 7.741 17.545 ( 2.366 -0.000 -6.140) 6.580 17.642 ( -12.174 0.000 31.415) 33.692 18.783 ( -0.603 0.000 0.412) 0.730 18.915 ( -3.754 0.000 8.356) 9.161 22.211 ( 9.986 -0.000 -25.708) 27.579 ======================= Grid point 186 (83/366) ======================= q-point: (-0.45 -0.55 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.553 ( -3.096 -0.687 6.215) 6.978 0.703 ( -1.727 -2.913 2.411) 4.157 1.116 ( -3.292 -7.027 3.319) 8.440 1.608 ( 0.145 2.686 -0.533) 2.742 1.614 ( -10.815 -11.237 10.731) 18.931 1.870 ( -4.568 -1.762 -3.371) 5.944 1.973 ( -1.014 -0.232 -0.109) 1.046 2.240 ( -6.110 -17.520 6.967) 19.820 2.626 ( -5.022 2.031 10.085) 11.447 2.731 ( -6.268 -10.407 3.361) 12.605 3.370 ( -1.368 13.835 -9.517) 16.848 3.947 ( -4.642 -18.044 15.044) 23.947 5.499 ( 2.152 3.096 0.147) 3.773 5.571 ( -0.817 -0.811 4.197) 4.352 5.941 ( 1.561 13.910 5.188) 14.928 6.249 ( 4.182 -7.930 -6.491) 11.069 6.504 ( 3.165 -4.226 -2.228) 5.730 6.749 ( 0.186 -4.441 2.793) 5.249 7.767 ( -2.434 -10.493 13.117) 16.973 8.262 ( 3.181 3.313 -2.370) 5.168 9.430 ( 0.551 5.069 -0.782) 5.159 9.758 ( -2.283 3.145 1.604) 4.204 9.990 ( -2.986 -11.771 9.255) 15.268 10.023 ( 0.579 -4.718 -3.024) 5.634 10.349 ( -6.729 -13.278 16.506) 22.227 11.688 ( 1.098 2.765 -5.768) 6.490 12.847 ( -4.435 -1.827 -3.419) 5.891 13.347 ( -1.415 -0.876 3.475) 3.853 14.566 ( 10.215 19.213 -19.298) 29.084 15.083 ( 7.523 16.613 -19.707) 26.851 15.697 ( -1.376 -2.477 4.904) 5.664 17.403 ( -4.051 9.083 10.337) 14.344 17.965 ( -3.076 -26.383 10.959) 28.734 18.802 ( 2.107 -1.225 1.259) 2.743 18.971 ( -2.415 -6.337 5.441) 8.695 21.937 ( 6.615 28.201 -24.338) 37.834 ======================= Grid point 187 (84/366) ======================= q-point: (-0.36 -0.55 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.597 ( 0.092 -4.766 -1.658) 5.047 0.764 ( -0.842 -3.966 0.874) 4.148 1.222 ( -7.492 -6.703 2.069) 10.263 1.541 ( 0.866 4.541 -2.638) 5.323 1.696 ( -0.600 1.530 -7.047) 7.236 1.879 ( -7.133 -7.149 -2.425) 10.385 2.118 ( -3.062 -15.366 -0.100) 15.668 2.544 ( -3.751 -19.151 -8.330) 21.218 2.606 ( -3.628 -1.862 15.252) 15.788 2.967 ( -7.700 -7.050 2.787) 10.806 3.075 ( -1.752 2.067 2.811) 3.905 4.412 ( -3.776 -30.445 16.761) 34.958 5.414 ( 3.105 11.051 3.302) 11.944 5.531 ( -1.785 6.989 4.239) 8.366 5.734 ( 2.361 8.321 7.667) 11.559 6.380 ( 6.269 -2.568 -3.139) 7.467 6.676 ( 3.903 -15.200 -14.908) 21.645 6.847 ( -0.938 -4.828 6.710) 8.320 7.983 ( -1.336 -7.192 9.866) 12.282 8.223 ( 1.060 -0.862 2.216) 2.603 9.429 ( 3.949 -1.804 -10.003) 10.904 9.685 ( -0.381 1.727 -2.717) 3.242 9.952 ( 2.605 10.131 -4.867) 11.537 10.138 ( 0.553 -8.590 -1.544) 8.745 10.856 ( -12.728 -34.578 33.244) 49.627 11.641 ( 2.592 0.710 -2.013) 3.358 12.848 ( -6.720 -3.969 -6.368) 10.073 13.294 ( 2.520 9.186 -7.448) 12.092 14.185 ( 8.552 23.386 -12.561) 27.889 14.802 ( 6.370 12.047 -16.655) 21.519 15.667 ( -7.286 6.088 19.294) 21.503 17.210 ( -4.738 12.785 11.993) 18.159 18.498 ( 2.552 -28.619 2.632) 28.853 18.861 ( 4.193 -2.695 1.718) 5.273 19.129 ( 0.129 -10.940 -0.612) 10.958 21.240 ( -0.194 42.339 -20.075) 46.858 ======================= Grid point 188 (85/366) ======================= q-point: (-0.27 -0.55 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.709 ( 1.951 -7.801 -6.808) 10.536 0.835 ( -0.329 -4.306 0.318) 4.331 1.242 ( -10.328 -2.610 -2.076) 10.853 1.445 ( 1.625 6.001 -4.317) 7.569 1.643 ( 2.281 2.532 -0.550) 3.452 1.954 ( -3.351 -4.675 -0.278) 5.758 2.279 ( 2.306 -2.842 -3.256) 4.898 2.723 ( -5.151 5.607 -0.505) 7.631 2.825 ( -6.827 -15.170 4.091) 17.131 2.898 ( 0.998 -26.876 -12.576) 29.690 3.452 ( -3.775 -24.174 17.775) 30.242 4.923 ( -1.449 -8.495 12.296) 15.015 5.202 ( 2.777 1.738 13.946) 14.326 5.392 ( -0.997 7.905 -1.482) 8.104 5.680 ( 3.480 4.069 7.074) 8.871 6.458 ( 3.832 -4.539 -3.623) 6.958 6.925 ( -0.422 -6.810 2.076) 7.132 6.961 ( 1.204 -12.696 -9.565) 15.941 7.961 ( 1.700 6.179 -2.441) 6.858 8.405 ( -2.998 -13.621 12.153) 18.499 9.315 ( -0.163 14.289 -3.224) 14.649 9.665 ( -2.273 9.989 2.528) 10.551 9.901 ( 11.964 -14.514 -26.157) 32.218 10.330 ( 2.344 -12.158 -1.284) 12.448 11.269 ( -8.333 -7.782 3.119) 11.820 11.888 ( -0.268 -27.554 31.036) 41.504 12.869 ( -7.984 -6.033 -8.167) 12.917 12.965 ( 9.512 26.246 -25.447) 37.774 13.812 ( 9.129 21.641 -7.638) 24.698 14.674 ( -1.646 4.345 2.183) 5.134 15.528 ( -9.889 6.685 24.624) 27.365 16.941 ( -4.724 17.151 12.045) 21.483 18.900 ( 6.723 -6.082 2.403) 9.379 19.036 ( 4.442 -18.354 -3.219) 19.157 19.339 ( 1.712 -12.046 -5.956) 13.546 20.425 ( -5.209 38.372 -14.286) 41.275 ======================= Grid point 189 (86/366) ======================= q-point: (-0.18 -0.55 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.857 ( 2.831 -8.982 -8.803) 12.891 0.919 ( 0.198 -5.037 -0.124) 5.042 1.197 ( -7.160 -0.107 -2.493) 7.582 1.326 ( 2.200 7.248 -5.706) 9.483 1.621 ( 2.407 2.237 2.836) 4.340 1.978 ( -2.834 -0.053 2.696) 3.912 2.349 ( 7.682 -2.636 0.990) 8.181 2.614 ( -6.346 0.657 -0.367) 6.390 3.142 ( -6.245 -21.883 1.003) 22.779 3.397 ( 2.461 -28.430 -11.052) 30.602 3.887 ( -3.125 -20.495 16.833) 26.705 4.656 ( 0.752 23.626 11.281) 26.192 5.209 ( -1.395 10.156 -5.316) 11.548 5.407 ( 4.098 3.901 5.497) 7.889 5.796 ( 3.439 -15.823 15.926) 22.711 6.565 ( -0.695 -5.524 -4.393) 7.092 7.024 ( -2.471 -6.234 9.317) 11.480 7.145 ( 0.051 -8.367 -13.877) 16.204 7.893 ( 2.997 -0.218 -5.385) 6.166 8.638 ( -1.649 -8.174 6.708) 10.702 8.979 ( -2.019 17.918 2.377) 18.187 9.430 ( -3.229 13.368 4.640) 14.514 10.299 ( 13.439 -24.222 -30.137) 40.933 10.607 ( 6.088 -17.269 -5.144) 19.019 11.216 ( -3.356 4.622 -9.301) 10.915 12.398 ( 12.891 34.265 -34.303) 50.169 12.555 ( -6.959 -33.108 37.023) 50.152 12.934 ( -6.749 -9.494 -6.636) 13.407 13.502 ( 10.795 17.847 -2.911) 21.060 14.486 ( -12.352 17.724 24.814) 32.900 15.543 ( -6.801 -9.969 16.578) 20.505 16.600 ( -4.510 20.600 11.756) 24.143 19.007 ( 6.558 -2.344 2.838) 7.520 19.337 ( 2.470 -10.102 -6.793) 12.422 19.522 ( 1.093 -8.412 -9.541) 12.767 19.811 ( -1.686 20.980 -8.602) 22.737 ======================= Grid point 190 (87/366) ======================= q-point: (-0.09 -0.55 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.010 ( 1.552 -5.471 -2.854) 6.363 1.016 ( 2.355 -7.286 -6.105) 9.793 1.139 ( -2.052 2.270 -1.839) 3.570 1.189 ( 2.302 7.452 -6.191) 9.958 1.617 ( 0.680 0.383 4.556) 4.622 1.956 ( -2.544 0.903 3.812) 4.671 2.440 ( 2.593 -1.565 0.463) 3.064 2.591 ( -2.538 -0.915 2.860) 3.932 3.519 ( -4.922 -23.302 2.170) 23.915 3.821 ( 1.534 -16.936 -5.670) 17.925 4.134 ( -3.571 1.560 11.214) 11.872 4.316 ( 1.223 12.367 12.678) 17.753 5.028 ( -2.567 3.837 -8.414) 9.597 5.262 ( 4.042 11.853 1.903) 12.667 6.135 ( 2.519 -10.164 12.198) 16.076 6.575 ( -4.124 0.293 2.209) 4.688 7.164 ( -2.030 -3.199 0.525) 3.825 7.179 ( 1.122 -2.532 -6.755) 7.301 8.039 ( 3.023 -15.857 -5.957) 17.207 8.433 ( 1.835 22.799 -5.377) 23.497 8.986 ( -4.255 -12.053 12.274) 17.721 9.175 ( -3.608 14.059 6.520) 15.912 10.681 ( 9.438 -14.818 -14.632) 22.864 10.934 ( 3.595 -1.211 -14.078) 14.580 11.160 ( 8.094 -18.112 -24.635) 31.630 11.770 ( 13.181 33.046 -35.254) 50.087 12.942 ( -6.334 -8.834 2.399) 11.132 13.109 ( 0.249 -2.788 0.321) 2.817 13.476 ( 1.347 -16.879 28.686) 33.310 14.030 ( -18.705 28.086 33.157) 47.309 15.831 ( -5.064 -20.258 12.328) 24.249 16.213 ( -4.324 22.173 11.549) 25.372 19.103 ( 5.715 -2.915 2.280) 6.809 19.286 ( -6.488 6.287 -4.972) 10.312 19.607 ( 4.785 -3.143 -9.775) 11.328 19.689 ( 4.703 -0.879 -9.544) 10.676 ======================= Grid point 197 (88/366) ======================= q-point: (-0.45 -0.45 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.546 ( -5.541 0.000 11.030) 12.344 0.668 ( -2.831 0.000 3.496) 4.499 1.028 ( -3.861 0.000 1.982) 4.340 1.465 ( -17.234 0.000 28.507) 33.312 1.636 ( -0.152 0.000 0.521) 0.543 1.797 ( -7.849 0.000 -5.943) 9.845 1.969 ( -2.713 0.000 -4.927) 5.625 2.026 ( -7.630 0.000 7.747) 10.873 2.577 ( -8.456 0.000 -0.963) 8.511 2.636 ( -6.702 0.000 10.196) 12.202 3.474 ( 0.487 -0.000 -13.157) 13.166 3.792 ( -3.686 0.000 13.446) 13.942 5.556 ( -0.980 0.000 5.468) 5.555 5.560 ( 4.484 -0.000 0.184) 4.488 6.052 ( 6.469 -0.000 -15.622) 16.908 6.223 ( -0.708 0.000 12.080) 12.100 6.504 ( 3.417 -0.000 6.983) 7.774 6.717 ( 2.817 -0.000 -0.259) 2.829 7.679 ( -2.378 0.000 12.462) 12.687 8.316 ( 4.310 -0.000 -1.849) 4.689 9.637 ( -1.234 0.000 2.703) 2.971 9.647 ( -8.159 0.000 24.097) 25.441 9.779 ( -2.987 0.000 2.498) 3.894 9.971 ( -0.752 0.000 -2.807) 2.905 10.296 ( -0.509 0.000 0.799) 0.947 11.701 ( 0.308 -0.000 -6.375) 6.382 12.775 ( -8.716 0.000 -4.361) 9.746 13.332 ( -2.177 0.000 5.744) 6.143 14.784 ( 13.074 -0.000 -22.645) 26.148 15.274 ( 5.048 -0.000 -13.177) 14.111 15.642 ( 3.301 -0.000 -6.735) 7.500 17.546 ( 2.524 -0.000 -6.116) 6.616 17.651 ( -11.426 0.000 32.522) 34.471 18.818 ( 4.410 -0.000 2.256) 4.953 18.911 ( -3.184 0.000 7.995) 8.606 22.182 ( 6.940 -0.000 -29.018) 29.837 ======================= Grid point 198 (89/366) ======================= q-point: (-0.36 -0.45 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.541 ( -3.348 -1.120 5.811) 6.800 0.689 ( -2.166 -3.399 2.246) 4.614 1.061 ( -7.079 -5.566 2.486) 9.342 1.508 ( -12.615 -10.639 9.990) 19.290 1.605 ( -0.305 2.895 -1.395) 3.228 1.726 ( -12.563 -1.593 -6.685) 14.320 1.950 ( -2.871 -2.844 1.853) 4.446 2.177 ( -5.616 -16.333 -0.876) 17.294 2.602 ( -7.027 -2.792 11.553) 13.807 2.660 ( -7.989 -11.217 7.637) 15.747 3.297 ( -0.208 14.446 -13.197) 19.568 3.972 ( -3.501 -18.623 14.778) 24.031 5.534 ( 0.856 2.843 3.768) 4.798 5.604 ( 3.654 0.254 1.825) 4.092 5.993 ( 2.182 11.702 4.761) 12.821 6.284 ( 5.878 -9.031 -5.874) 12.273 6.548 ( 3.772 -0.245 0.493) 3.812 6.783 ( 2.329 -4.064 3.467) 5.828 7.806 ( -2.305 -10.813 13.538) 17.479 8.302 ( 4.089 4.148 -1.621) 6.046 9.432 ( 0.296 4.926 -0.618) 4.973 9.732 ( -2.801 3.102 1.654) 4.495 10.002 ( -1.823 -6.417 2.770) 7.223 10.016 ( 0.492 -10.148 2.927) 10.574 10.352 ( -6.329 -14.889 18.748) 24.764 11.669 ( 0.757 1.569 -5.563) 5.829 12.714 ( -11.097 -2.306 -6.261) 12.949 13.347 ( -1.376 -0.716 3.488) 3.817 14.614 ( 11.414 19.680 -17.954) 28.982 15.083 ( 7.869 16.577 -19.668) 26.899 15.704 ( -1.345 -2.326 4.816) 5.515 17.404 ( -3.926 9.199 10.332) 14.380 17.997 ( -1.425 -27.533 12.331) 30.202 18.871 ( 5.977 -1.231 2.908) 6.760 18.970 ( -1.462 -6.255 4.960) 8.116 21.854 ( 1.571 30.212 -29.433) 42.208 ======================= Grid point 199 (90/366) ======================= q-point: (-0.27 -0.45 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.587 ( -0.028 -4.804 -2.284) 5.319 0.757 ( -0.787 -4.296 0.769) 4.435 1.097 ( -11.104 -4.579 -1.385) 12.090 1.536 ( 0.431 4.024 -3.273) 5.205 1.630 ( -4.270 -3.655 -5.523) 7.880 1.746 ( -8.887 -13.538 -4.718) 16.868 2.077 ( -3.410 -12.479 1.254) 12.997 2.441 ( -2.976 -19.142 -12.499) 23.054 2.646 ( -3.029 -4.267 16.600) 17.406 2.842 ( -9.246 3.089 -5.690) 11.287 3.104 ( -0.665 -10.587 13.695) 17.323 4.464 ( -1.563 -31.469 16.804) 35.709 5.471 ( 1.096 6.968 4.739) 8.497 5.535 ( 0.949 11.788 2.098) 12.011 5.818 ( 3.436 7.518 9.243) 12.400 6.456 ( 7.092 -1.083 -2.715) 7.671 6.649 ( 3.655 -13.794 -14.508) 20.350 6.878 ( 0.166 -3.614 6.977) 7.859 8.013 ( -1.587 -5.821 8.635) 10.534 8.255 ( 1.750 -0.506 2.401) 3.014 9.428 ( 3.311 -0.844 -9.085) 9.706 9.664 ( -0.581 0.595 -2.660) 2.787 9.959 ( 2.244 10.306 -5.162) 11.743 10.136 ( 0.546 -9.985 -1.566) 10.122 10.886 ( -6.930 -30.088 28.816) 42.233 11.682 ( 3.042 -5.208 4.275) 7.392 12.682 ( -11.702 -4.866 -8.035) 15.006 13.289 ( 2.804 9.455 -7.762) 12.550 14.249 ( 10.067 22.435 -10.586) 26.772 14.801 ( 6.404 12.460 -16.465) 21.619 15.668 ( -7.416 6.429 18.888) 21.286 17.210 ( -4.667 12.825 12.100) 18.239 18.565 ( 4.806 -29.384 3.394) 29.967 18.952 ( 7.207 -1.923 2.677) 7.925 19.129 ( 0.521 -10.638 -0.748) 10.677 21.067 ( -8.542 42.640 -24.848) 50.086 ======================= Grid point 200 (91/366) ======================= q-point: (-0.18 -0.45 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.698 ( 2.112 -7.942 -7.487) 11.117 0.832 ( -0.516 -4.431 0.215) 4.466 1.093 ( -9.396 -4.179 -3.066) 10.731 1.444 ( 1.632 5.850 -4.405) 7.502 1.649 ( -1.842 -1.534 1.381) 2.767 1.906 ( -2.602 -7.506 -2.049) 8.204 2.274 ( 1.080 -10.100 -6.757) 12.199 2.615 ( -7.828 5.305 -6.444) 11.444 2.772 ( -3.448 -17.924 0.633) 18.263 2.888 ( 2.468 -22.878 1.431) 23.055 3.513 ( -2.440 -23.305 20.253) 30.972 4.975 ( 0.505 -5.168 9.407) 10.745 5.319 ( 3.209 -2.314 13.755) 14.313 5.359 ( -2.548 8.506 -0.120) 8.881 5.783 ( 5.674 3.770 7.795) 10.353 6.483 ( 2.887 -1.488 -4.594) 5.626 6.904 ( 2.252 -13.836 -14.193) 19.949 6.949 ( -2.576 -3.197 8.157) 9.132 7.973 ( 2.419 6.376 -3.640) 7.730 8.426 ( -2.857 -12.892 10.560) 16.908 9.295 ( -0.408 14.448 -2.690) 14.702 9.647 ( -2.788 9.963 3.428) 10.899 9.921 ( 11.189 -14.887 -25.667) 31.712 10.359 ( 2.897 -13.813 -0.918) 14.144 11.188 ( -4.799 -4.238 -0.090) 6.403 12.065 ( 1.574 -27.694 32.454) 42.693 12.693 ( -10.936 -7.236 -8.274) 15.505 12.963 ( 10.196 25.755 -25.815) 37.864 13.918 ( 11.621 20.413 -5.080) 24.032 14.660 ( -2.204 5.221 2.613) 6.241 15.522 ( -9.891 6.790 23.764) 26.621 16.942 ( -4.662 17.138 12.223) 21.560 19.017 ( 8.036 -6.148 2.480) 10.418 19.085 ( 4.920 -15.851 -2.735) 16.821 19.329 ( 1.552 -11.060 -6.099) 12.725 20.234 ( -10.895 33.120 -16.727) 38.671 ======================= Grid point 201 (92/366) ======================= q-point: (-0.09 -0.45 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.850 ( 3.160 -9.144 -9.026) 13.231 0.918 ( -0.302 -5.701 -0.307) 5.717 1.108 ( -4.511 -2.753 -1.340) 5.452 1.326 ( 2.289 7.254 -5.707) 9.509 1.655 ( -0.075 0.793 4.262) 4.336 1.955 ( -2.399 -0.665 2.206) 3.327 2.392 ( -1.951 -2.035 -2.761) 3.946 2.572 ( 2.337 -5.096 -2.620) 6.188 3.093 ( -4.470 -20.205 8.098) 22.221 3.386 ( 4.134 -27.994 -8.893) 29.662 3.941 ( -2.988 -19.325 18.229) 26.734 4.708 ( -0.239 22.439 6.574) 23.383 5.153 ( -3.115 11.309 -3.021) 12.113 5.490 ( 4.950 6.374 1.711) 8.250 5.955 ( 6.576 -16.283 18.221) 25.306 6.526 ( -2.048 -3.010 -3.723) 5.208 7.024 ( -4.845 -6.566 4.363) 9.253 7.070 ( -0.044 -7.663 -9.283) 12.037 7.911 ( 4.288 -0.265 -6.600) 7.875 8.649 ( -1.246 -8.033 4.867) 9.475 8.962 ( -2.318 17.409 2.200) 17.700 9.412 ( -3.671 13.222 6.504) 15.186 10.319 ( 12.981 -24.719 -30.225) 41.147 10.666 ( 5.891 -17.819 -3.550) 19.101 11.128 ( -2.378 4.620 -8.822) 10.238 12.388 ( 12.974 33.803 -35.962) 51.032 12.621 ( -7.240 -21.063 18.060) 28.674 12.840 ( -5.266 -17.249 8.651) 20.003 13.656 ( 12.666 16.029 0.564) 20.437 14.446 ( -13.155 19.335 25.489) 34.592 15.538 ( -6.596 -10.166 15.731) 19.857 16.602 ( -4.501 20.571 12.019) 24.246 19.108 ( 5.585 -1.447 2.206) 6.177 19.291 ( -4.356 -1.846 -6.596) 8.117 19.492 ( 2.275 -8.139 -9.602) 12.791 19.765 ( 2.311 9.374 -8.943) 13.161 ======================= Grid point 209 (93/366) ======================= q-point: (-0.36 -0.36 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.528 ( -6.140 0.000 11.966) 13.450 0.642 ( -4.017 0.000 3.734) 5.484 0.968 ( -6.746 0.000 2.402) 7.161 1.386 ( -17.190 0.000 28.971) 33.687 1.574 ( -18.868 0.000 -8.018) 20.501 1.636 ( -0.131 0.000 0.365) 0.387 1.909 ( -3.728 0.000 -0.783) 3.810 1.950 ( -7.262 0.000 2.280) 7.612 2.450 ( -10.924 0.000 3.283) 11.406 2.593 ( -7.568 0.000 10.683) 13.092 3.417 ( 3.561 -0.000 -19.504) 19.826 3.812 ( -3.823 0.000 12.615) 13.181 5.580 ( -0.375 0.000 6.852) 6.863 5.633 ( 5.891 -0.000 0.374) 5.902 6.066 ( 8.102 -0.000 -16.190) 18.104 6.286 ( -0.097 0.000 13.324) 13.324 6.591 ( 3.193 -0.000 8.230) 8.828 6.770 ( 5.262 -0.000 -0.149) 5.264 7.713 ( -2.450 0.000 12.798) 13.031 8.370 ( 4.837 -0.000 -1.190) 4.981 9.630 ( -1.736 0.000 2.446) 2.999 9.689 ( -6.166 0.000 29.334) 29.975 9.751 ( -3.314 0.000 3.330) 4.698 9.937 ( -1.905 0.000 -3.022) 3.572 10.288 ( -1.309 0.000 0.980) 1.635 11.670 ( 0.212 -0.000 -6.411) 6.415 12.590 ( -13.824 0.000 -6.417) 15.241 13.333 ( -2.180 0.000 5.877) 6.268 14.850 ( 14.037 -0.000 -21.974) 26.074 15.275 ( 5.543 -0.000 -13.525) 14.616 15.652 ( 3.342 -0.000 -6.533) 7.338 17.548 ( 2.595 -0.000 -6.135) 6.662 17.678 ( -10.800 0.000 34.760) 36.399 18.886 ( -1.135 0.000 7.277) 7.365 18.944 ( 6.174 -0.000 3.718) 7.207 22.084 ( 3.857 -0.000 -37.518) 37.716 ======================= Grid point 210 (94/366) ======================= q-point: (-0.27 -0.36 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.523 ( -3.870 -1.751 5.576) 7.009 0.669 ( -2.770 -4.356 2.776) 5.861 0.951 ( -10.769 -2.380 0.888) 11.064 1.392 ( -12.052 -9.049 8.685) 17.395 1.452 ( -18.820 -4.726 -5.212) 20.092 1.616 ( -0.593 2.023 -0.089) 2.110 1.920 ( -4.041 -4.566 4.460) 7.554 2.088 ( -4.048 -14.681 -6.976) 16.751 2.556 ( -10.217 -13.317 14.808) 22.383 2.610 ( -6.547 -6.750 10.396) 14.018 3.231 ( 0.980 14.100 -14.296) 20.103 4.004 ( -3.055 -20.498 14.220) 25.133 5.558 ( -0.777 3.359 5.693) 6.655 5.682 ( 6.691 1.030 -0.280) 6.776 6.047 ( 2.689 9.470 3.126) 10.329 6.340 ( 6.420 -9.135 -5.029) 12.245 6.603 ( 3.285 3.120 1.784) 4.869 6.844 ( 3.823 -3.153 3.416) 6.019 7.844 ( -2.457 -10.749 12.800) 16.894 8.350 ( 4.300 4.984 -1.658) 6.789 9.431 ( 0.010 5.068 -0.286) 5.076 9.704 ( -3.045 3.107 2.730) 5.136 9.976 ( -1.445 -6.528 -2.315) 7.075 10.063 ( 2.528 -5.580 4.520) 7.612 10.393 ( -3.888 -23.092 26.206) 35.144 11.656 ( 1.267 -0.558 -3.687) 3.938 12.503 ( -14.152 -2.894 -7.164) 16.124 13.347 ( -1.348 -0.560 3.476) 3.770 14.680 ( 11.919 19.792 -16.733) 28.527 15.088 ( 8.210 16.571 -19.563) 26.920 15.711 ( -1.321 -1.990 4.685) 5.259 17.407 ( -3.725 9.358 10.276) 14.389 18.057 ( 0.165 -29.427 14.282) 32.710 18.944 ( -0.363 -5.257 5.332) 7.497 19.019 ( 7.261 -2.034 2.802) 8.044 21.650 ( -6.323 34.648 -39.331) 52.796 ======================= Grid point 211 (95/366) ======================= q-point: (-0.18 -0.36 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.573 ( 0.047 -4.928 -2.892) 5.714 0.754 ( -0.282 -4.541 0.892) 4.637 0.918 ( -12.604 -5.128 -4.846) 14.445 1.483 ( -7.746 -6.753 -2.535) 10.584 1.555 ( -1.479 -1.651 -2.861) 3.619 1.623 ( -4.759 -16.444 -5.342) 17.933 2.041 ( -3.674 -10.091 3.280) 11.229 2.348 ( -1.096 -20.112 -11.243) 23.067 2.665 ( -10.097 1.942 -4.971) 11.421 2.698 ( -3.483 -5.036 13.265) 14.609 3.184 ( -0.895 -14.643 18.990) 23.997 4.545 ( 0.485 -33.316 16.649) 37.247 5.477 ( -2.114 6.288 2.661) 7.147 5.586 ( 3.654 14.796 2.368) 15.423 5.917 ( 3.765 5.380 9.402) 11.468 6.530 ( 5.210 3.446 -2.598) 6.765 6.623 ( 4.253 -14.173 -14.350) 20.612 6.921 ( 0.848 -1.929 6.398) 6.736 8.028 ( -2.135 -4.775 6.318) 8.202 8.292 ( 2.003 0.246 1.839) 2.730 9.424 ( 2.739 0.008 -7.833) 8.298 9.644 ( -0.542 -0.423 -1.921) 2.040 9.957 ( 1.622 10.660 -5.339) 12.033 10.137 ( 0.635 -11.868 -1.380) 11.965 10.973 ( 0.816 -20.985 19.317) 28.534 11.782 ( 5.146 -13.642 14.563) 20.608 12.471 ( -12.699 -5.849 -7.573) 15.900 13.287 ( 3.057 9.498 -8.187) 12.906 14.346 ( 11.868 20.391 -7.968) 24.902 14.801 ( 6.450 13.219 -16.113) 21.817 15.666 ( -7.486 6.918 18.423) 21.055 17.213 ( -4.562 12.884 12.305) 18.391 18.658 ( 6.168 -29.012 3.827) 29.907 19.064 ( 6.379 -3.167 2.312) 7.488 19.139 ( 2.074 -8.228 -0.528) 8.501 20.735 ( -19.772 40.354 -30.578) 54.354 ======================= Grid point 212 (96/366) ======================= q-point: (-0.09 -0.36 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.689 ( 2.525 -8.237 -7.838) 11.648 0.818 ( -1.876 -4.246 -0.420) 4.661 0.975 ( -5.336 -7.814 -2.075) 9.687 1.442 ( 1.533 5.434 -4.454) 7.191 1.614 ( -4.987 -5.407 3.837) 8.297 1.870 ( -0.559 -9.630 -3.290) 10.192 2.251 ( 0.710 -14.994 -5.221) 15.892 2.469 ( -7.911 2.953 -7.160) 11.071 2.738 ( -0.307 -22.486 -3.241) 22.720 2.960 ( 1.971 -18.460 11.916) 22.060 3.588 ( -2.960 -22.170 20.866) 30.588 5.028 ( 1.600 2.023 4.485) 5.173 5.313 ( -2.946 6.604 -0.085) 7.232 5.440 ( 2.821 -5.743 13.134) 14.610 5.904 ( 5.380 2.115 8.997) 10.694 6.483 ( 1.093 1.235 -5.498) 5.740 6.854 ( 0.844 -11.183 -12.502) 16.795 6.962 ( -1.727 -1.757 7.407) 7.806 7.987 ( 2.974 5.662 -4.999) 8.118 8.437 ( -2.950 -12.086 8.323) 14.968 9.278 ( -0.235 14.756 -1.667) 14.852 9.628 ( -3.085 10.078 4.777) 11.572 9.929 ( 10.021 -15.542 -25.252) 31.299 10.395 ( 2.806 -15.603 -0.551) 15.863 11.143 ( -0.648 -0.185 -3.272) 3.341 12.249 ( 1.012 -22.632 25.671) 34.238 12.520 ( -9.250 -10.565 -1.205) 14.094 12.968 ( 11.107 25.111 -26.421) 38.105 14.068 ( 13.475 19.275 -2.329) 23.633 14.643 ( -2.600 6.380 3.310) 7.643 15.513 ( -9.710 6.804 22.804) 25.702 16.944 ( -4.628 17.152 12.505) 21.724 19.100 ( 2.227 -12.509 -2.071) 12.873 19.147 ( 5.898 -3.282 0.580) 6.775 19.317 ( 1.567 -10.120 -6.287) 12.017 19.981 ( -12.116 20.807 -16.962) 29.452 ======================= Grid point 221 (97/366) ======================= q-point: (-0.27 -0.27 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.511 ( -6.802 0.000 15.030) 16.498 0.596 ( -6.581 0.000 5.486) 8.568 0.881 ( -7.885 0.000 3.239) 8.524 1.161 ( -25.895 0.000 -11.334) 28.267 1.399 ( -14.087 0.000 37.597) 40.149 1.636 ( -0.095 0.000 0.156) 0.183 1.860 ( -4.554 0.000 3.243) 5.590 1.868 ( -5.016 0.000 -0.784) 5.077 2.331 ( -11.569 0.000 9.414) 14.915 2.549 ( -7.457 0.000 11.088) 13.363 3.351 ( 4.096 -0.000 -27.474) 27.778 3.821 ( -4.301 0.000 11.951) 12.701 5.618 ( 0.168 -0.000 8.433) 8.435 5.712 ( 5.659 -0.000 -0.564) 5.687 6.098 ( 9.502 -0.000 -16.834) 19.331 6.352 ( -0.806 0.000 12.940) 12.965 6.667 ( 1.656 -0.000 7.571) 7.750 6.853 ( 6.981 -0.000 0.274) 6.986 7.744 ( -2.935 0.000 12.401) 12.743 8.426 ( 4.363 -0.000 -1.774) 4.709 9.617 ( -2.020 0.000 2.321) 3.077 9.729 ( -3.270 0.000 5.141) 6.093 9.808 ( -1.362 0.000 35.774) 35.800 9.897 ( -2.377 0.000 2.967) 3.802 10.273 ( -1.796 0.000 1.080) 2.096 11.645 ( 0.871 -0.000 -5.283) 5.354 12.361 ( -14.528 0.000 -6.183) 15.789 13.335 ( -2.218 0.000 5.981) 6.379 14.925 ( 13.954 -0.000 -21.369) 25.522 15.280 ( 5.936 -0.000 -13.815) 15.036 15.662 ( 3.269 -0.000 -6.443) 7.224 17.550 ( 2.576 -0.000 -6.173) 6.689 17.732 ( -9.442 0.000 38.786) 39.918 18.889 ( -3.372 0.000 8.262) 8.923 19.075 ( 9.334 -0.000 2.554) 9.677 21.861 ( -2.460 0.000 -55.901) 55.955 ======================= Grid point 222 (98/366) ======================= q-point: (-0.18 -0.27 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.492 ( -5.515 -3.097 5.334) 8.274 0.640 ( -5.531 -5.583 3.975) 8.807 0.782 ( -12.011 1.271 -4.209) 12.790 1.164 ( -17.700 -14.850 -0.564) 23.112 1.314 ( -10.579 -2.722 15.866) 19.263 1.613 ( 0.012 2.381 -0.190) 2.389 1.892 ( -4.684 -5.555 7.625) 10.533 2.015 ( -0.634 -13.577 -7.135) 15.351 2.485 ( -10.771 -13.456 11.808) 20.893 2.586 ( -5.826 -6.799 11.716) 14.746 3.168 ( -1.477 8.543 -9.228) 12.662 4.041 ( -2.528 -23.922 14.249) 27.959 5.576 ( -1.067 5.018 6.237) 8.076 5.769 ( 7.154 1.345 -2.307) 7.636 6.093 ( 2.332 7.918 0.828) 8.296 6.396 ( 5.560 -8.606 -5.088) 11.439 6.648 ( 1.868 4.884 1.780) 5.524 6.918 ( 4.581 -1.579 3.123) 5.764 7.870 ( -3.060 -10.024 10.652) 14.944 8.394 ( 3.813 5.386 -2.824) 7.178 9.429 ( -0.271 5.419 0.124) 5.428 9.682 ( -2.903 3.203 4.542) 6.271 9.945 ( -1.267 -8.122 -2.293) 8.534 10.110 ( 2.555 4.325 -0.967) 5.116 10.573 ( 8.292 -33.797 35.878) 49.982 11.676 ( 3.345 -4.872 1.346) 6.061 12.284 ( -12.635 -3.367 -5.782) 14.297 13.347 ( -1.393 -0.379 3.313) 3.614 14.760 ( 12.539 18.610 -14.355) 26.639 15.097 ( 8.308 16.517 -19.157) 26.623 15.717 ( -1.517 -1.539 4.426) 4.925 17.413 ( -3.330 9.539 10.089) 14.278 18.161 ( 3.565 -31.138 17.662) 35.975 18.952 ( -1.932 -6.710 5.462) 8.865 19.144 ( 8.157 -0.277 2.018) 8.408 21.220 ( -23.379 40.060 -55.582) 72.393 ======================= Grid point 223 (99/366) ======================= q-point: (-0.09 -0.27 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.560 ( 0.411 -5.494 -3.235) 6.389 0.723 ( -9.873 -6.112 -5.065) 12.668 0.766 ( 0.115 -7.942 0.599) 7.966 1.355 ( -9.570 -15.892 2.241) 18.686 1.529 ( 0.585 -11.053 -5.809) 12.500 1.570 ( -0.904 -5.820 -1.169) 6.004 2.015 ( -3.512 -8.981 5.398) 11.051 2.303 ( 1.521 -20.054 -6.598) 21.166 2.487 ( -9.158 2.611 -7.628) 12.201 2.739 ( -3.891 -11.435 17.161) 20.986 3.263 ( -3.583 -16.199 21.056) 26.807 4.645 ( 1.039 -35.080 16.254) 38.677 5.458 ( -1.765 9.157 0.460) 9.337 5.637 ( 1.946 14.694 2.086) 14.969 6.008 ( 2.691 2.970 7.310) 8.336 6.539 ( 0.041 3.314 -5.909) 6.775 6.636 ( 6.846 -9.654 -10.607) 15.892 6.966 ( 1.105 -0.145 5.466) 5.578 8.021 ( -2.759 -4.706 3.584) 6.527 8.323 ( 1.527 1.312 0.288) 2.034 9.420 ( 2.487 0.308 -6.657) 7.113 9.631 ( -0.337 -0.915 -0.675) 1.185 9.946 ( 0.955 11.038 -5.355) 12.306 10.139 ( 0.625 -13.694 -1.142) 13.756 11.096 ( 6.712 -7.743 6.148) 11.950 11.975 ( 8.133 -18.355 21.989) 29.776 12.288 ( -9.194 -7.279 -3.581) 12.262 13.286 ( 3.470 9.157 -8.756) 13.137 14.488 ( 14.386 17.958 -5.019) 23.551 14.804 ( 6.223 14.267 -15.327) 21.845 15.659 ( -7.874 7.346 17.801) 20.805 17.218 ( -4.436 13.019 12.623) 18.668 18.773 ( 8.131 -25.055 4.480) 26.719 19.114 ( 1.167 -10.009 -0.100) 10.078 19.194 ( 4.209 0.001 0.374) 4.226 20.222 ( -30.201 28.252 -32.794) 52.780 ======================= Grid point 233 (100/366) ======================= q-point: (-0.18 -0.18 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.496 ( -9.339 0.000 13.191) 16.163 0.525 ( -9.920 0.000 10.965) 14.786 0.727 ( -27.627 0.000 -5.134) 28.100 0.803 ( -5.931 0.000 3.295) 6.785 1.508 ( -1.214 0.000 43.793) 43.810 1.635 ( -0.074 0.000 -0.013) 0.075 1.820 ( -1.634 0.000 0.517) 1.714 1.830 ( -4.655 0.000 11.263) 12.187 2.244 ( -10.498 0.000 14.534) 17.929 2.509 ( -6.881 0.000 9.926) 12.077 3.199 ( -4.150 0.000 -35.737) 35.977 3.825 ( -4.487 0.000 12.143) 12.946 5.677 ( 1.715 -0.000 9.281) 9.438 5.772 ( 4.168 -0.000 -2.225) 4.725 6.141 ( 10.081 -0.000 -17.542) 20.232 6.388 ( -2.887 0.000 9.268) 9.707 6.709 ( -0.659 0.000 5.516) 5.555 6.959 ( 7.969 -0.000 1.586) 8.125 7.762 ( -3.842 0.000 11.303) 11.938 8.462 ( 2.931 -0.000 -3.608) 4.648 9.602 ( -2.112 0.000 2.517) 3.285 9.720 ( -2.842 0.000 7.171) 7.714 9.837 ( -1.188 0.000 -3.527) 3.722 10.171 ( 15.296 -0.000 64.635) 66.420 10.253 ( -1.806 0.000 1.054) 2.091 11.645 ( 2.422 -0.000 -2.418) 3.423 12.161 ( -10.646 0.000 -3.574) 11.230 13.336 ( -2.305 0.000 5.890) 6.325 15.002 ( 13.512 -0.000 -18.145) 22.623 15.288 ( 6.092 -0.000 -13.969) 15.240 15.668 ( 2.511 -0.000 -6.916) 7.357 17.552 ( 2.525 -0.000 -6.205) 6.699 17.863 ( -2.273 0.000 47.703) 47.757 18.888 ( -3.335 0.000 8.368) 9.008 19.201 ( 7.401 -0.000 1.548) 7.561 21.325 ( -26.456 0.000 -92.059) 95.785 ======================= Grid point 234 (101/366) ======================= q-point: (-0.09 -0.18 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.387 ( -13.809 -7.785 -2.184) 16.002 0.515 ( -7.975 -6.648 2.877) 10.774 0.707 ( -0.257 -2.615 3.751) 4.580 0.997 ( -12.007 -15.998 11.783) 23.215 1.288 ( -6.955 3.389 19.008) 20.523 1.613 ( 0.084 2.420 -0.097) 2.424 1.880 ( -4.021 -5.270 10.349) 12.290 2.009 ( 3.952 -12.687 -2.848) 13.590 2.396 ( -7.630 -5.262 3.267) 9.828 2.576 ( -5.116 -8.276 12.375) 15.742 3.085 ( -8.543 -5.468 3.267) 10.656 4.087 ( -2.313 -27.889 15.245) 31.868 5.595 ( -1.172 7.062 6.559) 9.709 5.843 ( 6.478 2.546 -4.978) 8.557 6.106 ( -0.258 7.030 -2.823) 7.580 6.430 ( 3.863 -7.529 -6.072) 10.415 6.670 ( 0.638 4.162 0.183) 4.215 6.995 ( 4.207 0.753 3.283) 5.389 7.869 ( -4.266 -8.621 7.460) 12.173 8.418 ( 2.645 5.155 -4.999) 7.652 9.425 ( -0.515 5.748 0.421) 5.786 9.675 ( -2.380 3.362 6.386) 7.599 9.921 ( -0.574 -9.384 -1.800) 9.572 10.121 ( 0.805 8.221 -2.651) 8.675 10.979 ( 23.728 -21.433 24.586) 40.335 11.796 ( 10.878 -14.349 12.180) 21.739 12.125 ( -7.254 -3.567 -2.413) 8.436 13.344 ( -1.476 -0.246 2.798) 3.173 14.880 ( 15.331 15.761 -9.898) 24.112 15.107 ( 7.605 16.275 -17.920) 25.374 15.709 ( -3.342 -1.213 3.345) 4.882 17.424 ( -2.699 9.772 9.483) 13.881 18.392 ( 18.258 -28.847 24.811) 42.203 18.954 ( -1.913 -7.060 5.514) 9.160 19.237 ( 3.649 1.194 0.118) 3.841 20.367 ( -55.987 31.379 -66.833) 92.660 ======================= Grid point 245 (102/366) ======================= q-point: (-0.09 -0.09 0.09) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.190 ( -24.516 0.000 -6.977) 25.490 0.471 ( -8.790 0.000 19.426) 21.323 0.622 ( -6.641 0.000 30.018) 30.744 0.759 ( -3.155 0.000 2.525) 4.041 1.634 ( -0.066 0.000 -0.106) 0.125 1.716 ( 2.359 -0.000 5.806) 6.267 1.832 ( 1.192 -0.000 4.688) 4.837 2.019 ( 22.263 -0.000 44.330) 49.607 2.206 ( -7.695 0.000 17.918) 19.500 2.449 ( -8.928 0.000 0.134) 8.929 2.812 ( -29.576 0.000 -20.641) 36.066 3.834 ( -4.126 0.000 13.908) 14.508 5.752 ( 2.268 -0.000 6.496) 6.880 5.798 ( 2.103 -0.000 -4.067) 4.579 6.178 ( 9.383 -0.000 -18.325) 20.588 6.363 ( -5.703 0.000 3.147) 6.514 6.706 ( -3.034 0.000 2.746) 4.092 7.070 ( 6.836 -0.000 -0.554) 6.859 7.758 ( -4.964 0.000 9.724) 10.918 8.464 ( 1.061 -0.000 -5.772) 5.868 9.588 ( -2.024 0.000 2.867) 3.510 9.728 ( -2.224 0.000 8.532) 8.817 9.811 ( 0.236 -0.000 -3.214) 3.223 10.237 ( -1.313 0.000 0.904) 1.594 10.957 ( 46.384 -0.000 46.984) 66.022 11.695 ( 4.203 -0.000 2.016) 4.662 12.056 ( -3.476 0.000 0.727) 3.552 13.332 ( -2.661 0.000 5.098) 5.751 15.120 ( 15.073 -0.000 -9.385) 17.756 15.296 ( 5.974 -0.000 -13.960) 15.184 15.627 ( -4.249 0.000 -10.180) 11.031 17.553 ( 2.476 -0.000 -6.224) 6.698 18.370 ( 48.855 -0.000 65.604) 81.796 18.888 ( -3.208 0.000 8.531) 9.115 19.279 ( 3.355 -0.000 0.105) 3.357 19.952 (-103.061 0.000 -102.722) 145.511 ======================= Grid point 246 (103/366) ======================= q-point: ( 0.00 0.00 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.676 ( 16.338 -0.000 12.881) 20.805 0.785 ( -0.245 0.000 3.217) 3.226 0.875 ( -2.631 0.000 14.662) 14.896 1.147 ( -0.954 0.000 15.668) 15.697 1.623 ( 0.544 -0.000 -0.861) 1.018 1.752 ( -0.083 0.000 1.877) 1.879 2.120 ( 2.816 -0.000 12.985) 13.287 2.331 ( -4.130 0.000 13.931) 14.530 2.718 ( -7.358 0.000 29.356) 30.264 2.759 ( 14.143 -0.000 8.030) 16.263 3.010 ( -15.826 0.000 23.966) 28.720 4.339 ( -9.779 0.000 32.935) 34.356 5.631 ( 0.539 -0.000 -10.304) 10.318 5.797 ( 8.467 -0.000 -21.742) 23.332 5.903 ( -3.512 0.000 7.518) 8.298 6.318 ( -6.653 0.000 3.057) 7.322 6.566 ( -3.779 0.000 -8.513) 9.314 6.998 ( -1.487 0.000 -4.723) 4.951 7.904 ( -6.823 0.000 6.974) 9.756 8.324 ( -2.176 0.000 -1.675) 2.746 9.657 ( -0.553 0.000 1.426) 1.529 9.744 ( 4.112 -0.000 -4.712) 6.254 9.846 ( -0.587 0.000 2.617) 2.682 10.353 ( -6.030 0.000 13.720) 14.987 11.240 ( -6.619 0.000 -1.099) 6.709 11.594 ( -19.590 0.000 6.256) 20.565 12.216 ( 7.148 -0.000 8.780) 11.321 13.427 ( -1.376 0.000 3.997) 4.227 14.694 ( -10.318 0.000 -25.573) 27.576 14.937 ( 9.868 -0.000 -23.296) 25.300 15.387 ( 4.248 -0.000 -7.703) 8.797 17.376 ( 4.732 -0.000 -12.116) 13.007 18.608 ( -25.926 0.000 17.921) 31.517 19.106 ( -4.634 0.000 12.707) 13.526 19.255 ( -3.154 0.000 -1.750) 3.607 19.968 ( 63.016 -0.000 -4.393) 63.169 ======================= Grid point 247 (104/366) ======================= q-point: ( 0.09 0.00 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.721 ( -1.149 8.044 9.572) 12.556 0.786 ( 0.014 0.685 3.267) 3.338 0.888 ( 10.143 -2.644 9.669) 14.260 1.323 ( 1.307 -9.575 13.455) 16.566 1.580 ( 1.209 3.280 -0.415) 3.520 1.749 ( 0.464 1.424 10.140) 10.250 2.140 ( -4.153 1.845 18.985) 19.522 2.352 ( 3.986 -7.370 9.988) 13.038 2.671 ( 10.753 3.429 10.203) 15.215 2.956 ( -1.199 -6.294 17.436) 18.576 3.243 ( -15.142 -21.159 18.848) 32.128 4.586 ( -13.616 -23.472 29.311) 39.943 5.613 ( -0.959 1.832 -8.222) 8.478 5.670 ( 7.878 11.878 -15.086) 20.755 5.910 ( -7.025 -2.076 5.147) 8.953 6.316 ( -3.889 -2.311 -0.250) 4.530 6.475 ( -1.441 2.913 -9.417) 9.962 7.004 ( -2.963 -2.920 -3.053) 5.160 7.909 ( -3.961 -2.734 3.453) 5.923 8.289 ( -3.124 0.607 2.007) 3.762 9.477 ( -2.551 15.309 4.975) 16.298 9.775 ( 1.860 5.327 -1.671) 5.884 9.852 ( 3.559 -6.277 -6.319) 9.591 10.166 ( -5.905 10.270 11.293) 16.367 11.276 ( 2.433 -1.741 -1.653) 3.418 11.796 ( -28.144 -30.296 12.834) 43.297 12.297 ( 9.955 -0.505 8.027) 12.798 13.344 ( 2.953 10.999 -5.334) 12.576 14.461 ( -9.541 10.384 -24.386) 28.170 14.733 ( 6.392 12.587 -14.368) 20.143 15.633 ( 2.977 -16.717 -4.046) 17.455 17.425 ( 2.898 -3.087 -7.733) 8.817 18.581 ( -17.524 -8.267 17.202) 25.910 19.105 ( -3.763 0.068 8.990) 9.746 19.216 ( -4.093 0.663 -1.645) 4.461 20.206 ( 53.349 15.287 -11.930) 56.763 ======================= Grid point 248 (105/366) ======================= q-point: ( 0.18 0.00 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.585 ( -0.191 5.754 3.050) 6.515 0.799 ( -0.043 -1.301 2.522) 2.838 1.031 ( 7.345 -3.534 6.336) 10.324 1.441 ( 3.086 3.040 -2.050) 4.793 1.620 ( 1.116 -7.556 6.982) 10.348 1.817 ( 2.655 -5.210 9.926) 11.520 2.202 ( -0.706 -4.891 12.849) 13.767 2.596 ( 6.138 -8.890 2.688) 11.132 2.741 ( 7.151 -5.284 7.926) 11.911 3.108 ( -7.762 -8.900 15.591) 19.558 3.580 ( -14.553 -22.435 19.487) 33.088 5.032 ( -15.275 -27.082 21.866) 38.011 5.398 ( 6.725 19.442 -3.054) 20.798 5.479 ( -2.342 9.945 -10.994) 15.009 5.912 ( -9.191 -2.020 7.527) 12.050 6.316 ( -2.920 -1.219 -4.742) 5.701 6.498 ( 2.753 -8.715 -9.728) 13.348 7.028 ( -2.690 -2.110 -0.359) 3.437 7.924 ( 1.678 1.193 -4.714) 5.144 8.335 ( -4.457 -7.650 11.209) 14.284 9.269 ( 0.861 5.191 -4.683) 7.044 9.619 ( 3.697 12.191 -7.512) 14.789 9.930 ( -2.325 3.206 3.763) 5.463 10.109 ( -1.089 -7.691 1.988) 8.018 11.266 ( 9.102 5.582 -6.613) 12.559 12.199 ( -21.694 -24.361 20.710) 38.639 12.443 ( 4.959 -10.060 8.038) 13.799 13.006 ( 10.447 26.209 -24.418) 37.314 14.101 ( -8.348 15.345 -21.311) 27.556 14.663 ( -0.943 -4.465 3.630) 5.831 15.868 ( -1.709 -7.321 8.368) 11.249 17.405 ( -1.958 5.967 4.247) 7.581 18.744 ( -7.224 -14.884 3.000) 16.814 19.101 ( -3.012 -0.623 0.175) 3.081 19.182 ( -2.646 -0.449 -1.463) 3.056 20.121 ( 35.356 22.320 -10.053) 43.003 ======================= Grid point 249 (106/366) ======================= q-point: ( 0.27 0.00 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.568 ( 3.389 -2.835 -5.027) 6.692 0.845 ( 0.214 -3.121 1.346) 3.405 1.141 ( 6.173 -2.042 3.818) 7.540 1.339 ( 2.755 7.748 -6.716) 10.617 1.739 ( -2.598 -3.080 4.101) 5.749 1.972 ( 2.228 -5.449 4.635) 7.492 2.326 ( 1.435 -4.600 7.240) 8.697 2.693 ( 4.130 -0.757 4.649) 6.264 3.060 ( 1.019 -21.579 0.603) 21.612 3.275 ( -10.792 -14.356 12.283) 21.758 3.952 ( -13.298 -23.024 19.137) 32.759 5.018 ( 2.078 23.687 1.776) 23.844 5.215 ( 2.114 14.972 -13.911) 20.547 5.409 ( -10.037 -13.539 17.734) 24.465 5.932 ( -10.326 -6.797 10.488) 16.212 6.367 ( -1.521 -9.599 -6.181) 11.518 6.702 ( 3.914 -11.784 -6.079) 13.826 7.037 ( -1.447 -0.164 1.408) 2.025 7.874 ( 2.948 3.257 -7.651) 8.822 8.537 ( -2.899 -12.288 14.184) 18.989 9.238 ( 2.834 5.757 -7.958) 10.222 9.402 ( 6.702 4.224 -18.070) 19.731 9.808 ( -4.742 7.889 9.820) 13.460 10.315 ( -1.061 -13.942 -3.995) 14.542 11.169 ( 10.705 9.917 -12.479) 19.201 12.298 ( 10.642 22.243 -18.190) 30.641 12.544 ( 10.277 4.091 -4.306) 11.870 12.885 ( -16.935 -28.865 21.151) 39.590 13.721 ( -8.781 13.986 -16.366) 23.250 14.836 ( -5.640 -11.723 16.602) 21.093 15.917 ( -5.854 2.190 20.227) 21.171 17.213 ( -5.416 14.630 12.880) 20.230 18.981 ( -0.156 -13.785 -8.011) 15.944 19.080 ( -5.287 -0.734 -2.980) 6.114 19.208 ( 3.025 -3.431 -7.718) 8.971 19.876 ( 20.402 21.955 -8.216) 31.077 ======================= Grid point 250 (107/366) ======================= q-point: ( 0.36 0.00 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.679 ( 4.757 -7.777 -9.316) 13.035 0.916 ( 0.022 -4.271 -0.104) 4.273 1.174 ( 3.800 8.063 -6.783) 11.201 1.205 ( 5.018 2.644 -0.664) 5.710 1.741 ( -4.201 0.177 3.733) 5.623 2.036 ( -0.176 -0.346 4.678) 4.694 2.407 ( -3.599 -3.234 3.846) 6.180 2.712 ( -0.580 0.783 4.796) 4.894 3.472 ( -2.060 -23.970 -1.645) 24.115 3.589 ( -5.132 -23.331 5.843) 24.593 4.265 ( -9.895 -11.773 13.660) 20.570 4.586 ( -1.484 24.824 6.497) 25.703 4.950 ( 3.937 9.806 -11.413) 15.554 5.452 ( -4.023 6.239 16.188) 17.809 6.080 ( -8.403 -12.022 7.651) 16.543 6.618 ( -0.989 -18.635 -5.585) 19.479 6.891 ( 3.283 -4.986 4.591) 7.531 7.036 ( 0.191 -2.196 -3.429) 4.076 7.842 ( 2.446 -1.077 -7.984) 8.419 8.692 ( 0.598 6.377 2.833) 7.004 9.010 ( -0.141 4.948 7.413) 8.914 9.547 ( 4.120 -6.465 -15.242) 17.062 9.688 ( 1.446 -3.422 -6.429) 7.425 10.544 ( -2.376 -13.671 -5.567) 14.951 10.974 ( 12.831 15.861 -24.030) 31.522 11.752 ( 14.248 31.501 -27.699) 44.301 12.693 ( 11.629 -6.859 0.376) 13.506 13.224 ( -2.933 3.463 -3.030) 5.456 13.583 ( -24.487 -25.323 23.010) 42.076 14.975 ( -9.264 1.333 29.685) 31.125 15.910 ( -6.883 -3.818 22.357) 23.702 16.895 ( -6.889 19.986 16.320) 26.707 19.052 ( -5.825 -1.384 -2.617) 6.534 19.171 ( 3.523 -8.815 -12.312) 15.546 19.290 ( 7.490 -4.611 -14.631) 17.072 19.599 ( 10.201 17.163 -7.737) 21.412 ======================= Grid point 251 (108/366) ======================= q-point: ( 0.45 0.00 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.842 ( 4.706 -9.174 -10.111) 14.441 0.988 ( -0.119 -3.352 -1.748) 3.782 1.000 ( 4.018 9.764 -10.368) 14.797 1.176 ( 3.444 4.841 -0.440) 5.957 1.742 ( -2.277 -1.793 6.747) 7.343 2.035 ( -1.619 0.731 5.187) 5.483 2.397 ( -10.994 -0.918 1.737) 11.168 2.735 ( 5.146 -0.126 5.807) 7.760 3.859 ( -3.214 -20.129 -0.118) 20.384 4.001 ( -1.094 -17.833 4.403) 18.401 4.114 ( -2.827 20.380 7.706) 21.971 4.239 ( -1.251 11.405 -6.846) 13.360 4.988 ( -3.643 -11.553 7.884) 14.453 5.297 ( -1.972 11.299 13.135) 17.437 6.248 ( -4.054 -8.881 5.623) 11.266 6.848 ( -1.551 -6.363 -7.048) 9.622 6.919 ( 5.023 3.946 12.012) 13.604 7.140 ( -1.423 -7.722 -6.196) 10.002 7.960 ( 2.581 -13.935 -7.499) 16.033 8.317 ( 2.194 26.361 -6.124) 27.151 9.170 ( -2.573 -11.741 15.472) 19.592 9.414 ( -6.037 10.424 10.061) 15.695 10.042 ( 14.062 -26.418 -37.411) 47.908 10.555 ( 12.953 21.548 -32.623) 41.187 10.814 ( 1.345 -9.855 -13.758) 16.977 11.313 ( 9.994 19.945 -13.981) 26.328 12.892 ( 7.483 -3.240 -4.903) 9.515 12.987 ( 0.642 7.627 -11.025) 13.421 14.122 ( -22.754 -35.116 38.900) 57.132 14.771 ( -11.025 21.800 40.497) 47.295 16.136 ( -6.395 -18.508 18.963) 27.259 16.507 ( -7.404 22.252 17.115) 29.032 19.040 ( -5.814 -2.379 -2.709) 6.841 19.268 ( 5.260 -1.632 -10.690) 12.025 19.373 ( 7.272 5.242 -9.861) 13.327 19.401 ( 8.316 -0.440 -17.724) 19.583 ======================= Grid point 252 (109/366) ======================= q-point: (-0.45 0.00 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.814 ( 4.674 9.934 -11.743) 16.076 1.003 ( 1.240 0.954 -2.266) 2.753 1.021 ( 3.487 -7.340 -8.375) 11.669 1.103 ( -0.203 2.607 -1.310) 2.924 1.796 ( -0.627 -2.122 8.712) 8.988 2.024 ( -1.546 0.845 4.710) 5.029 2.341 ( -10.343 -0.986 1.030) 10.441 2.751 ( 7.113 6.793 3.889) 10.577 3.688 ( 1.741 25.281 8.365) 26.686 3.809 ( 3.899 19.686 4.892) 20.656 4.258 ( -5.791 -21.477 -4.236) 22.644 4.418 ( -4.703 -15.537 3.455) 16.597 5.038 ( -1.084 7.594 11.182) 13.560 5.307 ( -4.605 -13.667 4.827) 15.208 6.361 ( -1.004 -3.960 4.061) 5.760 6.822 ( 2.850 7.196 7.563) 10.821 6.893 ( 1.163 5.396 -1.127) 5.634 7.160 ( -4.349 2.088 -3.161) 5.767 7.900 ( 3.706 16.942 -7.994) 19.096 8.316 ( 2.771 -23.197 -6.782) 24.326 9.176 ( -7.513 10.622 9.939) 16.372 9.423 ( -3.422 -11.040 15.972) 19.715 10.100 ( 15.794 25.660 -38.848) 49.163 10.510 ( 12.406 -23.100 -32.987) 42.138 10.921 ( 5.855 7.847 -7.016) 12.045 11.182 ( 4.982 -13.885 -19.263) 24.263 12.668 ( -4.169 12.139 -10.435) 16.541 13.153 ( 8.215 -9.638 -4.935) 13.592 14.345 ( -9.240 25.765 41.218) 49.479 14.663 ( -18.256 -25.770 37.880) 49.318 16.117 ( -7.658 19.216 17.227) 26.919 16.517 ( -6.453 -21.959 18.171) 29.224 19.041 ( -5.799 -2.747 -3.449) 7.285 19.240 ( 4.333 4.508 -1.715) 6.484 19.295 ( 5.391 1.922 -18.918) 19.765 19.487 ( 10.806 -2.764 -16.680) 20.066 ======================= Grid point 253 (110/366) ======================= q-point: (-0.36 0.00 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.645 ( 4.519 8.576 -11.327) 14.909 0.904 ( -0.709 6.571 0.064) 6.609 1.054 ( -0.519 3.308 -0.300) 3.362 1.188 ( 3.356 -8.751 -8.422) 12.600 1.816 ( -2.314 2.242 8.668) 9.248 1.991 ( -0.982 3.927 3.411) 5.293 2.306 ( -6.252 -0.949 -1.446) 6.487 2.575 ( 5.067 16.644 4.860) 18.064 3.234 ( 5.146 28.655 3.815) 29.362 3.572 ( 0.608 12.634 15.564) 20.055 4.402 ( -6.448 13.950 23.598) 28.161 4.612 ( -3.970 -20.893 -7.830) 22.662 5.107 ( 1.702 -14.395 -6.887) 16.048 5.519 ( -4.829 -9.853 5.246) 12.163 6.397 ( -0.553 0.576 -2.174) 2.316 6.610 ( 2.566 21.337 22.164) 30.873 6.766 ( -0.604 6.460 -9.112) 11.186 7.070 ( -4.106 1.986 0.132) 4.563 7.768 ( 5.729 0.265 -9.005) 10.676 8.659 ( 0.536 -8.153 -2.761) 8.625 9.025 ( -5.508 -2.447 6.453) 8.830 9.623 ( -1.263 -6.002 5.539) 8.264 9.700 ( 9.759 14.976 -23.484) 29.513 10.664 ( 5.016 14.308 -4.433) 15.796 10.839 ( 5.236 -9.909 -17.639) 20.898 11.649 ( 12.262 -33.885 -34.614) 49.966 12.423 ( -3.617 8.927 -7.471) 12.190 13.269 ( -0.104 4.448 6.958) 8.259 14.041 ( 0.435 8.829 23.673) 25.270 14.939 ( -12.646 -3.987 28.509) 31.442 15.880 ( -8.876 4.267 19.570) 21.908 16.902 ( -6.172 -19.929 17.012) 26.920 19.034 ( -5.451 -1.607 -3.772) 6.821 19.201 ( 3.682 2.631 -3.728) 5.863 19.233 ( 6.021 3.878 -15.251) 16.849 19.541 ( 7.433 -0.795 -14.368) 16.196 ======================= Grid point 254 (111/366) ======================= q-point: (-0.27 0.00 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.531 ( 2.889 3.290 -6.778) 8.070 0.787 ( -1.271 5.835 1.615) 6.186 0.955 ( 0.914 7.723 1.980) 8.025 1.331 ( 2.582 -6.732 -6.576) 9.758 1.719 ( -3.906 8.565 8.407) 12.622 1.853 ( -0.585 11.610 3.648) 12.183 2.229 ( -2.648 5.872 -0.207) 6.445 2.403 ( 1.963 4.918 9.253) 10.661 2.785 ( 5.712 26.238 6.440) 27.614 3.374 ( -3.683 14.159 18.031) 23.220 4.078 ( -7.655 21.002 23.493) 32.428 4.948 ( 1.083 -19.319 -8.331) 21.066 5.389 ( -0.146 -14.881 -2.825) 15.148 5.541 ( -4.150 8.007 4.368) 10.021 6.220 ( -6.729 10.043 7.286) 14.114 6.475 ( 1.614 2.587 8.211) 8.759 6.600 ( 2.376 9.227 -8.158) 12.543 7.044 ( -0.797 -0.178 1.306) 1.540 7.845 ( 4.462 -6.013 -8.824) 11.572 8.557 ( -5.655 10.504 6.930) 13.796 9.228 ( 2.135 -10.267 -4.253) 11.316 9.451 ( 7.043 2.580 -20.733) 22.048 9.819 ( -4.746 -9.030 13.094) 16.599 10.385 ( 1.985 16.498 -3.079) 16.900 10.991 ( 4.917 -7.024 -10.820) 13.806 12.145 ( 2.790 -7.234 -14.270) 16.240 12.408 ( 9.459 -23.965 -24.349) 35.450 13.012 ( -5.606 22.193 22.186) 31.878 14.181 ( 6.765 -13.894 -2.144) 15.601 14.828 ( -6.668 11.349 15.899) 20.641 15.900 ( -8.394 -3.170 17.848) 19.976 17.220 ( -4.816 -14.672 13.198) 20.313 19.007 ( -2.286 0.542 -2.069) 3.130 19.139 ( 2.455 4.063 -8.344) 9.600 19.186 ( 3.397 2.670 -5.522) 7.012 19.539 ( 2.503 0.869 -11.009) 11.324 ======================= Grid point 255 (112/366) ======================= q-point: (-0.18 0.00 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.554 ( 0.405 -4.635 2.668) 5.363 0.679 ( 2.918 7.622 6.207) 10.253 0.839 ( 1.316 5.629 3.921) 6.985 1.390 ( -1.438 1.951 3.137) 3.964 1.561 ( -1.859 5.267 5.675) 7.962 1.684 ( -2.210 5.700 12.229) 13.672 2.132 ( -2.343 3.969 7.312) 8.643 2.391 ( 2.655 3.357 4.760) 6.401 2.431 ( 6.671 17.393 10.804) 21.535 3.122 ( -6.466 14.410 19.094) 24.779 3.710 ( -9.503 19.667 20.674) 30.075 5.091 ( -3.059 23.802 19.047) 30.637 5.343 ( -0.509 -12.978 -7.023) 14.765 5.614 ( 0.470 -8.906 -6.482) 11.025 6.092 ( -6.541 4.553 2.775) 8.438 6.436 ( -2.096 1.862 -2.123) 3.516 6.504 ( 2.711 0.722 -4.943) 5.684 7.052 ( 1.225 0.262 0.195) 1.268 7.950 ( 0.602 -4.622 -6.116) 7.689 8.369 ( -4.970 6.801 7.261) 11.121 9.293 ( 0.999 -5.044 -3.961) 6.491 9.599 ( 3.105 -11.246 -6.313) 13.265 9.951 ( -2.186 -3.164 4.148) 5.656 10.126 ( -1.732 9.023 2.890) 9.632 11.112 ( 6.908 -4.907 -7.166) 11.097 12.132 ( 1.381 1.354 1.559) 2.485 12.595 ( -7.304 25.074 17.856) 31.637 12.964 ( 10.450 -28.538 -24.646) 39.128 14.488 ( 3.853 -15.921 -12.759) 20.763 14.662 ( -1.705 3.524 2.324) 4.552 15.867 ( -4.587 6.817 6.741) 10.628 17.411 ( -1.512 -5.797 4.090) 7.253 18.986 ( -6.070 0.576 -3.531) 7.046 19.070 ( 3.662 2.137 1.102) 4.381 19.143 ( 1.378 2.045 0.821) 2.599 19.502 ( 4.699 2.771 -4.398) 7.008 ======================= Grid point 256 (113/366) ======================= q-point: (-0.09 0.00 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.589 ( 12.469 5.933 12.883) 18.885 0.719 ( -0.350 -7.219 11.015) 13.175 0.799 ( -0.678 0.427 4.107) 4.185 1.272 ( -3.549 10.598 14.044) 17.948 1.567 ( 0.559 -4.362 0.526) 4.429 1.711 ( -3.242 -4.405 10.809) 12.114 2.100 ( -2.957 0.823 15.060) 15.370 2.248 ( 2.106 3.253 11.533) 12.167 2.464 ( 9.781 -2.442 10.462) 14.529 2.908 ( -5.654 10.019 19.772) 22.876 3.334 ( -12.744 20.789 19.152) 31.006 4.585 ( -9.355 26.901 30.081) 41.425 5.624 ( 5.201 -12.964 -10.092) 17.233 5.679 ( 2.373 -1.198 -11.509) 11.812 5.963 ( -3.045 4.818 0.991) 5.785 6.383 ( -6.320 1.746 1.032) 6.638 6.544 ( -1.595 -5.536 -8.534) 10.297 7.037 ( 0.710 1.863 -2.835) 3.466 7.953 ( -5.066 1.519 3.383) 6.278 8.317 ( -2.077 -1.383 0.940) 2.667 9.485 ( -2.467 -14.831 4.689) 15.749 9.757 ( 1.587 -4.393 -0.707) 4.725 9.845 ( 2.510 6.538 -6.434) 9.510 10.185 ( -5.986 -10.814 12.011) 17.235 11.219 ( 7.830 -2.871 -5.412) 9.942 12.068 ( -16.421 28.034 8.425) 33.564 12.156 ( 4.972 0.889 6.444) 8.188 13.336 ( 2.136 -11.680 -5.216) 12.969 14.697 ( 1.884 -12.155 -19.594) 23.134 14.737 ( -0.632 -11.310 -16.964) 20.398 15.629 ( 0.202 17.052 -4.538) 17.647 17.426 ( 3.011 3.170 -7.722) 8.874 18.806 ( -25.097 4.088 1.876) 25.497 19.101 ( -2.882 -0.073 9.397) 9.830 19.223 ( 6.903 -4.096 2.378) 8.372 19.567 ( 35.179 0.153 5.430) 35.596 ======================= Grid point 258 (114/366) ======================= q-point: ( 0.09 0.09 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.785 ( -1.629 0.000 3.210) 3.600 0.856 ( 1.065 -0.000 9.735) 9.793 0.940 ( 0.958 -0.000 12.262) 12.299 1.273 ( 9.756 -0.000 11.604) 15.160 1.627 ( 0.593 -0.000 -0.397) 0.714 1.782 ( 2.697 -0.000 1.770) 3.226 2.210 ( 1.060 -0.000 10.943) 10.994 2.368 ( -6.877 0.000 25.898) 26.795 2.787 ( -5.023 0.000 27.648) 28.101 2.918 ( -13.534 0.000 18.416) 22.854 2.998 ( 16.572 -0.000 2.053) 16.698 4.356 ( -12.676 0.000 30.639) 33.158 5.576 ( -0.645 0.000 -10.195) 10.216 5.790 ( 7.256 -0.000 -21.030) 22.247 5.864 ( -7.623 0.000 7.314) 10.565 6.285 ( -1.811 0.000 5.000) 5.318 6.474 ( -3.160 0.000 -7.676) 8.301 6.930 ( -4.913 0.000 -3.544) 6.058 7.855 ( -5.618 0.000 6.756) 8.787 8.281 ( -3.038 0.000 -1.219) 3.274 9.660 ( -0.324 0.000 2.044) 2.069 9.784 ( 5.102 -0.000 -4.186) 6.599 9.850 ( -0.157 0.000 0.974) 0.987 10.349 ( -5.117 0.000 13.187) 14.145 10.947 ( -38.035 0.000 23.045) 44.472 11.516 ( 3.507 -0.000 -4.127) 5.416 12.390 ( 11.011 -0.000 9.424) 14.493 13.433 ( -0.960 0.000 3.867) 3.984 14.448 ( -4.409 0.000 -26.583) 26.946 14.946 ( 9.462 -0.000 -22.671) 24.567 15.411 ( 5.266 -0.000 -8.792) 10.249 17.376 ( 4.686 -0.000 -12.111) 12.986 18.444 ( -19.095 0.000 29.095) 34.801 19.103 ( -5.569 0.000 10.437) 11.830 19.181 ( -6.087 0.000 -0.301) 6.095 20.702 ( 56.014 -0.000 -26.750) 62.074 ======================= Grid point 259 (115/366) ======================= q-point: ( 0.18 0.09 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.736 ( -3.277 9.248 8.924) 13.263 0.788 ( -1.528 0.023 3.220) 3.565 1.042 ( 5.373 -3.544 8.833) 10.929 1.447 ( 7.983 -5.717 6.554) 11.806 1.595 ( 1.491 2.371 -0.303) 2.818 1.816 ( 2.407 -0.851 6.408) 6.898 2.188 ( -5.071 1.907 22.284) 22.933 2.439 ( 1.538 -8.017 7.906) 11.364 2.814 ( 1.190 0.203 12.751) 12.808 3.069 ( 5.186 -0.215 12.266) 13.319 3.147 ( -11.419 -18.165 15.784) 26.636 4.536 ( -15.953 -20.103 28.035) 38.008 5.541 ( -2.069 1.906 -9.452) 9.862 5.705 ( 8.042 9.536 -13.460) 18.352 5.839 ( -7.987 -1.368 6.793) 10.574 6.276 ( -2.840 0.026 1.830) 3.379 6.414 ( -0.267 0.995 -8.614) 8.675 6.937 ( -4.834 -4.411 -1.590) 6.735 7.886 ( -2.313 -4.211 3.980) 6.239 8.257 ( -3.527 -0.805 2.719) 4.526 9.471 ( -2.318 15.887 5.178) 16.870 9.787 ( 1.769 6.030 -3.244) 7.073 9.873 ( 4.188 -5.372 -5.630) 8.837 10.147 ( -5.385 9.117 10.317) 14.784 11.222 ( -17.685 -25.523 17.897) 35.840 11.574 ( -8.453 -11.157 2.727) 14.261 12.491 ( 12.024 -0.191 7.722) 14.291 13.355 ( 2.635 10.708 -5.167) 12.178 14.252 ( -2.027 11.244 -25.096) 27.574 14.741 ( 6.057 12.703 -14.293) 20.058 15.654 ( 3.137 -16.588 -4.151) 17.385 17.422 ( 2.848 -2.990 -7.854) 8.874 18.476 ( -14.731 -8.717 22.749) 28.470 19.075 ( -6.824 0.403 2.603) 7.315 19.150 ( -4.634 -0.304 4.177) 6.247 20.768 ( 43.936 20.822 -24.727) 54.547 ======================= Grid point 260 (116/366) ======================= q-point: ( 0.27 0.09 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.597 ( -0.332 5.041 2.841) 5.796 0.806 ( -0.731 -1.746 2.492) 3.129 1.160 ( 6.833 -2.610 6.356) 9.690 1.463 ( 2.608 5.685 -3.937) 7.390 1.662 ( 0.856 -4.841 2.751) 5.633 1.903 ( 3.056 -4.926 7.018) 9.103 2.263 ( -1.809 -5.655 16.148) 17.204 2.659 ( 2.505 -11.813 -2.032) 12.245 2.848 ( 3.230 -0.934 5.274) 6.254 3.087 ( -5.410 -1.195 10.743) 12.087 3.490 ( -14.077 -23.033 20.430) 33.854 4.942 ( -15.577 -27.483 23.745) 39.519 5.379 ( -2.165 12.117 -9.758) 15.707 5.491 ( 6.405 16.727 0.090) 17.912 5.839 ( -7.809 -2.204 8.071) 11.444 6.260 ( -2.100 -0.702 -3.143) 3.844 6.480 ( 3.133 -10.802 -12.155) 16.561 6.988 ( -3.371 -4.007 1.437) 5.430 7.927 ( 2.367 1.148 -4.566) 5.270 8.340 ( -4.436 -9.966 13.392) 17.272 9.258 ( 1.329 5.635 -4.857) 7.557 9.628 ( 3.632 12.025 -7.824) 14.799 9.919 ( -1.782 3.910 2.712) 5.081 10.108 ( -0.450 -6.571 1.622) 6.783 11.351 ( 8.604 5.123 -6.413) 11.891 11.971 ( -28.696 -36.843 29.462) 55.217 12.607 ( 11.676 -2.564 4.366) 12.727 13.011 ( 9.566 27.088 -24.517) 37.767 13.922 ( -1.534 16.332 -21.467) 27.017 14.669 ( -0.944 -4.583 3.675) 5.950 15.892 ( -1.633 -7.556 8.730) 11.660 17.402 ( -1.912 6.013 4.138) 7.545 18.669 ( -7.116 -15.840 5.009) 18.073 19.024 ( -7.054 -0.180 -1.772) 7.276 19.155 ( -1.117 -1.811 0.304) 2.150 20.493 ( 29.858 29.295 -16.734) 45.053 ======================= Grid point 261 (117/366) ======================= q-point: ( 0.36 0.09 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.587 ( 3.116 -2.859 -4.840) 6.428 0.851 ( -0.233 -3.028 1.184) 3.260 1.253 ( 7.497 -0.616 3.481) 8.289 1.340 ( 2.688 8.069 -6.748) 10.857 1.706 ( -4.403 -1.240 1.114) 4.708 2.021 ( 1.419 -3.424 4.213) 5.611 2.361 ( -2.788 -1.475 8.990) 9.527 2.763 ( 3.885 2.191 1.513) 4.710 3.031 ( -2.124 -19.669 -8.176) 21.407 3.203 ( -9.654 -15.711 12.333) 22.184 3.876 ( -12.810 -23.459 19.138) 32.873 5.036 ( 0.644 21.987 -0.874) 22.013 5.214 ( 4.753 16.377 -4.332) 17.594 5.369 ( -11.109 -18.163 21.283) 30.105 5.864 ( -8.133 -5.040 10.682) 14.341 6.326 ( -0.060 -10.019 -5.000) 11.197 6.706 ( 4.086 -13.519 -12.683) 18.982 7.035 ( -1.180 -1.785 5.030) 5.466 7.872 ( 2.603 3.857 -7.484) 8.813 8.578 ( -3.059 -13.030 16.052) 20.900 9.233 ( 3.186 3.218 -9.378) 10.414 9.403 ( 7.009 6.912 -16.304) 19.045 9.793 ( -4.147 8.025 7.613) 11.813 10.285 ( -0.476 -11.988 -3.463) 12.487 11.238 ( 9.848 10.821 -14.171) 20.369 12.333 ( 8.096 19.975 -15.054) 26.291 12.616 ( -4.968 -10.311 8.436) 14.218 12.809 ( -3.313 -18.282 10.412) 21.299 13.562 ( -1.771 16.254 -17.399) 23.876 14.848 ( -5.489 -12.254 16.492) 21.267 15.945 ( -6.071 2.042 20.845) 21.807 17.208 ( -5.341 14.712 12.799) 20.218 18.923 ( -2.321 -14.490 -7.712) 16.578 18.987 ( -5.111 -1.746 -2.902) 6.132 19.208 ( 3.310 -4.538 -8.333) 10.049 20.087 ( 17.654 28.372 -10.714) 35.091 ======================= Grid point 262 (118/366) ======================= q-point: ( 0.45 0.09 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.693 ( 4.396 -7.533 -9.117) 12.618 0.914 ( -0.176 -3.830 -0.185) 3.838 1.177 ( 3.444 9.595 -8.986) 13.590 1.287 ( 6.349 3.387 0.270) 7.201 1.691 ( -5.892 -1.715 2.888) 6.782 2.058 ( -0.333 0.414 5.042) 5.070 2.333 ( -8.858 1.235 4.336) 9.940 2.762 ( 2.901 -0.519 4.789) 5.623 3.403 ( -3.349 -24.400 -9.554) 26.417 3.544 ( -6.050 -24.166 4.767) 25.363 4.206 ( -9.763 -13.782 15.079) 22.641 4.613 ( 0.080 25.473 8.156) 26.748 4.965 ( 5.233 10.613 -6.917) 13.707 5.485 ( -4.611 4.492 17.766) 18.896 6.018 ( -8.324 -13.605 10.981) 19.364 6.579 ( -0.609 -17.289 -5.098) 18.036 6.920 ( 3.621 -10.564 -11.335) 15.912 7.063 ( 1.872 0.724 8.369) 8.606 7.827 ( 1.663 -1.023 -7.929) 8.166 8.709 ( 0.157 9.626 1.751) 9.786 9.052 ( -0.623 1.923 10.255) 10.453 9.528 ( 4.738 -5.098 -14.758) 16.316 9.673 ( 2.373 -4.288 -9.136) 10.367 10.491 ( -1.225 -12.494 -4.913) 13.481 11.011 ( 12.446 17.400 -26.360) 33.949 11.789 ( 12.475 30.208 -26.580) 42.126 12.841 ( 9.636 -6.667 0.374) 11.723 13.167 ( -1.452 8.251 -6.788) 10.783 13.408 ( -21.779 -31.838 29.101) 48.320 15.006 ( -9.305 -0.207 29.020) 30.475 15.934 ( -7.468 -3.203 23.100) 24.488 16.889 ( -6.796 20.127 16.200) 26.715 18.960 ( -5.494 -1.907 -2.026) 6.158 19.138 ( 2.917 -10.145 -14.683) 18.084 19.312 ( 7.341 -6.183 -15.077) 17.872 19.696 ( 8.990 21.696 -6.581) 24.389 ======================= Grid point 263 (119/366) ======================= q-point: (-0.45 0.09 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.850 ( 4.344 -9.093 -10.164) 14.313 0.978 ( 0.361 -2.229 -2.467) 3.344 1.001 ( 3.892 8.719 -9.477) 13.453 1.216 ( 2.947 7.256 -1.631) 8.000 1.731 ( -4.609 -4.917 6.020) 9.036 2.052 ( -0.309 1.189 6.268) 6.387 2.264 ( -8.904 -0.081 2.284) 9.193 2.836 ( 3.855 -2.031 5.903) 7.337 3.784 ( -4.762 -23.432 -6.861) 24.876 3.958 ( -5.103 -22.359 -1.332) 22.973 4.164 ( 1.276 19.893 11.215) 22.873 4.227 ( 0.945 15.461 4.206) 16.051 4.985 ( -2.170 -10.958 5.195) 12.320 5.330 ( -3.555 12.501 13.574) 18.793 6.224 ( -5.008 -10.551 8.416) 14.396 6.785 ( -1.791 -6.668 -7.523) 10.211 7.043 ( 3.400 0.349 5.921) 6.837 7.105 ( 2.057 -3.347 -2.165) 4.486 7.951 ( 1.853 -14.904 -7.198) 16.655 8.315 ( 2.288 26.347 -6.247) 27.174 9.213 ( -3.551 -9.727 16.236) 19.257 9.386 ( -5.456 9.806 8.855) 14.295 10.038 ( 14.775 -26.704 -37.834) 48.609 10.548 ( 10.635 18.387 -29.939) 36.708 10.782 ( 5.784 -6.611 -16.610) 18.790 11.357 ( 7.285 19.833 -13.703) 25.183 12.865 ( 0.043 14.133 -11.090) 17.965 13.037 ( 7.808 -7.170 -5.469) 11.928 14.039 ( -20.596 -37.189 41.101) 59.131 14.826 ( -12.296 20.036 39.239) 45.742 16.148 ( -6.826 -18.202 19.266) 27.369 16.498 ( -7.181 22.404 16.951) 28.997 18.961 ( -3.765 -2.082 -1.652) 4.608 19.251 ( 4.933 -4.269 -17.579) 18.751 19.414 ( 4.992 10.648 -7.540) 13.969 19.439 ( 8.686 -3.766 -14.267) 17.122 ======================= Grid point 264 (120/366) ======================= q-point: (-0.36 0.09 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.816 ( 4.775 9.932 -11.645) 16.033 1.005 ( 0.631 1.879 -1.469) 2.467 1.023 ( 3.734 -8.973 -9.550) 13.626 1.098 ( 0.204 4.534 -0.881) 4.623 1.803 ( -4.396 -3.656 6.903) 8.964 2.044 ( -0.458 1.845 6.182) 6.468 2.241 ( -4.224 -1.812 1.256) 4.765 2.847 ( 3.378 6.626 4.529) 8.708 3.755 ( -0.538 23.655 13.153) 27.071 3.894 ( 5.190 19.000 2.199) 19.818 4.164 ( -3.297 -22.811 -5.548) 23.707 4.378 ( -4.379 -17.200 4.719) 18.365 5.074 ( -2.195 10.143 10.591) 14.828 5.260 ( -5.213 -14.163 2.949) 15.378 6.355 ( -2.418 -4.668 2.994) 6.050 6.792 ( -1.758 0.829 -7.320) 7.574 7.012 ( 3.591 11.158 18.540) 21.934 7.087 ( -2.407 3.388 -6.948) 8.096 7.913 ( 4.392 15.529 -8.088) 18.051 8.317 ( 2.706 -23.606 -6.567) 24.651 9.131 ( -6.438 11.399 8.707) 15.722 9.454 ( -4.786 -10.450 16.447) 20.065 10.101 ( 14.644 25.446 -38.553) 48.459 10.504 ( 12.415 -22.536 -32.075) 41.119 10.971 ( 7.445 5.070 -8.229) 12.200 11.145 ( 4.461 -11.749 -19.149) 22.905 12.587 ( -0.056 12.907 -8.713) 15.572 13.216 ( 5.081 -8.344 -5.739) 11.330 14.409 ( -12.586 21.871 38.378) 45.930 14.630 ( -16.742 -25.217 39.021) 49.385 16.108 ( -7.183 19.417 17.083) 26.841 16.524 ( -6.762 -21.887 18.231) 29.277 18.972 ( -2.102 -1.667 -1.248) 2.959 19.270 ( 4.786 2.559 -11.548) 12.760 19.278 ( 3.945 3.153 -10.000) 11.203 19.531 ( 8.601 -2.809 -17.325) 19.545 ======================= Grid point 265 (121/366) ======================= q-point: (-0.27 0.09 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.648 ( 4.659 8.603 -11.010) 14.729 0.899 ( -0.065 6.874 0.317) 6.881 1.057 ( 0.766 2.675 0.555) 2.837 1.188 ( 3.336 -8.828 -8.499) 12.701 1.814 ( -4.149 1.832 7.783) 9.008 1.997 ( -1.177 4.336 3.717) 5.831 2.259 ( 0.268 -0.323 -0.520) 0.669 2.667 ( 3.448 15.426 7.046) 17.306 3.328 ( 3.770 27.420 8.249) 28.882 3.639 ( -1.777 13.920 12.050) 18.497 4.417 ( -9.379 12.240 20.895) 25.969 4.547 ( -0.180 -21.959 -4.332) 22.383 5.082 ( 1.480 -13.428 -10.571) 17.154 5.474 ( -5.546 -10.266 5.113) 12.739 6.350 ( -3.922 4.165 -3.385) 6.647 6.706 ( 1.518 12.105 -5.199) 13.261 6.743 ( -3.434 13.061 17.866) 22.396 7.038 ( -0.178 0.563 -0.174) 0.616 7.801 ( 5.751 0.358 -8.356) 10.150 8.653 ( 0.331 -5.385 -1.667) 5.647 8.991 ( -3.904 -5.300 4.941) 8.231 9.624 ( -0.005 -1.110 -1.836) 2.145 9.705 ( 6.400 10.846 -15.851) 20.245 10.686 ( 2.064 13.967 -5.537) 15.166 10.838 ( 8.066 -8.992 -16.897) 20.771 11.642 ( 13.747 -34.265 -34.001) 50.191 12.378 ( 2.040 8.377 -5.171) 10.054 13.295 ( -1.282 4.730 6.020) 7.763 14.100 ( -8.767 7.386 18.956) 22.152 14.926 ( -11.929 -4.496 29.275) 31.931 15.869 ( -8.054 4.665 19.642) 21.736 16.906 ( -6.471 -19.918 16.933) 26.931 18.985 ( 0.352 -0.733 -0.306) 0.869 19.209 ( 2.590 3.366 -8.209) 9.243 19.242 ( 5.513 2.426 -11.731) 13.187 19.557 ( 6.032 0.342 -14.905) 16.083 ======================= Grid point 266 (122/366) ======================= q-point: (-0.18 0.09 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.537 ( 3.138 3.126 -6.129) 7.562 0.800 ( 1.169 4.622 2.353) 5.317 0.991 ( 2.399 6.187 2.804) 7.204 1.333 ( 2.789 -6.807 -6.514) 9.826 1.722 ( -2.479 8.151 8.826) 12.268 1.874 ( 0.945 10.284 3.620) 10.943 2.220 ( 0.780 4.588 1.656) 4.940 2.498 ( 3.738 6.792 10.664) 13.185 2.900 ( 5.227 25.173 8.701) 27.142 3.390 ( -7.026 14.703 15.507) 22.495 4.074 ( -10.641 21.467 21.746) 32.357 4.940 ( 3.400 -21.740 -5.869) 22.774 5.354 ( -0.568 -16.134 -8.838) 18.404 5.498 ( -6.374 8.334 7.038) 12.634 6.138 ( -10.248 9.337 6.715) 15.405 6.484 ( -1.670 6.872 -3.451) 7.869 6.622 ( 2.969 7.944 1.328) 8.584 7.048 ( 0.107 -0.974 1.050) 1.436 7.860 ( 4.282 -4.306 -8.142) 10.158 8.523 ( -4.994 10.910 8.139) 14.499 9.234 ( 2.427 -10.247 -4.958) 11.639 9.433 ( 6.610 1.641 -20.769) 21.857 9.821 ( -5.196 -8.451 13.042) 16.386 10.381 ( 0.092 16.755 -3.846) 17.191 11.023 ( 8.152 -8.100 -10.797) 15.768 12.153 ( 8.173 -8.316 -11.299) 16.237 12.416 ( 10.257 -23.075 -22.702) 33.956 13.027 ( -8.642 22.115 19.715) 30.861 14.155 ( -6.517 -13.777 -8.304) 17.356 14.824 ( -6.467 11.225 16.348) 20.859 15.887 ( -7.510 -2.632 18.443) 20.087 17.222 ( -5.216 -14.642 13.035) 20.286 18.993 ( 1.795 2.114 -1.176) 3.012 19.138 ( 2.984 3.218 -6.580) 7.909 19.200 ( 3.327 2.762 -6.362) 7.693 19.554 ( 7.314 -0.162 -8.758) 11.412 ======================= Grid point 267 (123/366) ======================= q-point: (-0.09 0.09 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.571 ( -0.052 -5.905 3.027) 6.636 0.766 ( 3.273 1.760 4.073) 5.514 0.905 ( 5.608 6.710 5.768) 10.475 1.406 ( 1.638 1.201 2.139) 2.950 1.577 ( -0.490 5.923 6.879) 9.090 1.737 ( 0.768 5.765 11.309) 12.717 2.154 ( -0.938 4.073 9.256) 10.156 2.485 ( 6.419 5.858 5.521) 10.296 2.588 ( 7.597 12.430 11.383) 18.488 3.124 ( -7.582 13.087 17.809) 23.365 3.664 ( -12.884 21.027 19.523) 31.453 5.104 ( -11.456 27.919 21.721) 37.182 5.336 ( 5.728 -19.522 -7.751) 21.772 5.564 ( -1.728 -9.781 -9.139) 13.497 6.004 ( -9.232 2.804 5.286) 11.002 6.382 ( -2.908 1.879 -4.791) 5.911 6.507 ( 2.441 5.108 -6.897) 8.923 7.055 ( -0.713 0.616 -0.545) 1.089 7.932 ( 1.053 -2.419 -5.214) 5.844 8.344 ( -4.815 6.471 8.772) 11.917 9.283 ( 0.732 -4.959 -4.375) 6.653 9.609 ( 3.497 -11.909 -6.948) 14.225 9.942 ( -2.518 -2.968 4.323) 5.817 10.116 ( -1.686 8.703 2.371) 9.176 11.181 ( 8.735 -5.735 -7.144) 12.658 12.203 ( 5.280 1.308 5.300) 7.595 12.507 ( -17.829 26.587 16.931) 36.213 12.986 ( 11.504 -26.413 -24.453) 37.788 14.346 ( -9.824 -15.922 -19.950) 27.350 14.657 ( -1.261 4.572 3.696) 6.013 15.855 ( -2.848 7.323 7.799) 11.071 17.409 ( -1.878 -5.856 4.156) 7.422 18.840 ( -8.714 10.778 -0.479) 13.868 19.115 ( -0.060 1.192 1.030) 1.577 19.204 ( 2.212 -1.646 -0.618) 2.825 19.706 ( 27.925 -8.177 -2.905) 29.242 ======================= Grid point 270 (124/366) ======================= q-point: ( 0.18 0.18 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.780 ( -1.778 0.000 3.678) 4.085 0.865 ( -6.021 0.000 11.683) 13.144 1.015 ( 1.653 -0.000 8.952) 9.103 1.481 ( 13.611 -0.000 3.630) 14.087 1.634 ( 0.509 -0.000 0.163) 0.534 1.827 ( 3.181 -0.000 -0.568) 3.231 2.260 ( -0.687 0.000 6.678) 6.713 2.392 ( -13.147 0.000 32.075) 34.665 2.862 ( -4.921 0.000 25.141) 25.618 2.862 ( -7.635 0.000 16.364) 18.058 3.209 ( 14.589 -0.000 -2.645) 14.827 4.323 ( -14.910 0.000 27.775) 31.524 5.514 ( -0.847 0.000 -8.780) 8.820 5.773 ( 6.477 -0.000 -20.231) 21.242 5.790 ( -8.198 0.000 6.039) 10.182 6.306 ( -0.881 0.000 8.535) 8.580 6.410 ( -1.238 0.000 -4.884) 5.038 6.843 ( -5.816 0.000 -1.243) 5.948 7.828 ( -3.822 0.000 7.544) 8.457 8.234 ( -2.733 0.000 -1.341) 3.044 9.669 ( 0.017 -0.000 2.179) 2.179 9.831 ( 4.981 -0.000 -4.015) 6.398 9.851 ( -0.093 0.000 -0.299) 0.314 10.354 ( -4.221 0.000 12.612) 13.299 10.602 ( -33.546 0.000 31.600) 46.086 11.557 ( 5.836 -0.000 -6.716) 8.897 12.591 ( 11.410 -0.000 8.011) 13.942 13.439 ( -1.222 0.000 4.080) 4.259 14.298 ( 2.893 -0.000 -27.802) 27.952 14.952 ( 8.892 -0.000 -21.977) 23.707 15.432 ( 4.828 -0.000 -9.219) 10.407 17.375 ( 4.625 -0.000 -12.096) 12.950 18.369 ( -16.830 0.000 32.515) 36.612 19.026 ( -8.761 0.000 -0.801) 8.797 19.138 ( -4.905 0.000 10.856) 11.913 21.180 ( 40.053 -0.000 -34.080) 52.590 ======================= Grid point 271 (125/366) ======================= q-point: ( 0.27 0.18 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.734 ( -3.994 8.933 8.969) 13.274 0.785 ( -1.632 -0.618 3.515) 3.925 1.138 ( 2.519 -6.154 8.370) 10.690 1.558 ( 4.897 3.077 -1.120) 5.890 1.633 ( 5.172 -0.849 -0.143) 5.243 1.870 ( 2.095 -2.631 2.270) 4.057 2.226 ( -6.869 0.345 21.611) 22.679 2.464 ( -3.151 -8.412 5.089) 10.325 2.861 ( -3.692 -0.221 14.825) 15.279 3.082 ( -11.428 -17.602 23.375) 31.413 3.216 ( 9.217 7.716 -2.227) 12.225 4.463 ( -16.269 -18.574 27.230) 36.758 5.470 ( -1.372 3.132 -7.957) 8.660 5.736 ( 5.451 3.599 -10.805) 12.626 5.775 ( -4.923 -0.800 3.863) 6.309 6.257 ( -2.761 3.337 5.476) 6.982 6.382 ( 1.252 0.673 -5.987) 6.153 6.869 ( -4.701 -5.857 0.828) 7.556 7.890 ( -0.612 -5.318 4.791) 7.184 8.226 ( -3.251 -2.284 3.094) 5.036 9.469 ( -2.022 16.335 5.197) 17.261 9.788 ( 1.497 5.926 -4.370) 7.514 9.900 ( 3.976 -3.837 -5.281) 7.643 10.131 ( -4.649 7.347 9.367) 12.780 11.057 ( -23.472 -39.234 31.010) 55.243 11.547 ( 3.218 2.292 -6.665) 7.748 12.682 ( 10.563 0.021 5.604) 11.957 13.361 ( 2.200 10.700 -4.826) 11.942 14.136 ( 4.190 12.086 -25.502) 28.530 14.746 ( 5.639 12.662 -13.966) 19.677 15.672 ( 2.777 -16.823 -4.055) 17.526 17.419 ( 2.853 -2.894 -8.021) 8.992 18.413 ( -13.548 -8.100 25.210) 29.744 18.965 ( -8.336 -0.177 -1.642) 8.498 19.134 ( -3.860 -0.068 8.802) 9.612 21.127 ( 31.434 21.728 -29.704) 48.400 ======================= Grid point 272 (126/366) ======================= q-point: ( 0.36 0.18 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.605 ( -0.578 4.265 2.540) 4.998 0.808 ( -0.903 -1.962 2.541) 3.335 1.278 ( 5.564 -3.933 6.556) 9.456 1.473 ( 2.131 6.611 -4.237) 8.136 1.667 ( -0.411 -0.065 -1.891) 1.936 1.964 ( 1.748 -4.870 3.613) 6.311 2.311 ( -4.353 -6.079 16.393) 18.017 2.637 ( -1.605 -12.404 -8.035) 14.866 2.884 ( -3.019 -2.039 9.096) 9.798 3.077 ( -1.691 7.705 2.403) 8.246 3.423 ( -12.268 -22.338 21.523) 33.358 4.870 ( -14.343 -28.567 25.599) 40.952 5.317 ( 0.262 10.855 -8.010) 13.493 5.579 ( 4.876 17.171 3.618) 18.213 5.787 ( -5.849 -3.046 7.134) 9.715 6.230 ( -0.613 -0.924 -1.569) 1.921 6.457 ( 3.443 -10.906 -12.863) 17.212 6.960 ( -2.922 -5.946 4.060) 7.770 7.939 ( 3.056 2.083 -4.791) 6.053 8.354 ( -4.665 -12.453 14.896) 19.968 9.254 ( 1.888 6.044 -4.958) 8.042 9.633 ( 3.232 11.464 -7.840) 14.260 9.912 ( -0.995 4.826 1.536) 5.161 10.112 ( -0.143 -5.717 1.265) 5.856 11.424 ( 7.599 6.134 -8.329) 12.835 11.772 ( -25.833 -41.439 35.312) 60.262 12.768 ( 9.089 -1.381 1.764) 9.361 13.008 ( 9.214 28.089 -24.578) 38.445 13.828 ( 3.921 17.300 -21.001) 27.490 14.675 ( -1.104 -4.868 3.783) 6.264 15.914 ( -2.041 -7.936 8.961) 12.143 17.398 ( -1.814 5.991 3.937) 7.395 18.608 ( -6.535 -15.415 6.759) 18.055 18.920 ( -6.415 -0.983 -1.603) 6.685 19.146 ( -0.859 -1.939 0.888) 2.300 20.739 ( 21.596 31.901 -21.028) 43.889 ======================= Grid point 273 (127/366) ======================= q-point: ( 0.45 0.18 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.599 ( 2.510 -2.941 -4.973) 6.299 0.853 ( -0.408 -2.898 1.129) 3.136 1.338 ( 2.739 8.274 -6.699) 10.992 1.376 ( 7.818 0.294 2.885) 8.338 1.630 ( -6.854 0.033 -1.345) 6.984 2.051 ( -0.039 -2.543 3.485) 4.314 2.349 ( -5.360 2.684 8.271) 10.215 2.806 ( 1.693 0.520 -0.454) 1.828 2.938 ( -3.130 -17.315 -11.383) 20.956 3.139 ( -8.707 -16.324 9.823) 20.947 3.816 ( -11.306 -23.350 20.042) 32.783 5.048 ( 2.469 18.955 -0.897) 19.136 5.270 ( 2.991 18.531 2.265) 18.907 5.343 ( -9.229 -22.013 22.949) 33.112 5.822 ( -6.554 -3.499 10.219) 12.635 6.313 ( 1.644 -9.583 -3.929) 10.487 6.685 ( 4.531 -13.963 -16.578) 22.144 7.056 ( -1.062 -4.369 8.324) 9.461 7.866 ( 2.481 4.929 -7.467) 9.284 8.618 ( -3.870 -13.382 16.249) 21.403 9.227 ( 3.517 2.122 -9.860) 10.682 9.416 ( 7.182 7.575 -15.236) 18.469 9.778 ( -3.389 8.489 5.947) 10.905 10.267 ( 0.294 -10.538 -2.894) 10.932 11.278 ( 7.598 11.266 -15.720) 20.779 12.366 ( 7.543 17.163 -11.635) 22.065 12.530 ( -15.044 -23.657 18.736) 33.719 12.870 ( 5.396 -5.071 -1.310) 7.519 13.485 ( 3.430 17.684 -16.734) 24.586 14.860 ( -5.647 -12.755 16.282) 21.440 15.970 ( -6.786 1.916 21.080) 22.228 17.204 ( -5.247 14.790 12.756) 20.223 18.847 ( -3.261 -10.407 -4.568) 11.824 18.928 ( -1.116 -6.595 -4.018) 7.803 19.208 ( 3.263 -5.275 -8.636) 10.632 20.225 ( 12.219 31.303 -13.470) 36.202 ======================= Grid point 274 (128/366) ======================= q-point: ( 0.55 0.18 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.699 ( 3.670 -7.410 -9.360) 12.490 0.911 ( -0.062 -3.589 -0.121) 3.591 1.176 ( 3.491 9.555 -9.014) 13.592 1.361 ( 4.707 6.442 -2.601) 8.392 1.618 ( -6.787 -4.240 3.649) 8.795 2.077 ( -0.904 -0.061 5.020) 5.101 2.255 ( -5.412 3.622 4.661) 8.008 2.810 ( 0.005 -2.248 4.675) 5.187 3.298 ( -3.158 -24.528 -12.362) 27.648 3.477 ( -6.476 -23.960 2.260) 24.923 4.170 ( -8.250 -15.792 18.009) 25.333 4.675 ( 1.436 24.564 10.903) 26.914 5.008 ( 5.932 11.822 -6.160) 14.591 5.513 ( -5.148 4.134 17.982) 19.156 5.973 ( -7.621 -14.836 13.044) 21.174 6.548 ( -0.062 -14.941 -4.854) 15.710 6.900 ( 5.169 -10.980 -16.692) 20.637 7.141 ( 0.871 -1.936 12.103) 12.287 7.805 ( 1.287 -0.690 -7.998) 8.130 8.713 ( -0.305 11.777 0.201) 11.782 9.095 ( -1.960 -0.374 12.157) 12.320 9.520 ( 4.654 -1.899 -12.141) 13.141 9.658 ( 4.365 -6.626 -13.201) 15.402 10.462 ( 0.529 -11.610 -4.226) 12.367 11.029 ( 11.195 17.676 -27.438) 34.505 11.803 ( 10.330 29.559 -26.739) 41.175 12.944 ( 5.991 -5.886 -2.315) 8.712 13.121 ( -0.292 9.040 -5.928) 10.815 13.312 ( -16.461 -33.755 32.952) 49.962 15.027 ( -10.018 -1.151 28.243) 29.989 15.950 ( -8.352 -2.769 23.312) 24.917 16.883 ( -6.632 20.243 16.196) 26.759 18.898 ( -2.228 -2.521 -0.821) 3.463 19.108 ( 4.218 -10.086 -14.315) 18.012 19.325 ( 6.584 -7.214 -15.585) 18.392 19.756 ( 5.313 23.401 -7.758) 25.219 ======================= Grid point 275 (129/366) ======================= q-point: (-0.36 0.18 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.850 ( 3.708 -9.170 -10.573) 14.479 0.973 ( 0.916 -1.752 -2.341) 3.064 1.004 ( 3.864 8.187 -9.207) 12.912 1.229 ( 0.594 8.326 -3.015) 8.875 1.689 ( -5.315 -5.977 5.459) 9.684 2.081 ( -1.147 0.775 6.142) 6.296 2.210 ( -0.739 -0.111 3.877) 3.949 2.880 ( -1.965 -3.230 5.218) 6.444 3.682 ( -3.730 -23.662 -8.277) 25.344 3.875 ( -5.092 -21.948 -3.198) 22.757 4.251 ( 3.098 10.504 10.367) 15.080 4.291 ( 0.721 19.692 13.917) 24.124 4.981 ( -0.725 -8.663 0.391) 8.702 5.344 ( -4.974 13.532 13.814) 19.968 6.207 ( -4.312 -10.999 9.716) 15.296 6.723 ( -2.300 -5.788 -5.317) 8.189 7.041 ( 3.387 -4.729 -13.268) 14.487 7.192 ( 1.754 1.527 13.876) 14.069 7.936 ( 1.530 -16.042 -7.059) 17.593 8.313 ( 2.473 25.765 -6.478) 26.682 9.245 ( -4.355 -7.252 15.972) 18.074 9.361 ( -5.142 8.707 8.654) 13.309 10.041 ( 15.460 -26.646 -38.068) 48.971 10.531 ( 9.810 16.556 -28.291) 34.216 10.790 ( 8.667 -5.379 -17.865) 20.572 11.362 ( 4.321 19.838 -14.150) 24.748 12.832 ( 3.581 15.530 -9.861) 18.741 13.081 ( 3.427 -7.351 -7.488) 11.039 14.007 ( -17.031 -37.937 43.364) 60.081 14.849 ( -14.666 19.583 37.879) 45.094 16.154 ( -7.347 -18.083 19.227) 27.398 16.493 ( -6.856 22.469 16.990) 28.992 18.932 ( 0.334 -2.105 0.107) 2.134 19.234 ( 6.468 -4.582 -17.586) 19.290 19.429 ( 3.974 9.505 -9.622) 14.097 19.459 ( 4.994 -2.649 -13.557) 14.688 ======================= Grid point 276 (130/366) ======================= q-point: (-0.27 0.18 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.819 ( 4.727 9.842 -11.322) 15.729 1.005 ( 0.425 2.686 -1.276) 3.004 1.020 ( 3.473 -9.565 -10.142) 14.367 1.099 ( 0.558 3.673 -0.594) 3.762 1.767 ( -5.176 -4.490 5.602) 8.851 2.053 ( -2.534 2.375 5.199) 6.252 2.257 ( 4.088 -1.536 3.623) 5.674 2.876 ( -2.922 4.150 4.514) 6.793 3.808 ( -2.483 20.414 15.028) 25.471 3.940 ( 2.367 10.269 -4.719) 11.546 4.138 ( 0.885 -13.234 1.552) 13.354 4.353 ( -2.785 -16.702 4.114) 17.425 5.084 ( -3.194 13.037 5.790) 14.618 5.211 ( -4.868 -15.221 6.155) 17.125 6.332 ( -2.432 -2.943 1.199) 4.002 6.740 ( -2.345 -0.569 -0.750) 2.527 7.024 ( -0.830 5.683 -8.973) 10.654 7.136 ( 1.118 9.849 15.030) 18.004 7.931 ( 4.604 14.147 -8.080) 16.930 8.319 ( 2.611 -24.286 -6.368) 25.243 9.100 ( -4.819 12.247 8.867) 15.869 9.467 ( -5.969 -10.194 15.745) 19.684 10.089 ( 13.543 25.303 -37.829) 47.483 10.509 ( 13.366 -22.341 -31.960) 41.222 11.017 ( 4.010 14.326 -8.227) 17.000 11.112 ( 7.538 -21.497 -19.865) 30.226 12.581 ( 5.057 12.799 -6.470) 15.207 13.225 ( 1.440 -8.482 -7.736) 11.570 14.408 ( -16.864 23.089 36.370) 46.263 14.623 ( -15.223 -25.725 40.191) 50.088 16.105 ( -6.677 19.430 17.295) 26.856 16.526 ( -7.110 -21.880 18.083) 29.262 18.978 ( 3.144 -1.642 1.018) 3.690 19.271 ( 0.428 5.333 -4.625) 7.072 19.273 ( 7.441 0.041 -17.214) 18.754 19.531 ( 5.499 -2.823 -18.700) 19.695 ======================= Grid point 277 (131/366) ======================= q-point: (-0.18 0.18 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.654 ( 4.738 8.434 -10.451) 14.241 0.905 ( 0.504 5.992 0.356) 6.023 1.080 ( 1.978 1.716 1.172) 2.869 1.188 ( 3.284 -8.960 -8.598) 12.845 1.793 ( -4.230 0.127 6.355) 7.635 2.002 ( -0.776 3.389 3.659) 5.048 2.298 ( 4.484 1.716 1.636) 5.072 2.728 ( -0.408 11.022 7.049) 13.090 3.414 ( 1.603 25.556 10.171) 27.552 3.651 ( -3.825 16.708 7.611) 18.755 4.378 ( -9.488 8.060 14.462) 19.083 4.553 ( -0.102 -19.292 4.367) 19.780 5.036 ( 1.792 -11.925 -14.984) 19.234 5.435 ( -5.216 -9.905 8.472) 14.038 6.263 ( -6.846 7.200 -1.201) 10.008 6.689 ( 1.634 12.986 -7.608) 15.139 6.777 ( -4.033 8.835 14.814) 17.714 7.053 ( 1.158 2.419 0.683) 2.768 7.830 ( 4.803 0.535 -7.982) 9.331 8.654 ( 0.398 -3.394 0.349) 3.435 8.975 ( -2.033 -7.362 4.271) 8.751 9.605 ( 1.767 3.680 -9.599) 10.431 9.705 ( 3.227 6.418 -8.625) 11.225 10.663 ( -0.813 14.333 -5.985) 15.553 10.872 ( 10.565 -10.475 -18.386) 23.651 11.662 ( 15.061 -34.078 -32.170) 49.225 12.422 ( 7.417 7.800 -2.697) 11.096 13.296 ( -2.474 3.693 4.107) 6.052 14.007 ( -18.400 10.683 16.471) 26.907 14.928 ( -10.935 -4.122 29.874) 32.078 15.871 ( -7.263 4.756 20.300) 22.078 16.906 ( -6.763 -19.886 16.739) 26.859 19.039 ( 6.606 -0.727 1.162) 6.747 19.189 ( 0.325 3.257 -7.100) 7.818 19.254 ( 6.109 2.522 -13.056) 14.634 19.545 ( 4.391 -1.478 -15.413) 16.094 ======================= Grid point 278 (132/366) ======================= q-point: (-0.09 0.18 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.550 ( 3.361 2.942 -5.477) 7.067 0.829 ( 1.086 3.361 1.831) 3.978 1.051 ( 4.229 4.069 3.579) 6.874 1.336 ( 2.834 -7.270 -6.601) 10.221 1.737 ( -1.852 5.696 7.176) 9.347 1.917 ( 2.244 8.098 4.248) 9.416 2.262 ( 2.832 4.962 4.356) 7.184 2.603 ( 4.100 4.885 8.497) 10.624 3.005 ( 3.644 23.446 7.212) 24.800 3.351 ( -9.795 14.325 13.037) 21.705 4.025 ( -12.665 22.200 20.021) 32.467 4.972 ( 3.888 -22.943 -1.379) 23.311 5.284 ( -0.186 -15.942 -14.751) 21.720 5.451 ( -8.298 10.003 12.930) 18.333 6.030 ( -11.574 8.453 8.919) 16.881 6.427 ( -2.211 8.508 -6.606) 10.996 6.669 ( 3.350 9.396 -0.383) 9.982 7.049 ( -0.730 -0.566 0.460) 1.032 7.871 ( 3.577 -3.349 -7.808) 9.218 8.514 ( -3.730 11.523 11.053) 16.397 9.239 ( 2.628 -8.630 -6.256) 10.978 9.413 ( 6.476 -0.793 -19.813) 20.860 9.817 ( -5.136 -8.046 11.834) 15.204 10.352 ( -1.033 15.762 -4.197) 16.344 11.090 ( 10.170 -9.019 -11.314) 17.685 12.229 ( 11.877 -15.191 -13.854) 23.744 12.452 ( 10.302 -14.915 -14.842) 23.428 12.984 ( -13.385 25.198 20.189) 34.953 13.954 ( -12.950 -12.651 -13.273) 22.448 14.827 ( -6.029 11.349 16.594) 20.988 15.894 ( -6.369 -2.321 19.374) 20.526 17.218 ( -5.427 -14.596 12.951) 20.254 19.007 ( 1.814 9.691 -5.529) 11.303 19.136 ( -0.102 0.903 -3.936) 4.040 19.208 ( 2.695 1.996 -6.380) 7.208 19.663 ( 15.910 -10.507 -7.683) 20.556 ======================= Grid point 282 (133/366) ======================= q-point: ( 0.27 0.27 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.776 ( -1.865 0.000 3.929) 4.349 0.842 ( -6.718 0.000 12.867) 14.515 1.073 ( 0.966 -0.000 6.407) 6.480 1.642 ( 0.260 -0.000 0.640) 0.691 1.654 ( 11.448 -0.000 -2.534) 11.725 1.854 ( 2.045 -0.000 -2.962) 3.600 2.259 ( -2.280 0.000 0.231) 2.292 2.347 ( -17.719 0.000 31.537) 36.174 2.882 ( -3.392 0.000 17.070) 17.404 2.912 ( -6.869 0.000 23.747) 24.720 3.350 ( 9.365 -0.000 -5.909) 11.074 4.256 ( -15.697 0.000 26.311) 30.638 5.468 ( 0.222 -0.000 -6.424) 6.428 5.718 ( -6.645 0.000 5.081) 8.365 5.751 ( 6.035 -0.000 -20.038) 20.927 6.342 ( -1.654 0.000 11.433) 11.552 6.396 ( 1.513 -0.000 -0.802) 1.713 6.770 ( -4.911 0.000 1.477) 5.129 7.832 ( -2.196 0.000 9.030) 9.293 8.198 ( -1.248 0.000 -1.902) 2.275 9.682 ( 0.188 -0.000 1.918) 1.927 9.844 ( -0.358 0.000 -1.093) 1.150 9.871 ( 3.934 -0.000 -4.085) 5.672 10.367 ( -3.628 0.000 12.162) 12.691 10.382 ( -24.932 0.000 32.995) 41.355 11.590 ( 4.566 -0.000 -7.871) 9.099 12.761 ( 8.235 -0.000 5.026) 9.648 13.444 ( -1.486 0.000 4.469) 4.709 14.225 ( 7.852 -0.000 -27.798) 28.886 14.954 ( 8.268 -0.000 -21.440) 22.979 15.445 ( 4.510 -0.000 -9.251) 10.292 17.373 ( 4.577 -0.000 -12.066) 12.905 18.327 ( -15.487 0.000 33.917) 37.285 18.903 ( -7.833 0.000 -1.589) 7.993 19.135 ( -5.069 0.000 12.448) 13.441 21.445 ( 27.538 -0.000 -35.618) 45.022 ======================= Grid point 283 (134/366) ======================= q-point: ( 0.36 0.27 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.725 ( -4.242 8.219 8.993) 12.900 0.782 ( -1.690 -0.928 3.724) 4.194 1.199 ( 0.323 -8.298 7.322) 11.072 1.585 ( 1.369 5.248 -1.532) 5.636 1.705 ( 6.186 2.140 -4.623) 8.014 1.893 ( 0.598 -4.082 -0.199) 4.130 2.222 ( -8.964 -1.937 17.151) 19.449 2.411 ( -7.029 -8.677 1.827) 11.315 2.888 ( -4.520 1.563 16.485) 17.165 3.063 ( -9.939 -14.274 22.974) 28.815 3.285 ( 4.079 10.218 -6.425) 12.741 4.396 ( -14.715 -18.878 27.160) 36.202 5.429 ( 0.712 3.814 -5.615) 6.825 5.713 ( -4.871 -2.476 5.150) 7.508 5.773 ( 6.775 -0.579 -14.171) 15.718 6.261 ( -2.455 6.651 9.673) 11.993 6.386 ( 2.733 1.712 -2.809) 4.277 6.825 ( -3.356 -7.032 3.287) 8.456 7.919 ( 0.698 -5.818 5.642) 8.135 8.205 ( -2.249 -3.258 3.217) 5.101 9.470 ( -1.804 16.522 5.104) 17.386 9.781 ( 1.025 5.606 -4.783) 7.440 9.921 ( 3.301 -2.720 -5.414) 6.900 10.122 ( -3.859 5.560 8.741) 11.055 10.941 ( -19.228 -39.904 33.665) 55.636 11.556 ( 3.786 4.295 -8.844) 10.536 12.816 ( 5.778 0.127 2.307) 6.223 13.364 ( 1.948 10.841 -4.456) 11.882 14.090 ( 8.536 12.618 -24.990) 29.267 14.746 ( 5.236 12.487 -13.716) 19.274 15.686 ( 2.392 -17.074 -3.939) 17.685 17.415 ( 2.931 -2.809 -8.138) 9.095 18.376 ( -12.262 -7.351 26.743) 30.324 18.859 ( -5.881 -0.724 -0.979) 6.006 19.130 ( -4.060 0.119 9.371) 10.214 21.316 ( 21.429 21.496 -31.945) 44.065 ======================= Grid point 284 (135/366) ======================= q-point: ( 0.45 0.27 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.608 ( -0.987 3.730 2.151) 4.417 0.808 ( -1.121 -2.099 2.535) 3.477 1.366 ( 1.499 -6.989 6.829) 9.886 1.477 ( 1.770 6.940 -4.226) 8.316 1.639 ( -0.382 5.163 -5.554) 7.592 1.986 ( -0.667 -5.004 1.626) 5.304 2.310 ( -7.607 -6.765 13.951) 17.270 2.542 ( -3.809 -12.094 -13.245) 18.336 2.885 ( -5.225 -2.125 14.394) 15.459 3.050 ( -2.212 11.249 -3.786) 12.073 3.388 ( -10.122 -21.219 22.694) 32.676 4.828 ( -12.337 -29.315 26.330) 41.290 5.306 ( 3.387 9.504 -5.577) 11.528 5.644 ( 0.372 15.179 4.972) 15.977 5.769 ( -1.020 -1.962 6.081) 6.471 6.228 ( 1.305 -1.977 -0.916) 2.540 6.441 ( 3.715 -9.060 -11.241) 14.908 6.953 ( -2.138 -7.441 6.252) 9.951 7.958 ( 3.671 3.668 -5.322) 7.433 8.371 ( -4.827 -14.185 15.531) 21.581 9.257 ( 2.324 6.252 -4.977) 8.322 9.632 ( 2.554 10.662 -7.609) 13.346 9.910 ( -0.099 5.627 0.638) 5.664 10.116 ( -0.179 -5.286 1.043) 5.391 11.443 ( 1.213 6.422 -10.225) 12.136 11.674 ( -16.609 -43.046 39.112) 60.486 12.855 ( 3.313 -1.096 -1.346) 3.740 13.002 ( 9.172 28.855 -24.508) 38.954 13.801 ( 7.869 17.965 -19.914) 27.950 14.679 ( -1.383 -5.185 3.779) 6.564 15.930 ( -2.642 -8.209 8.941) 12.422 17.395 ( -1.677 5.951 3.795) 7.254 18.570 ( -4.797 -14.584 8.391) 17.496 18.850 ( -2.930 -1.922 -0.293) 3.516 19.139 ( -0.895 -1.974 0.999) 2.386 20.856 ( 13.736 32.689 -24.148) 42.900 ======================= Grid point 285 (136/366) ======================= q-point: ( 0.55 0.27 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.600 ( 1.703 -2.940 -5.447) 6.420 0.852 ( -0.515 -2.903 1.106) 3.149 1.338 ( 2.551 8.424 -6.823) 11.137 1.493 ( 7.174 0.396 2.902) 7.749 1.510 ( -9.190 1.113 -3.319) 9.835 2.053 ( -2.191 -2.862 2.698) 4.502 2.315 ( -4.786 3.472 5.250) 7.908 2.783 ( -1.630 -14.309 -9.642) 17.331 2.857 ( -2.838 -3.586 -2.955) 5.444 3.076 ( -7.672 -15.664 9.247) 19.742 3.790 ( -8.719 -23.122 21.898) 33.018 5.093 ( 3.430 16.430 2.219) 16.931 5.284 ( -3.942 0.703 7.633) 8.620 5.387 ( -1.258 -5.814 17.359) 18.350 5.798 ( -4.800 -1.720 10.577) 11.742 6.327 ( 3.019 -8.209 -3.273) 9.338 6.660 ( 5.194 -14.235 -17.193) 22.917 7.086 ( -1.744 -6.317 9.743) 11.742 7.860 ( 2.521 6.276 -7.742) 10.280 8.643 ( -4.696 -13.083 15.058) 20.493 9.224 ( 3.527 2.318 -9.359) 10.266 9.434 ( 7.161 6.325 -15.062) 17.836 9.767 ( -2.564 9.221 5.445) 11.011 10.262 ( 1.128 -9.981 -2.473) 10.345 11.274 ( 4.208 10.492 -16.086) 19.660 12.397 ( 12.039 35.489 -33.220) 50.079 12.465 ( -16.108 -44.270 43.528) 64.140 12.899 ( 1.034 -3.207 -5.202) 6.198 13.475 ( 7.403 18.442 -15.204) 25.022 14.867 ( -6.068 -13.067 15.985) 21.519 15.983 ( -7.711 1.916 20.846) 22.309 17.202 ( -5.138 14.834 12.784) 20.246 18.808 ( 0.390 -9.115 -2.208) 9.387 18.911 ( 1.468 -8.145 -3.613) 9.030 19.205 ( 3.107 -5.650 -8.837) 10.939 20.271 ( 6.209 32.163 -16.077) 36.490 ======================= Grid point 286 (137/366) ======================= q-point: (-0.36 -0.73 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.692 ( 2.909 -7.392 -10.014) 12.782 0.911 ( 0.181 -3.647 0.010) 3.652 1.176 ( 3.496 9.419 -8.900) 13.422 1.353 ( -3.107 6.650 -5.499) 9.171 1.586 ( -0.757 -3.824 5.687) 6.895 2.082 ( -2.105 -1.145 4.295) 4.918 2.244 ( 0.274 2.327 3.918) 4.565 2.802 ( -4.639 -2.677 4.007) 6.689 3.202 ( -1.554 -24.969 -11.144) 27.387 3.402 ( -5.845 -23.115 2.014) 23.928 4.178 ( -6.021 -17.697 21.374) 28.395 4.756 ( 1.124 23.621 12.277) 26.644 5.050 ( 5.801 12.561 -8.652) 16.318 5.534 ( -5.434 5.325 16.811) 18.453 5.962 ( -4.613 -15.738 15.517) 22.578 6.525 ( 0.319 -12.188 -4.704) 13.068 6.888 ( 6.026 -11.088 -16.841) 21.045 7.200 ( -1.622 -4.193 11.776) 12.605 7.779 ( 1.390 -0.261 -8.331) 8.450 8.705 ( -0.480 12.558 -1.174) 12.622 9.123 ( -3.707 -1.704 12.475) 13.125 9.525 ( 3.757 2.557 -7.205) 8.519 9.653 ( 7.044 -10.023 -17.932) 21.717 10.462 ( 2.520 -11.324 -3.730) 12.186 11.023 ( 9.113 16.611 -26.927) 32.925 11.786 ( 8.712 29.631 -27.927) 41.640 12.958 ( -0.396 -5.306 -7.892) 9.518 13.104 ( 0.270 5.088 0.542) 5.124 13.323 ( -7.736 -29.959 33.420) 45.544 15.032 ( -11.135 -1.187 27.606) 29.791 15.954 ( -9.239 -2.628 22.925) 24.856 16.881 ( -6.428 20.275 16.309) 26.803 18.898 ( 2.270 -2.867 0.793) 3.742 19.104 ( 6.022 -9.847 -13.533) 17.787 19.324 ( 5.543 -7.411 -15.913) 18.408 19.754 ( 1.206 23.435 -9.554) 25.336 ======================= Grid point 287 (138/366) ======================= q-point: (-0.27 0.27 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.839 ( 3.281 -9.376 -11.149) 14.933 0.977 ( 1.417 -1.230 -2.269) 2.944 1.008 ( 3.808 7.486 -8.839) 12.193 1.202 ( -1.886 6.763 -3.293) 7.755 1.665 ( -2.385 -4.437 5.808) 7.688 2.078 ( -3.120 1.039 5.085) 6.056 2.277 ( 6.106 -1.563 4.626) 7.818 2.837 ( -7.844 -3.502 4.127) 9.531 3.612 ( -1.374 -23.807 -4.657) 24.297 3.797 ( -3.692 -22.296 -3.460) 22.863 4.332 ( -0.539 9.405 12.139) 15.365 4.388 ( 2.187 17.787 13.967) 22.721 4.968 ( 0.106 -6.013 -3.078) 6.755 5.345 ( -5.433 13.981 13.482) 20.168 6.219 ( -1.460 -9.772 10.065) 14.104 6.673 ( -2.283 -5.304 -1.625) 5.998 7.017 ( 3.768 -3.331 -14.392) 15.246 7.262 ( -1.462 0.225 11.422) 11.517 7.919 ( 1.626 -17.115 -7.182) 18.632 8.313 ( 2.660 24.793 -6.762) 25.835 9.265 ( -5.339 -7.721 16.157) 18.686 9.341 ( -4.413 10.078 8.640) 13.989 10.052 ( 16.052 -26.391 -38.197) 49.124 10.518 ( 10.783 17.697 -29.084) 35.712 10.820 ( 8.849 -7.399 -15.943) 19.678 11.327 ( 2.301 19.947 -15.261) 25.221 12.859 ( 7.146 15.258 -7.897) 18.608 13.047 ( -1.398 -7.989 -9.800) 12.721 14.038 ( -12.988 -36.945 44.775) 59.484 14.831 ( -17.159 20.641 36.941) 45.663 16.152 ( -7.785 -18.192 18.860) 27.336 16.493 ( -6.534 22.420 17.221) 29.015 18.970 ( 4.354 -2.437 1.698) 5.270 19.240 ( 7.573 -4.488 -16.470) 18.675 19.413 ( -1.005 12.165 -5.783) 13.507 19.437 ( 5.807 -5.336 -19.840) 21.350 ======================= Grid point 288 (139/366) ======================= q-point: (-0.18 0.27 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.824 ( 4.693 9.645 -10.843) 15.252 1.002 ( 0.473 1.994 -2.302) 3.082 1.012 ( 3.132 -8.252 -9.410) 12.902 1.110 ( 1.441 0.807 -0.319) 1.682 1.737 ( -3.465 -3.761 5.581) 7.569 2.044 ( -2.560 1.726 4.786) 5.696 2.358 ( 6.968 -0.179 4.371) 8.227 2.816 ( -8.899 0.927 3.817) 9.727 3.849 ( -2.696 17.579 13.939) 22.597 3.936 ( 1.654 0.585 -3.993) 4.361 4.162 ( -0.719 -3.892 3.342) 5.180 4.340 ( -1.498 -12.522 0.498) 12.621 5.047 ( -4.841 10.721 2.772) 12.086 5.210 ( -2.441 -11.614 11.256) 16.357 6.304 ( -2.312 1.231 0.245) 2.631 6.733 ( -0.582 -3.469 6.690) 7.558 6.968 ( -0.144 7.309 -10.115) 12.480 7.194 ( -1.681 9.158 8.532) 12.629 7.949 ( 4.259 13.355 -7.987) 16.133 8.320 ( 2.445 -25.094 -6.207) 25.966 9.098 ( -3.154 12.801 10.688) 16.972 9.460 ( -6.588 -10.229 14.136) 18.650 10.070 ( 13.138 25.444 -37.189) 46.937 10.525 ( 14.299 -22.716 -32.770) 42.360 10.971 ( -1.623 14.467 -11.201) 18.369 11.160 ( 12.249 -21.928 -16.548) 30.079 12.651 ( 9.305 11.916 -4.459) 15.762 13.175 ( -1.685 -9.904 -10.199) 14.316 14.341 ( -21.120 27.841 35.893) 50.095 14.648 ( -12.913 -26.043 41.144) 50.377 16.110 ( -6.306 19.241 17.794) 26.955 16.523 ( -7.366 -21.940 17.782) 29.186 19.057 ( 6.635 -2.557 1.982) 7.382 19.234 ( -2.220 4.222 -4.139) 6.316 19.296 ( 9.246 0.976 -17.475) 19.795 19.486 ( 3.348 -2.589 -19.999) 20.442 ======================= Grid point 289 (140/366) ======================= q-point: (-0.09 0.27 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.665 ( 4.813 8.114 -9.819) 13.617 0.913 ( 0.418 4.945 0.125) 4.964 1.124 ( 3.683 0.062 1.312) 3.910 1.187 ( 3.300 -8.832 -8.460) 12.667 1.770 ( -3.750 -0.813 4.909) 6.231 2.015 ( -0.330 1.813 4.191) 4.578 2.376 ( 4.275 3.643 3.021) 6.377 2.727 ( -4.179 4.088 5.744) 8.195 3.471 ( -0.352 24.138 7.503) 25.280 3.626 ( -4.512 20.452 4.926) 21.516 4.324 ( -9.420 9.278 13.285) 18.743 4.573 ( -1.387 -21.627 6.683) 22.679 4.980 ( 2.476 -10.416 -15.907) 19.174 5.429 ( -4.188 -8.411 13.031) 16.065 6.164 ( -8.243 9.846 3.098) 13.209 6.660 ( -0.362 18.175 -6.496) 19.304 6.818 ( 0.630 2.532 10.409) 10.731 7.057 ( -0.007 3.876 -2.493) 4.609 7.844 ( 3.538 0.845 -7.975) 8.765 8.668 ( 0.668 -3.722 2.349) 4.452 8.982 ( -0.651 -7.262 5.071) 8.881 9.576 ( 3.098 6.086 -13.773) 15.373 9.700 ( 1.652 4.031 -5.827) 7.276 10.608 ( -2.397 14.505 -5.947) 15.859 10.923 ( 12.236 -13.369 -21.116) 27.827 11.703 ( 15.232 -33.038 -29.812) 47.035 12.539 ( 10.920 7.285 -0.712) 13.146 13.272 ( -3.218 1.013 1.108) 3.551 13.806 ( -23.920 17.455 17.986) 34.645 14.946 ( -9.892 -2.954 30.021) 31.747 15.887 ( -6.803 4.420 21.315) 22.806 16.901 ( -6.893 -19.894 16.517) 26.760 19.122 ( 0.077 0.084 -0.865) 0.872 19.154 ( 4.014 4.751 -7.464) 9.716 19.269 ( 6.863 3.474 -14.284) 16.223 19.536 ( 6.514 -8.080 -12.928) 16.579 ======================= Grid point 294 (141/366) ======================= q-point: ( 0.36 0.36 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.771 ( -2.112 0.000 4.151) 4.657 0.822 ( -6.587 0.000 13.180) 14.735 1.107 ( -0.423 0.000 4.855) 4.873 1.647 ( -0.085 0.000 0.845) 0.850 1.759 ( 7.678 -0.000 -6.423) 10.010 1.847 ( -0.323 0.000 -4.485) 4.497 2.200 ( -3.860 0.000 -6.487) 7.548 2.270 ( -17.331 0.000 30.340) 34.941 2.923 ( -4.798 0.000 17.385) 18.035 2.926 ( -9.762 0.000 24.192) 26.087 3.388 ( 2.271 -0.000 -9.887) 10.144 4.193 ( -13.847 0.000 26.381) 29.794 5.456 ( 2.211 -0.000 -4.331) 4.863 5.672 ( -4.102 0.000 5.174) 6.603 5.726 ( 6.061 -0.000 -20.102) 20.996 6.381 ( -1.973 0.000 12.857) 13.007 6.440 ( 4.046 -0.000 2.893) 4.974 6.729 ( -3.281 0.000 3.890) 5.089 7.861 ( -1.363 0.000 10.924) 11.009 8.185 ( 1.172 -0.000 -2.785) 3.021 9.692 ( 0.072 -0.000 1.430) 1.432 9.830 ( -0.720 0.000 -1.226) 1.422 9.892 ( 2.428 -0.000 -4.285) 4.925 10.269 ( -18.137 0.000 33.120) 37.761 10.383 ( -3.498 0.000 11.939) 12.441 11.595 ( 2.837 -0.000 -8.862) 9.306 12.850 ( 2.066 -0.000 1.306) 2.444 13.447 ( -1.645 0.000 4.945) 5.211 14.212 ( 11.462 -0.000 -26.867) 29.210 14.949 ( 7.746 -0.000 -21.304) 22.668 15.456 ( 4.373 -0.000 -9.164) 10.154 17.371 ( 4.598 -0.000 -12.020) 12.870 18.309 ( -14.115 0.000 34.814) 37.567 18.816 ( -3.944 0.000 -0.197) 3.949 19.130 ( -5.364 0.000 12.593) 13.688 21.561 ( 18.581 -0.000 -36.874) 41.291 ======================= Grid point 295 (142/366) ======================= q-point: ( 0.45 0.36 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.714 ( -4.393 7.564 8.761) 12.380 0.777 ( -1.975 -0.989 3.994) 4.564 1.222 ( -2.296 -9.092 6.221) 11.253 1.589 ( 0.588 5.361 -1.520) 5.603 1.733 ( 2.174 5.049 -7.301) 9.139 1.885 ( -1.299 -5.022 -0.819) 5.252 2.172 ( -9.216 -3.653 10.972) 14.787 2.309 ( -9.145 -7.177 1.808) 11.765 2.908 ( -5.830 2.132 17.110) 18.201 3.049 ( -10.258 -12.850 22.749) 28.069 3.258 ( -1.755 10.202 -8.617) 13.469 4.359 ( -11.998 -19.580 26.904) 35.371 5.432 ( 3.425 3.809 -3.729) 6.336 5.681 ( -3.661 -1.754 4.587) 6.126 5.789 ( 7.416 -5.486 -15.630) 18.149 6.293 ( -1.757 9.081 13.128) 16.059 6.424 ( 4.038 3.483 -0.412) 5.348 6.813 ( -1.641 -7.793 4.920) 9.362 7.964 ( 1.199 -5.858 6.474) 8.813 8.201 ( -0.606 -3.309 2.893) 4.437 9.474 ( -1.656 16.448 5.033) 17.280 9.767 ( 0.554 5.375 -4.607) 7.101 9.931 ( 2.499 -2.572 -5.843) 6.856 10.120 ( -3.198 4.632 8.753) 10.407 10.887 ( -15.492 -38.138 33.905) 53.330 11.554 ( 3.090 3.410 -9.053) 10.156 12.851 ( -1.200 0.019 -1.222) 1.713 13.367 ( 1.793 11.067 -4.059) 11.924 14.099 ( 11.636 13.002 -23.834) 29.538 14.742 ( 4.983 12.221 -13.763) 19.068 15.695 ( 2.091 -17.129 -3.950) 17.702 17.413 ( 3.090 -2.750 -8.142) 9.132 18.366 ( -10.562 -6.953 27.856) 30.592 18.809 ( -1.165 -1.080 0.709) 1.740 19.123 ( -4.230 0.171 9.393) 10.303 21.374 ( 13.411 21.328 -34.427) 42.661 ======================= Grid point 296 (143/366) ======================= q-point: (-0.45 -0.64 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.601 ( -1.463 3.545 1.682) 4.188 0.804 ( -1.413 -2.254 2.536) 3.675 1.365 ( -6.487 -6.919 4.246) 10.391 1.476 ( 1.437 6.973 -4.353) 8.345 1.619 ( 1.869 5.574 -4.879) 7.640 1.961 ( -4.258 -5.005 1.199) 6.680 2.261 ( -9.308 -7.031 11.649) 16.486 2.413 ( -3.663 -13.085 -15.136) 20.341 2.902 ( -4.927 -2.260 17.313) 18.142 2.972 ( -5.074 11.221 -6.810) 14.072 3.393 ( -7.551 -20.803 24.268) 32.844 4.815 ( -10.084 -29.445 25.875) 40.475 5.346 ( 6.027 8.210 -3.802) 10.871 5.633 ( -3.878 8.391 2.368) 9.542 5.829 ( 3.653 3.664 7.421) 9.046 6.255 ( 3.369 -3.299 -0.898) 4.800 6.440 ( 3.638 -5.757 -8.345) 10.772 6.965 ( -1.538 -7.996 7.195) 10.866 7.980 ( 4.032 5.561 -5.983) 9.109 8.387 ( -4.762 -14.724 15.129) 21.642 9.264 ( 2.539 6.259 -4.821) 8.299 9.622 ( 1.898 9.899 -7.204) 12.389 9.916 ( 0.597 6.001 0.314) 6.038 10.118 ( -0.371 -5.318 1.123) 5.448 11.359 ( -7.131 -1.845 -2.677) 7.837 11.726 ( -5.173 -35.372 32.557) 48.351 12.838 ( -3.529 -1.468 -4.364) 5.801 12.997 ( 9.064 29.398 -24.015) 39.027 13.827 ( 10.841 18.233 -18.267) 27.994 14.677 ( -1.637 -5.399 3.572) 6.677 15.936 ( -3.218 -8.195 8.625) 12.325 17.393 ( -1.534 5.949 3.814) 7.232 18.571 ( -2.106 -14.261 9.633) 17.338 18.843 ( 1.562 -2.276 1.332) 3.065 19.132 ( -0.851 -2.039 0.922) 2.394 20.855 ( 6.240 32.694 -27.271) 43.030 ======================= Grid point 297 (144/366) ======================= q-point: (-0.36 -0.64 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.588 ( 1.049 -2.819 -6.188) 6.880 0.851 ( -0.607 -3.134 1.111) 3.380 1.332 ( -0.079 7.179 -6.360) 9.591 1.359 ( -8.283 1.593 -4.261) 9.450 1.595 ( 5.619 0.508 2.805) 6.300 2.019 ( -4.480 -4.599 1.628) 6.623 2.281 ( -3.096 0.473 2.439) 3.970 2.700 ( -1.079 -21.413 -12.111) 24.624 2.790 ( -6.739 0.958 -1.160) 6.905 3.051 ( -4.336 -12.994 13.712) 19.382 3.813 ( -5.884 -22.982 23.878) 33.659 5.146 ( -0.699 12.222 7.777) 14.503 5.275 ( 1.009 1.578 -1.291) 2.275 5.459 ( -2.115 -5.624 17.218) 18.236 5.818 ( -1.161 0.187 13.566) 13.617 6.355 ( 3.531 -5.836 -3.110) 7.496 6.645 ( 5.470 -14.733 -16.172) 22.550 7.107 ( -2.842 -6.841 9.410) 11.976 7.853 ( 2.656 7.662 -8.295) 11.601 8.651 ( -5.131 -12.270 13.074) 18.649 9.223 ( 3.112 3.432 -8.112) 9.341 9.448 ( 7.075 3.923 -15.745) 17.702 9.768 ( -1.979 9.947 6.287) 11.932 10.271 ( 2.044 -10.410 -2.227) 10.840 11.225 ( 0.803 8.566 -15.017) 17.307 12.356 ( 7.645 25.438 -27.541) 38.263 12.539 ( -6.555 -31.591 36.420) 48.656 12.843 ( -4.441 -4.183 -6.550) 8.952 13.524 ( 10.925 18.337 -12.807) 24.892 14.865 ( -6.537 -13.099 15.683) 21.454 15.982 ( -8.539 2.112 20.202) 22.034 17.201 ( -5.016 14.833 12.889) 20.281 18.836 ( 4.964 -9.994 -1.318) 11.236 18.930 ( 3.625 -7.043 -2.157) 8.210 19.199 ( 2.949 -5.585 -8.934) 10.941 20.222 ( 0.033 31.346 -18.584) 36.441 ======================= Grid point 298 (145/366) ======================= q-point: (-0.27 -0.64 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.674 ( 2.740 -7.535 -10.780) 13.435 0.915 ( 0.251 -3.978 0.098) 3.987 1.175 ( 3.040 8.972 -8.609) 12.800 1.256 ( -6.023 2.872 -4.443) 8.017 1.636 ( 2.909 -0.540 5.508) 6.253 2.065 ( -3.366 -1.966 3.330) 5.127 2.292 ( 3.904 -1.959 2.535) 5.050 2.731 ( -8.311 -2.342 2.294) 8.934 3.144 ( 0.577 -26.531 -8.629) 27.905 3.357 ( -3.543 -20.502 6.313) 21.742 4.227 ( -4.626 -18.548 23.498) 30.291 4.817 ( -1.611 22.452 9.943) 24.608 5.071 ( 5.337 12.934 -10.906) 17.740 5.545 ( -5.164 6.849 14.575) 16.912 6.024 ( 0.479 -15.106 19.033) 24.304 6.507 ( 0.411 -10.008 -4.243) 10.878 6.880 ( 5.339 -10.765 -15.644) 19.726 7.218 ( -4.222 -5.200 9.694) 11.783 7.757 ( 2.021 0.034 -8.878) 9.105 8.691 ( -0.245 12.423 -2.204) 12.620 9.125 ( -5.268 -2.094 11.469) 12.794 9.545 ( 2.263 6.486 -0.976) 6.938 9.659 ( 9.563 -13.321 -22.322) 27.698 10.490 ( 4.444 -11.661 -3.491) 12.958 10.991 ( 6.495 14.579 -24.970) 29.635 11.749 ( 8.537 30.473 -29.822) 43.484 12.861 ( -6.523 -6.842 -9.129) 13.142 13.131 ( 1.670 2.130 3.561) 4.473 13.445 ( -0.325 -24.597 32.343) 40.634 15.019 ( -12.210 -0.325 27.307) 29.914 15.944 ( -9.834 -2.805 22.066) 24.320 16.882 ( -6.232 20.208 16.506) 26.827 18.962 ( 5.715 -2.734 2.076) 6.667 19.125 ( 7.403 -9.482 -12.910) 17.647 19.307 ( 4.351 -6.606 -15.917) 17.774 19.691 ( -2.057 21.569 -11.470) 24.516 ======================= Grid point 299 (146/366) ======================= q-point: (-0.18 -0.64 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.824 ( 3.555 -9.611 -11.541) 15.434 0.986 ( 1.724 -0.482 -2.567) 3.129 1.013 ( 3.613 6.441 -8.187) 11.025 1.156 ( -2.226 3.691 -2.595) 5.031 1.686 ( 0.466 -1.866 6.893) 7.157 2.059 ( -3.480 0.719 4.542) 5.767 2.397 ( 7.509 -2.730 3.992) 8.932 2.727 ( -10.381 -2.877 2.857) 11.145 3.597 ( 0.736 -24.308 0.396) 24.322 3.748 ( -1.338 -22.541 -1.526) 22.632 4.364 ( -4.039 13.966 11.412) 18.482 4.465 ( 0.082 14.291 7.174) 15.991 4.962 ( 0.622 -5.054 0.104) 5.093 5.342 ( -4.924 13.923 11.641) 18.804 6.272 ( 1.431 -5.861 9.022) 10.853 6.655 ( -0.914 -6.637 4.458) 8.048 6.987 ( 2.657 -2.087 -14.093) 14.492 7.272 ( -4.076 -0.638 6.701) 7.869 7.905 ( 2.079 -17.810 -7.485) 19.430 8.313 ( 2.788 23.819 -6.953) 24.969 9.260 ( -7.555 -10.570 14.604) 19.547 9.345 ( -2.393 13.006 10.938) 17.162 10.069 ( 16.424 -26.116 -38.417) 49.271 10.514 ( 12.187 20.386 -31.181) 39.197 10.855 ( 7.155 -10.437 -11.879) 17.356 11.272 ( 2.334 19.672 -16.936) 26.062 12.910 ( 1.086 2.654 -8.087) 8.581 12.974 ( 3.585 1.913 -9.264) 10.116 14.123 ( -9.825 -34.321 44.874) 57.343 14.781 ( -18.790 22.661 36.664) 47.020 16.144 ( -8.008 -18.493 18.283) 27.210 16.498 ( -6.325 22.277 17.567) 29.067 19.055 ( 6.164 -2.782 2.292) 7.140 19.247 ( 3.102 -1.798 -11.787) 12.321 19.353 ( 1.177 2.914 -13.323) 13.688 19.418 ( 6.177 1.415 -17.739) 18.836 ======================= Grid point 300 (147/366) ======================= q-point: (-0.09 0.36 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.832 ( 4.746 9.377 -10.376) 14.769 0.996 ( 0.448 1.890 -2.184) 2.923 1.004 ( 3.232 -8.100 -9.819) 13.133 1.136 ( 2.624 -2.134 -0.089) 3.384 1.733 ( -1.963 -1.520 6.332) 6.801 2.036 ( -2.288 0.582 4.778) 5.329 2.458 ( 2.400 1.536 3.500) 4.513 2.710 ( -7.278 -1.300 3.992) 8.402 3.874 ( -2.203 16.687 7.114) 18.273 3.960 ( 1.750 2.137 4.341) 5.145 4.145 ( -3.909 -6.267 2.970) 7.960 4.303 ( -1.987 -8.999 -6.190) 11.102 5.005 ( -4.697 10.541 6.437) 13.214 5.250 ( -1.314 -10.414 12.480) 16.307 6.274 ( -2.942 5.785 2.112) 6.825 6.796 ( 2.299 -5.922 12.296) 13.840 6.912 ( -0.135 8.372 -10.553) 13.471 7.186 ( -2.749 8.566 0.666) 9.021 7.960 ( 3.493 13.339 -7.794) 15.839 8.319 ( 2.263 -25.867 -6.114) 26.676 9.126 ( -2.282 12.709 13.341) 18.567 9.440 ( -6.540 -10.405 12.048) 17.210 10.053 ( 13.428 25.897 -37.069) 47.171 10.545 ( 14.349 -22.879 -33.459) 42.998 10.885 ( -1.491 12.142 -12.190) 17.270 11.241 ( 11.802 -20.304 -14.907) 27.817 12.772 ( 11.220 10.301 -3.298) 15.584 13.081 ( -3.135 -11.516 -12.056) 16.964 14.232 ( -23.152 31.960 37.043) 54.126 14.704 ( -11.248 -24.156 41.214) 49.078 16.122 ( -6.200 18.897 18.415) 27.105 16.516 ( -7.468 -22.075 17.424) 29.097 19.119 ( -1.938 1.056 -1.447) 2.640 19.210 ( 4.795 -0.865 -1.742) 5.175 19.333 ( 9.868 1.810 -17.602) 20.260 19.424 ( 3.450 -2.646 -19.560) 20.038 ======================= Grid point 306 (148/366) ======================= q-point: (-0.55 -0.55 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.762 ( -2.506 0.000 4.414) 5.076 0.803 ( -6.408 0.000 13.057) 14.544 1.113 ( -2.231 0.000 4.272) 4.820 1.648 ( -0.392 0.000 0.632) 0.744 1.762 ( -2.655 0.000 -10.634) 10.960 1.822 ( 0.963 -0.000 -2.436) 2.619 2.094 ( -4.975 0.000 -10.288) 11.427 2.215 ( -14.787 0.000 31.202) 34.528 2.906 ( -12.604 0.000 25.447) 28.397 2.928 ( -7.525 0.000 16.443) 18.083 3.313 ( -3.740 0.000 -13.080) 13.604 4.166 ( -10.928 0.000 25.809) 28.027 5.481 ( 4.404 -0.000 -3.501) 5.626 5.664 ( -1.535 0.000 6.221) 6.408 5.706 ( 6.705 -0.000 -19.836) 20.939 6.428 ( -1.081 0.000 13.428) 13.471 6.526 ( 5.328 -0.000 4.689) 7.097 6.720 ( -1.689 0.000 4.932) 5.214 7.905 ( -1.523 0.000 12.742) 12.833 8.201 ( 3.863 -0.000 -3.763) 5.393 9.697 ( -0.232 0.000 0.791) 0.824 9.814 ( -0.977 0.000 -0.423) 1.065 9.891 ( 0.982 -0.000 -4.847) 4.946 10.238 ( -13.002 0.000 34.353) 36.731 10.397 ( -3.842 0.000 11.985) 12.585 11.576 ( 1.694 -0.000 -9.340) 9.492 12.825 ( -5.444 0.000 -2.041) 5.814 13.452 ( -1.757 0.000 5.446) 5.722 14.246 ( 13.991 -0.000 -25.586) 29.161 14.938 ( 7.568 -0.000 -21.652) 22.937 15.467 ( 4.358 -0.000 -9.079) 10.071 17.370 ( 4.700 -0.000 -11.983) 12.872 18.315 ( -12.624 0.000 35.601) 37.773 18.803 ( 1.426 -0.000 1.631) 2.166 19.123 ( -5.542 0.000 12.487) 13.661 21.560 ( 11.217 -0.000 -39.899) 41.445 ======================= Grid point 307 (149/366) ======================= q-point: (-0.45 -0.55 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.700 ( -4.482 7.102 8.459) 11.920 0.770 ( -2.322 -0.911 4.384) 5.044 1.200 ( -5.466 -7.697 4.970) 10.668 1.584 ( -0.177 5.295 -2.258) 5.759 1.679 ( -4.215 3.015 -7.422) 9.052 1.853 ( -3.607 -3.378 1.072) 5.057 2.095 ( -6.643 -6.190 0.160) 9.081 2.204 ( -10.871 -2.809 11.236) 15.885 2.910 ( -6.812 0.737 16.069) 17.469 3.013 ( -11.156 -8.344 15.554) 20.880 3.177 ( -4.413 2.887 -1.425) 5.463 4.353 ( -9.788 -20.134 25.986) 34.300 5.477 ( 5.720 3.242 -3.066) 7.255 5.661 ( -1.878 0.555 1.550) 2.497 5.812 ( 7.566 -9.109 -13.327) 17.828 6.350 ( -0.690 9.944 14.635) 17.708 6.484 ( 4.486 5.663 0.879) 7.278 6.829 ( -0.074 -8.065 5.059) 9.521 8.013 ( 0.576 -5.735 7.240) 9.254 8.219 ( 1.361 -2.262 1.909) 3.258 9.479 ( -1.561 16.187 5.042) 17.025 9.750 ( 0.321 5.370 -3.872) 6.628 9.927 ( 1.645 -3.442 -6.407) 7.457 10.129 ( -2.630 5.024 9.490) 11.056 10.875 ( -12.518 -35.192 32.704) 49.646 11.551 ( 3.035 0.086 -6.734) 7.387 12.772 ( -8.279 -0.378 -3.927) 9.171 13.369 ( 1.645 11.356 -3.677) 12.049 14.148 ( 13.685 13.181 -22.189) 29.212 14.736 ( 5.081 11.943 -14.137) 19.191 15.701 ( 1.941 -16.896 -4.112) 17.497 17.413 ( 3.253 -2.728 -8.035) 9.088 18.386 ( -8.618 -7.132 28.566) 30.678 18.837 ( 3.937 -1.116 2.378) 4.733 19.115 ( -4.235 0.102 9.242) 10.167 21.313 ( 5.725 21.431 -38.440) 44.381 ======================= Grid point 308 (150/366) ======================= q-point: (-0.36 -0.55 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.587 ( -1.819 3.715 1.227) 4.315 0.797 ( -1.597 -2.454 2.617) 3.927 1.246 ( -11.997 -2.473 -0.503) 12.260 1.470 ( 1.154 6.716 -4.502) 8.167 1.625 ( 0.473 -0.828 -0.302) 1.000 1.884 ( -8.523 -4.880 2.853) 10.227 2.200 ( -7.788 -6.476 9.970) 14.212 2.299 ( -2.220 -15.378 -12.345) 19.845 2.830 ( -8.366 8.037 -8.387) 14.315 2.949 ( -3.674 -2.439 18.370) 18.892 3.442 ( -4.658 -20.850 25.530) 33.290 4.828 ( -7.707 -29.093 24.555) 38.842 5.421 ( 7.446 7.335 -3.161) 10.919 5.584 ( -4.062 6.955 -0.195) 8.057 5.926 ( 4.389 3.188 8.107) 9.754 6.307 ( 5.013 -4.043 -0.999) 6.517 6.448 ( 2.955 -1.680 -5.534) 6.495 6.984 ( -1.190 -7.474 6.524) 9.992 8.000 ( 3.837 7.375 -6.656) 10.650 8.401 ( -4.493 -14.113 13.753) 20.212 9.273 ( 2.519 6.143 -4.447) 7.991 9.609 ( 1.599 9.439 -6.682) 11.675 9.928 ( 0.796 5.775 0.578) 5.858 10.119 ( -0.540 -5.742 1.620) 5.991 11.247 ( -7.702 -3.528 -1.074) 8.540 11.857 ( -0.431 -33.451 31.120) 45.690 12.721 ( -9.330 -2.383 -6.221) 11.464 12.993 ( 8.891 29.571 -23.204) 38.625 13.899 ( 13.229 17.853 -15.857) 27.299 14.673 ( -1.664 -5.394 3.222) 6.500 15.934 ( -3.595 -7.828 8.099) 11.823 17.394 ( -1.434 5.995 3.994) 7.345 18.613 ( 0.476 -14.629 10.060) 17.760 18.903 ( 5.493 -1.815 2.663) 6.369 19.127 ( -0.651 -2.126 0.744) 2.344 20.733 ( -1.863 31.871 -30.829) 44.381 ======================= Grid point 309 (151/366) ======================= q-point: (-0.27 -0.55 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.566 ( 0.943 -2.777 -6.953) 7.546 0.848 ( -0.705 -3.428 1.119) 3.674 1.184 ( -10.771 -1.468 -3.744) 11.497 1.336 ( 2.451 7.832 -6.708) 10.599 1.672 ( 3.141 -0.962 3.947) 5.136 1.956 ( -5.649 -7.488 0.906) 9.423 2.260 ( -1.899 -3.449 2.636) 4.738 2.642 ( 0.717 -22.294 -8.477) 23.862 2.662 ( -9.707 -1.476 -4.063) 10.626 3.103 ( -0.967 -10.349 18.445) 21.172 3.877 ( -3.995 -22.568 25.019) 33.929 5.134 ( -5.743 7.704 5.249) 10.950 5.310 ( 6.470 10.528 -6.104) 13.783 5.508 ( -3.623 -9.796 16.714) 19.709 5.914 ( 2.777 -0.215 18.423) 18.633 6.383 ( 2.930 -2.785 -3.428) 5.300 6.636 ( 5.250 -15.030 -14.541) 21.561 7.107 ( -3.764 -6.009 7.542) 10.352 7.844 ( 2.885 8.695 -8.954) 12.810 8.644 ( -5.223 -11.352 10.902) 16.583 9.222 ( 2.474 5.184 -6.504) 8.677 9.458 ( 7.167 1.305 -17.025) 18.518 9.779 ( -2.021 10.288 8.086) 13.240 10.293 ( 2.959 -11.665 -2.108) 12.218 11.146 ( -1.100 6.667 -13.413) 15.019 12.322 ( 9.584 27.533 -29.881) 41.746 12.618 ( -6.716 -16.330 15.209) 23.304 12.757 ( -5.721 -18.026 12.558) 22.702 13.635 ( 14.211 16.901 -8.856) 23.791 14.857 ( -6.833 -12.836 15.485) 21.242 15.967 ( -9.013 2.501 19.345) 21.488 17.203 ( -4.886 14.789 13.045) 20.317 18.912 ( 7.393 -12.827 -3.179) 15.143 18.987 ( 5.604 -3.331 0.685) 6.555 19.190 ( 2.811 -5.043 -8.850) 10.566 20.078 ( -6.013 28.288 -20.677) 35.551 ======================= Grid point 310 (152/366) ======================= q-point: (-0.18 -0.55 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.656 ( 3.313 -7.908 -11.275) 14.165 0.917 ( -0.025 -4.486 0.080) 4.487 1.141 ( -3.747 0.938 -4.008) 5.567 1.191 ( 1.906 7.313 -7.437) 10.603 1.710 ( 3.049 0.277 6.638) 7.310 2.031 ( -3.743 -2.896 2.460) 5.334 2.365 ( 4.386 -6.267 2.926) 8.189 2.610 ( -9.813 -3.190 -0.623) 10.337 3.127 ( 2.922 -28.421 -6.210) 29.238 3.383 ( -0.316 -16.296 13.063) 20.888 4.292 ( -4.489 -17.721 23.988) 30.159 4.802 ( -5.016 20.426 1.666) 21.098 5.089 ( 4.750 14.031 -7.928) 16.801 5.550 ( -4.388 7.975 11.520) 14.682 6.168 ( 4.676 -12.301 21.404) 25.126 6.492 ( 0.194 -9.901 -2.588) 10.235 6.862 ( 3.459 -9.690 -14.258) 17.583 7.191 ( -5.961 -5.004 6.540) 10.166 7.743 ( 3.205 0.063 -9.361) 9.895 8.677 ( 0.218 11.695 -2.832) 12.035 9.104 ( -6.182 -1.477 9.902) 11.766 9.573 ( 0.543 8.449 4.484) 9.581 9.673 ( 11.154 -15.533 -25.403) 31.796 10.542 ( 5.898 -12.495 -3.475) 14.247 10.938 ( 4.294 12.432 -22.249) 25.846 11.707 ( 9.630 31.814 -32.001) 46.141 12.707 ( -8.674 -8.079 -9.547) 15.221 13.178 ( 1.531 -0.767 5.651) 5.905 13.641 ( 4.239 -19.026 30.721) 36.383 14.994 ( -12.891 1.138 27.398) 30.301 15.924 ( -9.944 -3.228 21.010) 23.467 16.887 ( -6.091 20.083 16.734) 26.841 19.059 ( 6.408 -2.092 2.250) 7.106 19.157 ( 6.410 -8.109 -11.811) 15.696 19.273 ( 3.053 -4.622 -15.684) 16.633 19.594 ( -1.865 16.253 -13.307) 21.088 ======================= Grid point 311 (153/366) ======================= q-point: (-0.09 -0.55 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.815 ( 4.232 -9.821 -11.688) 15.842 0.995 ( 1.776 -0.114 -2.842) 3.354 1.018 ( 3.333 5.955 -7.725) 10.308 1.121 ( -1.218 0.496 -1.864) 2.281 1.742 ( 1.375 0.350 8.409) 8.528 2.035 ( -3.216 -0.029 4.081) 5.196 2.458 ( -4.966 -1.176 2.731) 5.788 2.654 ( 1.402 -4.539 2.680) 5.455 3.629 ( 1.993 -25.107 4.106) 25.518 3.751 ( 1.400 -21.404 2.651) 21.613 4.340 ( -6.024 18.181 4.904) 19.771 4.462 ( -3.172 14.085 1.429) 14.508 4.991 ( 0.338 -5.941 7.655) 9.696 5.333 ( -4.436 13.760 8.321) 16.680 6.333 ( 1.244 0.200 5.965) 6.097 6.708 ( 2.230 -9.783 12.506) 16.034 6.939 ( 1.012 -1.534 -13.124) 13.252 7.230 ( -5.087 -1.227 1.471) 5.435 7.898 ( 2.829 -17.795 -7.790) 19.630 8.314 ( 2.817 23.236 -6.946) 24.415 9.224 ( -7.989 -10.267 11.917) 17.642 9.382 ( -2.377 11.950 14.188) 18.702 10.087 ( 16.399 -25.875 -38.708) 49.363 10.514 ( 12.790 22.634 -32.940) 41.963 10.886 ( 5.427 -11.112 -7.976) 14.715 11.220 ( 3.983 17.730 -18.635) 26.028 12.796 ( -5.894 -10.384 -11.035) 16.259 13.056 ( 9.903 11.352 -5.460) 16.024 14.236 ( -8.316 -30.411 43.667) 53.859 14.719 ( -19.143 24.711 37.003) 48.439 16.131 ( -7.961 -18.877 17.675) 27.058 16.507 ( -6.294 22.100 17.921) 29.141 19.124 ( -0.382 0.566 -0.999) 1.210 19.197 ( 0.427 -1.120 -3.749) 3.936 19.322 ( 5.815 -3.139 -19.432) 20.525 19.432 ( 9.683 3.213 -16.681) 19.553 ======================= Grid point 318 (154/366) ======================= q-point: (-0.45 -0.45 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.750 ( -2.967 0.000 4.792) 5.636 0.788 ( -5.935 0.000 12.878) 14.180 1.092 ( -4.347 0.000 4.508) 6.263 1.605 ( -12.067 0.000 -10.637) 16.086 1.643 ( -0.531 0.000 -0.072) 0.536 1.814 ( -0.783 0.000 -1.629) 1.807 1.974 ( -4.820 0.000 -9.150) 10.342 2.202 ( -12.451 0.000 33.144) 35.406 2.858 ( -14.696 0.000 26.515) 30.315 2.907 ( -8.137 0.000 16.811) 18.676 3.171 ( -5.548 0.000 -15.890) 16.831 4.162 ( -9.547 0.000 24.482) 26.278 5.533 ( 6.114 -0.000 -4.046) 7.331 5.692 ( -0.025 0.000 7.604) 7.604 5.699 ( 7.687 -0.000 -19.401) 20.868 6.496 ( 0.249 -0.000 14.154) 14.156 6.621 ( 5.071 -0.000 4.240) 6.610 6.732 ( -0.019 0.000 3.625) 3.625 7.950 ( -2.291 0.000 13.802) 13.991 8.245 ( 5.676 -0.000 -4.499) 7.242 9.694 ( -0.511 0.000 0.052) 0.513 9.802 ( -1.053 0.000 1.400) 1.752 9.868 ( -0.211 0.000 -5.783) 5.787 10.284 ( -7.925 0.000 37.142) 37.978 10.405 ( -4.537 0.000 12.294) 13.105 11.549 ( 1.606 -0.000 -8.661) 8.809 12.690 ( -11.779 0.000 -3.975) 12.432 13.457 ( -1.890 0.000 5.841) 6.139 14.315 ( 15.520 -0.000 -23.966) 28.553 14.926 ( 7.891 -0.000 -22.316) 23.670 15.478 ( 4.407 -0.000 -9.040) 10.057 17.371 ( 4.803 -0.000 -11.986) 12.912 18.345 ( -11.031 0.000 36.283) 37.923 18.868 ( 6.150 -0.000 2.998) 6.842 19.114 ( -5.531 0.000 12.319) 13.503 21.437 ( 3.424 -0.000 -45.548) 45.676 ======================= Grid point 319 (155/366) ======================= q-point: (-0.36 -0.45 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.684 ( -4.404 6.852 8.381) 11.687 0.763 ( -2.438 -0.677 5.000) 5.604 1.119 ( -10.080 -3.174 2.163) 10.787 1.517 ( -8.654 -2.684 -5.381) 10.538 1.597 ( -1.677 3.313 -1.733) 4.098 1.801 ( -6.598 0.382 5.780) 8.780 2.005 ( -3.964 -8.967 -5.068) 11.037 2.144 ( -10.123 1.756 19.349) 21.908 2.861 ( -10.178 1.994 -0.640) 10.391 2.928 ( -9.210 -1.241 15.026) 17.668 3.166 ( -2.922 -12.363 15.301) 19.888 4.365 ( -8.414 -21.344 25.282) 34.140 5.545 ( 6.918 2.431 -4.422) 8.563 5.646 ( -0.442 3.444 -0.919) 3.592 5.852 ( 7.472 -11.017 -10.118) 16.720 6.425 ( -0.050 10.058 14.975) 18.039 6.546 ( 4.036 7.389 0.479) 8.433 6.860 ( 1.249 -7.760 3.597) 8.644 8.051 ( -0.919 -5.301 7.383) 9.135 8.255 ( 2.801 -0.631 0.680) 2.950 9.485 ( -1.527 15.795 5.051) 16.653 9.737 ( 0.359 5.619 -2.635) 6.216 9.909 ( 0.957 -4.984 -6.803) 8.487 10.149 ( -2.224 6.664 10.537) 12.664 10.895 ( -8.598 -29.859 28.749) 42.332 11.577 ( 4.004 -6.640 -0.285) 7.759 12.601 ( -13.032 -0.966 -4.930) 13.967 13.371 ( 1.457 11.692 -3.509) 12.294 14.231 ( 15.004 12.895 -19.632) 27.872 14.732 ( 5.605 11.725 -14.698) 19.620 15.704 ( 1.937 -16.397 -4.379) 17.081 17.415 ( 3.326 -2.753 -7.872) 8.978 18.435 ( -6.566 -7.715 28.744) 30.477 18.931 ( 7.456 -0.858 3.359) 8.223 19.108 ( -4.023 -0.068 8.999) 9.857 21.114 ( -3.585 21.540 -44.246) 49.341 ======================= Grid point 320 (156/366) ======================= q-point: (-0.27 -0.45 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.567 ( -1.892 4.135 0.983) 4.652 0.791 ( -1.438 -2.614 2.798) 4.090 1.055 ( -14.604 -1.627 -2.650) 14.932 1.458 ( 0.495 5.838 -4.316) 7.277 1.618 ( -2.820 -6.569 3.523) 7.970 1.779 ( -10.199 -4.707 6.693) 13.075 2.160 ( -5.546 -5.591 8.958) 11.927 2.232 ( -0.086 -17.839 -6.341) 18.933 2.659 ( -9.411 6.675 -9.832) 15.159 3.002 ( -3.623 -6.489 19.815) 21.163 3.530 ( -2.586 -20.464 25.650) 32.915 4.866 ( -5.040 -28.151 22.593) 36.447 5.498 ( 5.435 6.501 -5.805) 10.271 5.532 ( -1.802 7.753 0.614) 7.983 6.026 ( 4.240 -0.296 7.429) 8.559 6.373 ( 5.534 -3.964 -1.260) 6.923 6.458 ( 1.854 2.617 -3.063) 4.434 6.999 ( -0.800 -6.054 4.509) 7.591 8.010 ( 2.918 8.554 -7.244) 11.583 8.410 ( -4.202 -12.600 11.709) 17.706 9.284 ( 2.305 5.951 -3.967) 7.514 9.597 ( 1.724 9.396 -6.148) 11.360 9.942 ( 0.457 5.055 1.247) 5.227 10.121 ( -0.656 -6.431 2.459) 6.916 11.150 ( -5.162 -2.098 -2.426) 6.077 12.035 ( 2.615 -32.028 30.031) 43.983 12.542 ( -11.785 -4.263 -5.258) 13.591 12.990 ( 8.516 29.374 -22.570) 38.010 14.017 ( 15.546 16.605 -12.217) 25.820 14.668 ( -1.419 -5.110 2.828) 6.011 15.926 ( -3.723 -7.171 7.504) 11.027 17.396 ( -1.375 6.034 4.232) 7.498 18.684 ( 2.344 -14.841 9.572) 17.815 19.008 ( 7.300 -1.001 3.225) 8.043 19.124 ( -0.179 -2.197 0.510) 2.262 20.476 ( -11.252 29.118 -34.009) 46.163 ======================= Grid point 321 (157/366) ======================= q-point: (-0.18 -0.45 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.544 ( 1.516 -3.018 -7.349) 8.088 0.841 ( -1.273 -3.431 0.934) 3.777 1.036 ( -8.351 -5.474 -2.323) 10.251 1.334 ( 2.468 7.513 -6.724) 10.380 1.720 ( 0.025 -3.625 5.978) 6.992 1.888 ( -4.835 -10.239 1.349) 11.404 2.259 ( -1.274 -7.257 4.847) 8.819 2.503 ( -9.725 0.494 -4.602) 10.771 2.637 ( 3.261 -25.524 -3.708) 25.997 3.203 ( 0.084 -10.676 20.154) 22.808 3.960 ( -3.642 -21.736 25.141) 33.434 5.068 ( -4.557 10.811 -2.618) 12.021 5.361 ( 4.426 13.135 -3.264) 14.240 5.541 ( -3.039 -10.827 12.853) 17.078 6.070 ( 3.765 -4.237 21.852) 22.575 6.395 ( 1.741 0.053 -3.468) 3.881 6.630 ( 4.492 -14.109 -12.790) 19.566 7.087 ( -3.901 -4.214 4.802) 7.485 7.837 ( 3.316 8.847 -9.420) 13.342 8.625 ( -5.306 -10.681 8.933) 14.901 9.221 ( 1.993 7.227 -5.062) 9.046 9.462 ( 7.379 -0.857 -18.510) 19.945 9.796 ( -2.747 10.135 10.190) 14.632 10.327 ( 3.563 -13.407 -2.123) 14.034 11.064 ( -0.770 5.782 -12.097) 13.430 12.288 ( 8.402 26.301 -30.420) 41.081 12.513 ( -5.803 1.056 -9.556) 11.229 12.841 ( -3.735 -28.683 31.775) 42.968 13.811 ( 16.628 14.413 -3.389) 22.264 14.846 ( -6.897 -12.344 15.447) 20.941 15.945 ( -9.038 2.982 18.521) 20.824 17.207 ( -4.753 14.719 13.201) 20.335 18.984 ( 6.419 -12.955 -5.069) 15.321 19.080 ( 6.579 -1.191 1.657) 6.888 19.181 ( 2.449 -3.847 -8.399) 9.557 19.856 ( -9.918 21.421 -21.113) 31.670 ======================= Grid point 322 (158/366) ======================= q-point: (-0.09 -0.45 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.646 ( 4.078 -8.335 -11.411) 14.708 0.914 ( -0.585 -5.364 -0.013) 5.396 1.079 ( -2.636 -2.782 -1.639) 4.168 1.187 ( 3.269 8.659 -8.313) 12.441 1.779 ( 1.047 -0.745 8.335) 8.433 1.999 ( -2.603 -3.540 2.324) 4.971 2.404 ( -5.030 -1.128 3.170) 6.052 2.509 ( 0.110 -12.802 -1.309) 12.869 3.159 ( 4.860 -29.022 -1.665) 29.473 3.471 ( 1.331 -13.334 16.356) 21.144 4.354 ( -5.054 -15.672 23.665) 28.830 4.716 ( -5.761 19.588 -5.209) 21.072 5.108 ( 3.036 14.676 -5.600) 15.998 5.544 ( -4.183 8.997 7.958) 12.719 6.345 ( 5.003 -4.339 15.133) 16.518 6.496 ( 0.514 -16.589 6.163) 17.704 6.822 ( 1.131 -8.065 -12.565) 14.973 7.133 ( -6.108 -3.873 3.072) 7.858 7.746 ( 4.674 -0.105 -9.436) 10.531 8.667 ( 0.553 10.341 -3.050) 10.795 9.067 ( -6.286 0.061 8.201) 10.333 9.603 ( -0.881 8.325 7.299) 11.107 9.689 ( 11.354 -16.287 -26.317) 32.966 10.607 ( 6.317 -13.584 -3.717) 15.435 10.879 ( 3.706 10.927 -19.626) 22.767 11.673 ( 11.008 33.071 -33.810) 48.559 12.545 ( -7.607 -8.872 -9.060) 14.787 13.227 ( 0.851 -3.079 6.863) 7.570 13.863 ( 4.977 -13.445 27.971) 31.431 14.964 ( -13.027 2.741 27.831) 30.851 15.900 ( -9.568 -3.756 20.084) 22.562 16.894 ( -6.050 19.972 16.928) 26.871 19.126 ( -1.469 0.091 -2.955) 3.302 19.156 ( 4.038 -3.453 -4.742) 7.121 19.239 ( 5.211 -4.510 -16.359) 17.751 19.532 ( 4.117 6.786 -14.387) 16.431 ======================= Grid point 330 (159/366) ======================= q-point: (-0.36 -0.36 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.734 ( -3.320 0.000 5.482) 6.409 0.779 ( -5.412 0.000 12.026) 13.188 1.045 ( -6.467 0.000 5.356) 8.397 1.334 ( -19.937 0.000 -8.483) 21.667 1.634 ( -0.360 0.000 -0.986) 1.050 1.788 ( -2.252 0.000 0.291) 2.271 1.884 ( -3.074 0.000 -3.523) 4.676 2.224 ( -10.341 0.000 33.283) 34.853 2.795 ( -15.567 0.000 27.288) 31.416 2.885 ( -10.322 0.000 17.457) 20.280 3.023 ( -1.878 0.000 -15.439) 15.553 4.164 ( -9.055 0.000 24.011) 25.661 5.596 ( 6.707 -0.000 -5.249) 8.517 5.708 ( 8.775 -0.000 -19.491) 21.376 5.737 ( 0.292 -0.000 8.592) 8.597 6.572 ( -1.173 0.000 14.895) 14.941 6.697 ( 3.547 -0.000 1.980) 4.062 6.762 ( 3.530 -0.000 0.195) 3.536 7.986 ( -3.288 0.000 13.749) 14.137 8.299 ( 5.766 -0.000 -4.877) 7.552 9.685 ( -0.609 0.000 -0.511) 0.795 9.802 ( -1.001 0.000 3.652) 3.786 9.827 ( -0.947 0.000 -6.485) 6.554 10.404 ( -5.379 0.000 12.819) 13.902 10.424 ( -0.903 0.000 39.604) 39.614 11.537 ( 2.643 -0.000 -5.954) 6.515 12.487 ( -14.626 0.000 -3.874) 15.130 13.461 ( -2.094 0.000 5.929) 6.288 14.410 ( 16.519 -0.000 -21.257) 26.921 14.917 ( 8.570 -0.000 -23.017) 24.560 15.490 ( 4.430 -0.000 -9.080) 10.103 17.373 ( 4.841 -0.000 -12.022) 12.960 18.401 ( -8.971 0.000 36.674) 37.756 18.987 ( 8.514 -0.000 3.468) 9.193 19.105 ( -5.273 0.000 12.107) 13.205 21.156 ( -7.383 0.000 -53.672) 54.177 ======================= Grid point 331 (160/366) ======================= q-point: (-0.27 -0.36 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.671 ( -4.219 6.754 8.851) 11.906 0.760 ( -2.199 -0.359 5.792) 6.206 0.936 ( -16.948 1.865 -2.975) 17.308 1.367 ( -10.596 -13.088 2.195) 16.982 1.579 ( -0.669 4.813 -0.848) 4.933 1.747 ( -7.183 3.592 9.992) 12.820 1.953 ( -1.161 -10.119 -0.545) 10.200 2.129 ( -8.199 4.352 21.089) 23.041 2.676 ( -11.672 5.530 -9.158) 15.833 2.906 ( -8.410 -5.181 18.617) 21.075 3.239 ( -1.059 -18.555 20.457) 27.639 4.395 ( -7.060 -23.646 25.750) 35.665 5.603 ( 6.291 3.935 -9.589) 12.125 5.645 ( 1.165 4.114 0.206) 4.280 5.903 ( 6.914 -11.570 -7.771) 15.558 6.493 ( -1.836 9.117 14.247) 17.013 6.594 ( 3.486 8.559 -1.717) 9.400 6.900 ( 2.805 -6.645 1.497) 7.367 8.063 ( -2.643 -4.084 6.378) 8.021 8.296 ( 2.825 0.610 -0.077) 2.891 9.490 ( -1.568 15.309 4.917) 16.155 9.732 ( 0.464 5.927 -1.254) 6.076 9.884 ( 0.831 -6.625 -6.811) 9.538 10.176 ( -2.530 8.876 11.404) 14.671 10.949 ( -2.338 -20.359 19.909) 28.572 11.670 ( 6.374 -16.656 10.457) 20.674 12.393 ( -13.699 -1.580 -3.808) 14.306 13.370 ( 1.160 12.080 -3.783) 12.711 14.347 ( 16.303 11.885 -15.385) 25.373 14.733 ( 6.464 11.584 -15.292) 20.244 15.706 ( 1.916 -15.738 -4.742) 16.548 17.419 ( 3.300 -2.836 -7.721) 8.862 18.513 ( -3.838 -8.168 28.247) 29.654 19.056 ( 7.443 -0.290 4.047) 8.477 19.104 ( -2.821 -0.412 8.044) 8.534 20.735 ( -16.613 20.444 -49.994) 56.509 ======================= Grid point 332 (161/366) ======================= q-point: (-0.18 -0.36 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.548 ( -1.618 4.355 1.192) 4.796 0.787 ( -1.884 -1.819 2.027) 3.311 0.849 ( -13.050 -5.991 -0.637) 14.374 1.437 ( -0.926 3.558 -2.849) 4.651 1.591 ( -4.640 -9.543 5.856) 12.120 1.698 ( -8.218 -4.040 10.579) 13.991 2.142 ( -4.301 -5.086 8.908) 11.123 2.234 ( 2.622 -19.228 0.469) 19.412 2.491 ( -8.039 3.948 -7.815) 11.886 3.055 ( -4.187 -10.357 20.075) 22.974 3.629 ( -2.830 -19.564 24.464) 31.452 4.930 ( -2.246 -26.084 20.123) 33.020 5.460 ( -2.660 7.378 -4.548) 9.066 5.581 ( 5.073 7.504 -2.367) 9.363 6.108 ( 2.548 -4.496 5.154) 7.298 6.433 ( 3.817 -3.680 -1.121) 5.419 6.468 ( 1.592 6.053 -1.540) 6.446 7.011 ( 0.111 -3.983 2.237) 4.570 8.001 ( 1.613 8.486 -7.488) 11.432 8.409 ( -4.186 -10.502 9.435) 14.725 9.293 ( 1.945 5.682 -3.628) 7.016 9.591 ( 2.117 9.758 -5.813) 11.554 9.952 ( -0.312 4.211 2.197) 4.760 10.127 ( -0.854 -7.354 3.208) 8.069 11.089 ( -1.046 0.355 -4.463) 4.598 12.199 ( -0.474 -18.188 14.611) 23.335 12.406 ( -5.068 -16.157 9.146) 19.245 12.983 ( 7.972 29.085 -22.437) 37.589 14.189 ( 17.727 14.862 -7.689) 24.377 14.665 ( -1.002 -4.520 2.419) 5.224 15.914 ( -3.797 -6.443 6.926) 10.192 17.401 ( -1.306 5.999 4.380) 7.542 18.774 ( 3.976 -13.716 8.490) 16.613 19.103 ( 2.402 -1.056 1.916) 3.249 19.141 ( 3.904 -1.097 0.837) 4.141 20.082 ( -20.094 21.830 -33.556) 44.792 ======================= Grid point 333 (162/366) ======================= q-point: (-0.09 -0.36 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.532 ( 2.378 -3.311 -7.217) 8.289 0.816 ( -3.038 -4.264 0.477) 5.257 0.955 ( -2.588 -8.419 0.427) 8.818 1.332 ( 2.460 7.076 -6.688) 10.042 1.731 ( -3.537 -6.633 7.562) 10.662 1.852 ( -2.053 -11.736 2.780) 12.234 2.266 ( -2.440 -10.477 4.116) 11.518 2.383 ( -4.459 1.311 0.021) 4.647 2.689 ( 5.031 -26.317 1.842) 26.857 3.304 ( -1.004 -12.499 19.756) 23.399 4.035 ( -4.968 -21.042 24.595) 32.747 4.996 ( -1.923 15.409 -7.309) 17.163 5.390 ( 1.517 13.800 -1.225) 13.937 5.557 ( -2.771 -9.294 7.317) 12.149 6.210 ( -0.413 -9.895 17.850) 20.414 6.408 ( 2.194 1.846 1.599) 3.283 6.619 ( 3.152 -11.716 -11.329) 16.599 7.059 ( -2.782 -1.918 2.364) 4.124 7.836 ( 3.970 7.823 -9.392) 12.852 8.595 ( -5.562 -10.400 7.442) 13.946 9.223 ( 1.907 9.092 -4.255) 10.218 9.461 ( 7.385 -2.229 -19.862) 21.307 9.811 ( -3.814 9.650 12.022) 15.881 10.363 ( 3.354 -15.191 -2.410) 15.743 11.006 ( 1.529 6.048 -11.257) 12.870 12.216 ( 1.904 13.769 -21.854) 25.899 12.425 ( 4.408 16.224 -19.469) 25.724 12.946 ( -4.096 -25.141 27.273) 37.318 14.026 ( 15.403 13.067 0.201) 20.200 14.835 ( -6.795 -11.777 15.578) 20.678 15.921 ( -8.774 3.318 17.945) 20.249 17.214 ( -4.667 14.670 13.280) 20.331 19.026 ( 3.021 -8.733 -4.558) 10.303 19.157 ( 4.747 -1.777 -2.936) 5.858 19.163 ( 0.726 -1.113 -6.651) 6.782 19.633 ( -6.138 9.049 -17.410) 20.559 ======================= Grid point 342 (163/366) ======================= q-point: (-0.27 -0.27 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.722 ( -3.184 0.000 6.758) 7.471 0.727 ( -12.446 0.000 2.613) 12.717 0.979 ( -7.753 0.000 6.714) 10.256 1.045 ( -16.564 0.000 4.958) 17.290 1.625 ( 0.093 -0.000 -1.311) 1.314 1.766 ( -1.618 0.000 1.482) 2.194 1.861 ( -0.427 0.000 3.637) 3.662 2.272 ( -6.822 0.000 28.488) 29.293 2.733 ( -15.063 0.000 28.008) 31.802 2.757 ( -12.579 0.000 -2.086) 12.751 3.013 ( -0.465 0.000 10.896) 10.906 4.176 ( -8.341 0.000 25.466) 26.797 5.650 ( 5.543 -0.000 -6.323) 8.409 5.730 ( 10.164 -0.000 -20.541) 22.918 5.787 ( 0.324 -0.000 8.724) 8.730 6.594 ( -6.111 0.000 11.270) 12.820 6.732 ( 1.269 -0.000 -1.328) 1.837 6.840 ( 8.080 -0.000 -0.898) 8.129 8.003 ( -4.533 0.000 12.592) 13.383 8.342 ( 4.277 -0.000 -4.783) 6.416 9.674 ( -0.550 0.000 -0.613) 0.824 9.779 ( -0.810 0.000 -6.638) 6.687 9.813 ( -0.994 0.000 5.255) 5.348 10.396 ( -6.144 0.000 13.435) 14.774 10.678 ( 8.820 -0.000 35.619) 36.694 11.570 ( 4.977 -0.000 0.383) 4.991 12.282 ( -12.874 0.000 -1.665) 12.982 13.461 ( -2.440 0.000 5.466) 5.986 14.541 ( 18.039 -0.000 -16.477) 24.432 14.915 ( 9.294 -0.000 -23.545) 25.313 15.500 ( 4.063 -0.000 -9.368) 10.211 17.375 ( 4.826 -0.000 -12.064) 12.993 18.497 ( -4.675 0.000 36.318) 36.617 19.096 ( -4.144 0.000 12.230) 12.913 19.122 ( 7.318 -0.000 2.696) 7.799 20.649 ( -24.422 0.000 -60.074) 64.849 ======================= Grid point 343 (164/366) ======================= q-point: (-0.18 -0.27 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.640 ( -18.883 1.626 1.855) 19.043 0.672 ( -5.257 2.096 6.433) 8.568 0.777 ( -1.438 2.214 4.974) 5.631 1.275 ( -7.621 -15.803 9.318) 19.866 1.568 ( -0.710 5.455 0.154) 5.503 1.719 ( -5.578 5.460 11.567) 13.954 1.972 ( 1.647 -10.623 5.689) 12.163 2.145 ( -6.402 7.114 22.297) 24.264 2.477 ( -9.935 4.108 -8.733) 13.850 2.894 ( -8.172 -8.438 19.390) 22.670 3.328 ( -2.653 -20.171 21.057) 29.280 4.450 ( -5.581 -26.499 27.566) 38.642 5.612 ( 3.930 9.732 -10.340) 14.733 5.676 ( 3.601 0.657 -3.311) 4.935 5.950 ( 5.336 -10.831 -5.949) 13.460 6.511 ( -5.395 5.762 10.390) 13.049 6.617 ( 1.960 9.170 -4.122) 10.243 6.954 ( 4.580 -4.326 0.124) 6.301 8.046 ( -4.230 -2.426 4.850) 6.877 8.325 ( 1.524 1.203 -0.281) 1.962 9.493 ( -1.735 14.852 4.665) 15.664 9.735 ( 0.544 5.686 -0.412) 5.727 9.863 ( 1.254 -7.507 -6.484) 9.999 10.196 ( -3.833 10.445 11.992) 16.358 11.036 ( 4.421 -8.108 7.131) 11.668 11.859 ( 9.681 -24.673 18.429) 32.281 12.217 ( -9.903 -2.387 -0.598) 10.204 13.361 ( 0.746 12.439 -4.507) 13.251 14.509 ( 17.412 10.679 -10.327) 22.889 14.747 ( 7.919 11.375 -15.732) 20.966 15.703 ( 1.230 -15.152 -5.391) 16.130 17.422 ( 3.237 -2.977 -7.652) 8.826 18.640 ( 2.148 -7.417 26.541) 27.642 19.097 ( -3.484 -0.195 9.267) 9.902 19.177 ( 6.276 0.117 1.492) 6.452 20.143 ( -32.229 14.676 -47.808) 59.496 ======================= Grid point 344 (165/366) ======================= q-point: (-0.09 -0.27 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.540 ( -0.652 3.350 1.980) 3.946 0.684 ( -7.312 -7.565 2.008) 10.712 0.811 ( -0.109 -4.731 3.856) 6.104 1.407 ( -2.275 0.193 0.465) 2.330 1.566 ( -3.538 -7.809 6.092) 10.517 1.669 ( -5.226 -4.519 12.311) 14.117 2.134 ( -3.634 -4.607 8.045) 9.957 2.305 ( 5.001 -18.998 6.701) 20.757 2.385 ( -3.364 -0.097 -1.655) 3.750 3.098 ( -5.209 -13.299 19.823) 24.432 3.698 ( -5.597 -19.083 22.534) 30.054 5.013 ( -0.588 -23.275 18.026) 29.445 5.399 ( -2.640 8.477 -4.905) 10.143 5.619 ( 2.993 8.007 -4.258) 9.550 6.136 ( -1.678 -6.132 2.573) 6.859 6.455 ( -0.336 -1.449 1.073) 1.834 6.488 ( 3.222 3.371 -4.137) 6.234 7.029 ( 1.337 -1.660 0.900) 2.314 7.977 ( 0.692 6.988 -7.077) 9.970 8.395 ( -4.586 -8.343 7.624) 12.197 9.297 ( 1.476 5.345 -3.636) 6.631 9.593 ( 2.611 10.436 -5.869) 12.255 9.955 ( -1.326 3.581 3.297) 5.045 10.130 ( -1.278 -8.407 3.341) 9.136 11.077 ( 3.420 2.955 -6.239) 7.704 12.156 ( -4.700 -2.906 -1.010) 5.617 12.516 ( 2.138 -26.848 21.782) 34.639 12.969 ( 8.055 29.105 -23.318) 38.154 14.390 ( 15.926 14.268 -6.142) 22.247 14.666 ( -0.646 -3.517 1.921) 4.059 15.895 ( -4.327 -6.128 6.434) 9.882 17.407 ( -1.254 5.881 4.300) 7.392 18.885 ( 6.932 -9.343 6.959) 13.556 19.114 ( -0.334 -1.588 0.308) 1.652 19.183 ( -0.738 1.733 -1.984) 2.736 19.651 ( -17.536 6.769 -22.218) 29.103 ======================= Grid point 354 (166/366) ======================= q-point: (-0.18 -0.18 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.455 ( -21.557 0.000 -0.356) 21.560 0.725 ( -2.053 0.000 8.189) 8.442 0.915 ( -7.593 0.000 8.447) 11.358 1.003 ( -2.798 0.000 17.640) 17.860 1.622 ( 0.369 -0.000 -1.240) 1.294 1.762 ( -0.326 0.000 1.301) 1.341 1.909 ( 2.124 -0.000 9.555) 9.788 2.337 ( -0.903 0.000 14.453) 14.481 2.583 ( -11.983 0.000 3.583) 12.507 2.691 ( -13.319 0.000 28.805) 31.735 3.066 ( -5.579 0.000 21.832) 22.534 4.214 ( -7.313 0.000 29.020) 29.927 5.674 ( 3.664 -0.000 -7.986) 8.787 5.762 ( 10.764 -0.000 -21.262) 23.832 5.837 ( 0.594 -0.000 8.037) 8.059 6.533 ( -9.426 0.000 6.249) 11.309 6.716 ( -1.137 0.000 -4.767) 4.901 6.945 ( 7.710 -0.000 -1.885) 7.938 7.994 ( -5.917 0.000 10.560) 12.105 8.361 ( 1.963 -0.000 -3.988) 4.445 9.665 ( -0.487 0.000 -0.235) 0.540 9.741 ( 0.378 -0.000 -6.249) 6.260 9.827 ( -1.109 0.000 5.455) 5.567 10.381 ( -6.626 0.000 13.909) 15.406 10.989 ( 14.832 -0.000 15.778) 21.655 11.684 ( 7.663 -0.000 9.160) 11.943 12.145 ( -7.080 0.000 2.084) 7.380 13.451 ( -2.966 0.000 4.526) 5.412 14.723 ( 19.674 -0.000 -12.162) 23.130 14.919 ( 9.814 -0.000 -23.786) 25.731 15.490 ( 1.519 -0.000 -10.463) 10.572 17.376 ( 4.795 -0.000 -12.094) 13.010 18.689 ( 8.032 -0.000 32.935) 33.901 19.097 ( -4.815 0.000 12.572) 13.462 19.225 ( 5.553 -0.000 1.119) 5.664 19.883 ( -44.231 0.000 -48.816) 65.874 ======================= Grid point 355 (167/366) ======================= q-point: (-0.09 -0.18 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.449 ( -6.169 -8.992 9.243) 14.294 0.682 ( -2.369 6.296 10.822) 12.743 0.789 ( -0.939 1.306 4.582) 4.856 1.254 ( -4.557 -13.723 12.867) 19.356 1.563 ( -0.376 5.520 0.679) 5.574 1.711 ( -4.719 6.167 11.070) 13.522 2.042 ( 1.516 -8.588 10.760) 13.850 2.187 ( -4.162 8.151 19.491) 21.533 2.363 ( -1.029 -0.384 -0.269) 1.131 2.892 ( -7.344 -10.300 19.851) 23.539 3.370 ( -7.595 -20.339 19.997) 29.517 4.527 ( -5.820 -28.119 29.500) 41.168 5.612 ( 4.575 12.830 -10.698) 17.320 5.693 ( 2.964 -0.099 -7.308) 7.887 5.977 ( 1.964 -8.446 -3.335) 9.291 6.463 ( -7.358 1.594 5.151) 9.122 6.599 ( -0.369 7.912 -6.535) 10.269 7.014 ( 4.084 -2.168 -1.260) 4.792 8.004 ( -5.190 -1.341 3.787) 6.563 8.332 ( -0.385 1.462 0.030) 1.512 9.492 ( -2.088 14.653 4.542) 15.483 9.743 ( 0.945 4.745 -0.346) 4.851 9.850 ( 1.786 -7.177 -6.270) 9.695 10.198 ( -5.283 10.933 12.253) 17.250 11.133 ( 7.946 0.438 -2.450) 8.327 12.061 ( 5.403 -20.354 11.985) 24.231 12.137 ( -3.650 -7.679 4.908) 9.817 13.345 ( 0.765 12.388 -5.105) 13.421 14.661 ( 11.702 11.649 -11.616) 20.188 14.786 ( 9.393 10.867 -16.025) 21.520 15.673 ( -1.220 -15.571 -6.118) 16.774 17.425 ( 3.156 -3.134 -7.697) 8.889 18.881 ( 16.244 -2.647 19.334) 25.391 19.098 ( -3.751 -0.084 8.597) 9.381 19.198 ( -8.915 4.468 -4.686) 11.018 19.500 ( -24.104 -2.041 -18.548) 30.483 ======================= Grid point 366 (168/366) ======================= q-point: (-0.09 -0.09 0.18) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.386 ( 8.587 -0.000 16.673) 18.754 0.753 ( -0.046 0.000 7.490) 7.490 0.871 ( -6.321 0.000 10.999) 12.686 1.079 ( -0.965 0.000 17.441) 17.468 1.622 ( 0.457 -0.000 -1.132) 1.220 1.759 ( -1.094 0.000 0.612) 1.254 2.008 ( 3.421 -0.000 12.749) 13.200 2.347 ( -2.600 0.000 -1.096) 2.821 2.568 ( 1.599 -0.000 19.663) 19.728 2.683 ( -10.577 0.000 29.492) 31.332 3.072 ( -12.084 0.000 25.047) 27.809 4.279 ( -7.457 0.000 32.488) 33.333 5.666 ( 2.096 -0.000 -9.497) 9.725 5.789 ( 9.861 -0.000 -21.718) 23.852 5.884 ( 0.038 -0.000 7.317) 7.317 6.421 ( -10.363 0.000 3.541) 10.952 6.655 ( -3.011 0.000 -7.410) 7.998 7.008 ( 3.633 -0.000 -3.991) 5.397 7.957 ( -6.892 0.000 8.375) 10.846 8.354 ( -0.379 0.000 -2.730) 2.757 9.659 ( -0.539 0.000 0.531) 0.757 9.728 ( 2.285 -0.000 -5.498) 5.954 9.839 ( -1.034 0.000 4.334) 4.456 10.366 ( -6.610 0.000 14.013) 15.493 11.196 ( 10.923 -0.000 -2.642) 11.238 11.776 ( -5.240 0.000 6.560) 8.396 12.123 ( 0.522 -0.000 6.066) 6.088 13.433 ( -2.790 0.000 4.108) 4.966 14.862 ( 8.081 -0.000 -19.037) 20.681 14.927 ( 10.008 -0.000 -23.696) 25.723 15.419 ( -2.629 0.000 -9.897) 10.240 17.376 ( 4.765 -0.000 -12.111) 13.014 18.975 ( -15.166 0.000 -6.886) 16.656 19.100 ( -4.605 0.000 12.699) 13.508 19.258 ( 11.204 -0.000 17.696) 20.945 19.274 ( 1.341 -0.000 -0.451) 1.415 ======================= Grid point 367 (169/366) ======================= q-point: ( 0.00 0.00 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.850 ( -1.648 0.000 3.640) 3.995 0.860 ( 11.367 -0.000 6.584) 13.136 1.112 ( -2.253 0.000 10.605) 10.842 1.366 ( -0.304 0.000 7.949) 7.954 1.601 ( 1.449 -0.000 -1.385) 2.004 1.753 ( 1.488 -0.000 -1.578) 2.168 2.319 ( -1.022 0.000 6.763) 6.840 2.517 ( 13.859 -0.000 3.420) 14.275 2.984 ( -3.516 0.000 17.056) 17.414 3.301 ( -8.155 0.000 30.063) 31.149 3.452 ( -14.291 0.000 21.180) 25.550 5.052 ( -15.316 0.000 38.197) 41.154 5.344 ( 6.890 -0.000 -21.641) 22.711 5.440 ( 4.383 -0.000 -12.687) 13.423 5.989 ( -2.229 0.000 -0.398) 2.264 6.389 ( -1.175 0.000 -8.750) 8.829 6.441 ( -5.574 0.000 10.435) 11.830 6.982 ( -3.860 0.000 5.222) 6.494 7.908 ( -2.350 0.000 -5.638) 6.108 8.432 ( -7.024 0.000 11.058) 13.100 9.495 ( 6.884 -0.000 -15.967) 17.388 9.632 ( 5.837 -0.000 -6.929) 9.060 10.005 ( -6.680 0.000 12.574) 14.238 10.719 ( -10.270 0.000 23.386) 25.541 11.163 ( 7.969 -0.000 -6.650) 10.379 11.791 ( -21.838 0.000 13.864) 25.867 12.402 ( 7.510 -0.000 10.235) 12.695 13.403 ( 2.673 -0.000 -8.304) 8.724 14.196 ( -9.497 0.000 -25.449) 27.163 14.438 ( 12.921 -0.000 -28.056) 30.889 15.311 ( -0.382 0.000 1.717) 1.760 17.093 ( 6.757 -0.000 -17.284) 18.558 18.933 ( -5.450 0.000 15.044) 16.000 19.218 ( -5.526 0.000 -1.036) 5.622 19.360 ( -3.916 0.000 12.232) 12.844 19.877 ( 31.280 -0.000 -4.771) 31.642 ======================= Grid point 368 (170/366) ======================= q-point: ( 0.09 0.00 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.844 ( -0.684 0.593 3.572) 3.685 0.890 ( -0.838 8.617 7.181) 11.248 1.038 ( 7.674 2.228 6.164) 10.092 1.471 ( 0.686 -0.021 1.690) 1.824 1.583 ( 0.333 -3.538 2.096) 4.126 1.819 ( 2.169 -4.951 -0.123) 5.407 2.409 ( -2.700 -9.382 3.381) 10.332 2.588 ( 11.983 4.114 8.920) 15.495 2.872 ( -3.510 8.767 18.228) 20.529 3.341 ( -7.759 -3.941 21.939) 23.603 3.635 ( -13.005 -17.824 20.763) 30.297 5.123 ( -9.788 -7.190 15.346) 19.570 5.347 ( 9.904 2.470 -15.741) 18.761 5.460 ( -5.277 -4.282 -0.267) 6.801 5.962 ( -3.785 -2.395 -2.155) 4.971 6.356 ( -1.725 0.412 -1.626) 2.405 6.416 ( -4.331 2.693 10.856) 11.995 6.998 ( -3.703 -3.029 4.478) 6.552 7.857 ( 0.309 2.727 -7.240) 7.743 8.459 ( -6.651 -5.394 12.777) 15.381 9.436 ( 5.603 7.177 -12.590) 15.537 9.720 ( 4.122 -4.928 -6.788) 9.346 9.815 ( -4.950 16.936 9.456) 20.019 10.456 ( -9.859 14.560 17.739) 24.977 11.175 ( 9.873 4.447 -8.069) 13.505 12.130 ( -23.873 -38.393 21.024) 49.859 12.457 ( 9.587 2.760 8.033) 12.808 13.082 ( 9.039 30.760 -21.160) 38.414 13.990 ( -9.080 7.901 -23.901) 26.761 14.568 ( 3.409 -11.610 -5.508) 13.294 15.535 ( 2.451 -20.603 -3.425) 21.029 17.184 ( 6.142 -8.889 -16.415) 19.652 18.918 ( -7.197 1.701 16.465) 18.050 19.166 ( -6.463 0.657 -1.305) 6.626 19.313 ( -3.168 5.623 10.018) 11.917 19.985 ( 31.775 9.699 -10.853) 34.950 ======================= Grid point 369 (171/366) ======================= q-point: ( 0.18 0.00 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.679 ( -1.788 11.790 6.393) 13.530 0.853 ( -0.623 -0.627 3.016) 3.143 1.118 ( 8.111 -1.311 2.690) 8.645 1.366 ( 2.466 8.639 -5.149) 10.355 1.716 ( -2.561 -7.181 2.843) 8.137 1.935 ( 2.607 -5.559 2.467) 6.617 2.580 ( 7.196 4.787 10.628) 13.699 2.615 ( -5.515 -12.937 8.497) 16.431 2.817 ( -0.528 -0.618 4.843) 4.911 3.425 ( -11.259 -6.382 16.947) 21.324 3.959 ( -12.759 -21.718 19.989) 32.156 5.143 ( 1.818 6.649 -10.902) 12.898 5.258 ( 11.086 10.360 -12.152) 19.439 5.547 ( -10.006 -12.252 15.093) 21.864 6.054 ( -8.321 -7.559 6.777) 13.127 6.346 ( -4.013 2.814 8.638) 9.932 6.387 ( -4.332 -7.578 0.516) 8.744 7.055 ( -1.947 -3.935 4.351) 6.181 7.782 ( 3.371 4.482 -9.312) 10.871 8.614 ( -4.009 -11.193 15.491) 19.528 9.233 ( 0.574 14.503 -2.587) 14.743 9.448 ( 2.000 16.210 -6.361) 17.528 9.891 ( 1.382 -8.758 -6.069) 10.745 10.273 ( -7.079 5.106 12.672) 15.387 11.076 ( 10.928 11.610 -13.069) 20.616 12.346 ( 13.522 27.892 -20.324) 37.066 12.575 ( 8.953 12.124 -2.059) 15.211 12.774 ( -18.840 -38.536 24.102) 49.203 13.702 ( -10.237 9.351 -18.830) 23.384 14.846 ( -4.024 -18.220 12.439) 22.425 15.929 ( 2.422 -19.509 -0.867) 19.678 17.340 ( 3.502 -6.914 -10.570) 13.107 18.870 ( -5.988 1.967 9.040) 11.021 19.105 ( -6.833 1.090 -0.294) 6.926 19.187 ( -0.838 7.916 2.564) 8.363 19.906 ( 25.376 16.466 -11.665) 32.421 ======================= Grid point 370 (172/366) ======================= q-point: ( 0.27 0.00 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.524 ( 1.162 5.387 0.672) 5.552 0.878 ( -0.396 -1.746 2.051) 2.722 1.182 ( 5.908 2.487 -1.075) 6.500 1.198 ( 3.932 8.053 -6.375) 10.998 1.790 ( -4.963 -3.491 1.564) 6.266 2.051 ( 2.084 -4.313 3.126) 5.720 2.567 ( 2.694 3.219 14.236) 14.842 2.781 ( -3.409 -2.930 7.199) 8.488 2.946 ( -5.058 -18.410 -10.066) 21.584 3.528 ( -12.533 -10.888 12.739) 20.926 4.328 ( -12.305 -21.519 20.130) 31.933 4.866 ( 3.584 18.558 -14.740) 23.969 5.112 ( 11.031 13.637 -0.585) 17.549 5.783 ( -4.918 -11.002 15.990) 20.022 6.092 ( -7.369 -3.279 6.749) 10.517 6.333 ( -2.828 -3.866 4.412) 6.512 6.598 ( -7.507 -17.487 -2.146) 19.151 7.128 ( 0.497 -2.631 7.977) 8.414 7.701 ( 3.710 3.886 -10.359) 11.669 8.816 ( -0.903 -4.037 11.775) 12.480 9.035 ( 3.272 3.936 -11.164) 12.281 9.197 ( 3.087 10.443 -3.283) 11.374 9.953 ( -5.320 1.708 2.851) 6.273 10.269 ( -2.162 -7.000 1.458) 7.469 10.809 ( 13.150 22.364 -25.471) 36.358 11.772 ( 13.674 30.440 -25.974) 42.287 12.588 ( 10.347 0.259 3.832) 11.037 13.208 ( -1.413 0.367 -4.879) 5.092 13.627 ( -25.929 -29.144 20.736) 44.178 15.212 ( -7.386 -20.925 21.266) 30.735 16.207 ( -0.717 -8.820 9.462) 12.955 17.369 ( -1.288 4.083 1.785) 4.639 18.836 ( -1.154 -0.794 -5.820) 5.986 19.016 ( -0.969 4.848 -4.213) 6.495 19.079 ( -2.636 2.006 -4.375) 5.488 19.704 ( 17.216 17.955 -9.239) 26.535 ======================= Grid point 371 (173/366) ======================= q-point: ( 0.36 0.00 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.520 ( 4.056 -3.491 -6.718) 8.589 0.917 ( -0.307 -2.276 0.155) 2.302 0.994 ( 3.614 11.230 -9.942) 15.428 1.200 ( 5.189 2.903 -1.477) 6.127 1.815 ( -5.285 -3.385 4.131) 7.514 2.124 ( 0.760 -1.535 4.270) 4.600 2.545 ( -7.783 2.184 8.812) 11.958 2.797 ( 1.118 -0.888 4.495) 4.717 3.283 ( -4.409 -24.700 -12.664) 28.106 3.736 ( -9.725 -17.303 6.724) 20.957 4.459 ( 1.438 17.447 -2.612) 17.700 4.598 ( 2.063 6.649 6.432) 9.478 5.000 ( -3.158 -3.807 11.984) 12.964 5.843 ( -4.478 6.416 22.382) 23.711 6.167 ( -0.947 -6.771 1.916) 7.100 6.491 ( 1.463 -11.897 -7.777) 14.288 6.851 ( -10.202 -17.815 -1.393) 20.576 7.187 ( 2.757 0.676 12.941) 13.248 7.666 ( 3.127 -1.772 -9.954) 10.583 8.643 ( 2.961 21.418 -6.598) 22.606 9.033 ( 8.194 -6.252 -20.844) 23.253 9.287 ( -1.073 -12.096 14.247) 18.720 9.823 ( -7.528 8.003 7.547) 13.330 10.326 ( 14.825 28.913 -36.271) 48.697 10.446 ( -0.165 -10.872 -7.600) 13.266 11.366 ( 10.316 18.884 -14.580) 25.992 12.690 ( 10.706 -2.952 -0.130) 11.107 12.987 ( -1.215 12.544 -14.896) 19.512 14.235 ( -23.514 -40.398 37.639) 60.013 15.547 ( -10.022 -12.174 29.902) 33.805 16.309 ( -3.955 -3.220 17.654) 18.376 17.185 ( -5.539 15.417 12.648) 20.696 18.849 ( 3.215 -2.923 -19.730) 20.203 18.945 ( 6.387 1.369 -15.560) 16.875 19.032 ( -3.389 -0.029 -4.308) 5.481 19.478 ( 10.306 14.555 -5.303) 18.606 ======================= Grid point 372 (174/366) ======================= q-point: ( 0.45 0.00 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.643 ( 4.860 -8.650 -10.197) 14.227 0.779 ( 4.412 11.480 -11.717) 16.986 0.968 ( -0.144 -2.556 -0.821) 2.689 1.148 ( 2.821 4.934 -2.427) 6.180 1.878 ( -3.638 -4.929 6.970) 9.279 2.142 ( -0.068 1.005 5.741) 5.829 2.441 ( -13.245 1.592 1.481) 13.422 2.867 ( 6.812 -0.414 8.609) 10.986 3.681 ( -3.808 -26.240 -15.180) 30.553 4.012 ( -4.161 -12.106 -1.787) 12.925 4.099 ( 5.749 17.135 -4.602) 18.650 4.371 ( 2.448 18.197 14.408) 23.339 5.246 ( -11.328 -18.905 16.284) 27.402 5.662 ( -5.334 15.758 23.022) 28.404 6.299 ( 2.314 -5.921 -0.454) 6.373 6.623 ( 1.828 -4.023 -13.194) 13.914 7.070 ( -9.709 -11.702 -0.062) 15.205 7.209 ( 5.365 2.762 14.022) 15.265 7.809 ( 3.405 -14.971 -7.492) 17.084 8.191 ( 2.448 26.848 -7.047) 27.865 9.264 ( 10.560 -17.351 -25.659) 32.726 9.537 ( -1.339 -11.787 10.850) 16.076 9.630 ( -5.603 9.339 2.707) 11.222 9.817 ( 14.310 24.928 -34.229) 44.697 10.642 ( -0.729 -12.347 -7.539) 14.486 11.105 ( 7.974 14.486 -9.636) 19.138 12.710 ( -1.626 11.001 -12.017) 16.373 12.847 ( 9.234 -5.698 -4.543) 11.763 14.878 ( -20.393 -35.134 39.353) 56.559 15.536 ( -11.931 15.458 39.148) 43.747 16.502 ( -5.626 -17.297 18.030) 25.611 16.839 ( -7.414 21.535 16.775) 28.287 18.852 ( 5.418 -1.051 -25.419) 26.011 18.976 ( 12.087 -2.331 -24.652) 27.555 19.010 ( -3.154 -1.122 -2.761) 4.339 19.318 ( 5.740 7.717 -1.752) 9.776 ======================= Grid point 373 (175/366) ======================= q-point: (-0.45 0.00 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.583 ( 4.881 9.937 -11.821) 16.196 0.822 ( 4.528 -10.390 -10.514) 15.460 0.986 ( 0.245 1.670 -0.922) 1.923 1.076 ( 0.430 2.403 -1.655) 2.949 1.952 ( -2.853 -2.912 6.780) 7.911 2.128 ( 0.758 2.383 6.078) 6.572 2.340 ( -10.856 0.652 -1.520) 10.981 2.886 ( 6.462 7.147 10.411) 14.185 3.699 ( 10.209 24.430 -2.511) 26.596 4.040 ( -2.832 3.192 8.866) 9.839 4.105 ( -0.974 -15.448 -5.965) 16.588 4.399 ( -2.453 -18.832 -4.077) 19.424 5.344 ( -6.417 20.222 19.674) 28.934 5.536 ( -10.774 -15.358 16.603) 25.052 6.368 ( 0.398 -0.679 -2.738) 2.849 6.623 ( 3.024 1.215 -13.015) 13.417 7.100 ( -5.582 0.261 2.174) 5.996 7.238 ( 3.234 5.145 16.309) 17.405 7.754 ( 2.791 18.268 -7.267) 19.857 8.176 ( 3.576 -23.120 -7.366) 24.528 9.333 ( -1.838 11.782 -8.839) 14.843 9.395 ( 7.554 14.753 -16.750) 23.564 9.736 ( 4.519 -15.280 -4.170) 16.471 9.814 ( 6.339 -20.017 -16.617) 26.777 10.794 ( 4.570 2.440 -6.761) 8.518 10.927 ( 2.556 -1.555 -10.480) 10.898 12.477 ( -2.494 9.445 -9.013) 13.291 13.030 ( 7.892 -9.225 -7.076) 14.052 15.133 ( -12.358 27.592 40.279) 50.363 15.386 ( -16.595 -20.164 37.307) 45.539 16.446 ( -7.355 19.655 16.046) 26.418 16.869 ( -6.236 -20.654 17.589) 27.836 18.847 ( 7.424 -1.264 -24.332) 25.471 18.988 ( 4.993 0.774 -12.255) 13.256 19.036 ( 3.670 -2.156 -14.389) 15.006 19.279 ( 4.430 0.034 -2.568) 5.121 ======================= Grid point 374 (176/366) ======================= q-point: (-0.36 0.00 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.448 ( 3.880 4.449 -8.288) 10.176 0.911 ( -0.719 4.808 0.782) 4.924 1.012 ( 3.923 -9.821 -8.910) 13.829 1.055 ( 0.250 0.923 -0.609) 1.134 1.958 ( -2.327 2.366 5.468) 6.396 2.077 ( -1.175 5.592 5.388) 7.853 2.271 ( -4.573 0.481 -1.367) 4.797 2.771 ( 3.146 10.904 14.211) 18.187 3.315 ( 8.598 25.351 4.321) 27.116 3.896 ( -3.747 9.272 17.206) 19.901 4.454 ( -0.299 -20.038 -8.445) 21.747 4.739 ( -0.818 -19.619 -7.489) 21.016 4.957 ( -5.312 21.280 12.510) 25.250 5.736 ( -9.119 -8.934 13.481) 18.566 6.331 ( -2.041 2.415 -3.231) 4.521 6.546 ( 2.450 6.199 -10.681) 12.590 7.040 ( 3.350 10.195 10.564) 15.058 7.100 ( -7.560 6.863 11.578) 15.437 7.615 ( 5.620 0.348 -6.912) 8.915 8.568 ( 3.317 -17.289 -6.200) 18.664 9.112 ( 5.170 6.525 -20.108) 21.763 9.184 ( -3.588 7.935 4.208) 9.671 9.944 ( -4.497 -8.603 15.601) 18.375 10.288 ( 13.634 -26.913 -35.479) 46.572 10.586 ( 4.057 15.184 -5.876) 16.779 11.163 ( 5.563 -20.401 -16.854) 27.041 12.307 ( -1.537 5.639 -4.239) 7.220 13.224 ( 5.061 -8.452 -7.586) 12.434 14.633 ( -10.514 28.066 34.164) 45.447 15.495 ( -12.075 8.949 29.357) 32.980 16.216 ( -6.555 4.190 13.955) 15.977 17.202 ( -4.786 -15.102 13.061) 20.532 18.880 ( 6.593 -3.608 -18.300) 19.783 18.980 ( 4.111 0.470 -6.170) 7.429 19.041 ( 1.611 -0.812 -12.375) 12.505 19.332 ( 3.886 -3.106 -5.310) 7.276 ======================= Grid point 375 (177/366) ======================= q-point: (-0.27 0.00 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.467 ( 0.920 -6.049 0.508) 6.140 0.833 ( -0.655 3.642 3.025) 4.780 1.002 ( 1.014 4.661 2.360) 5.322 1.196 ( 2.944 -9.592 -7.406) 12.471 1.869 ( -2.208 7.185 6.948) 10.235 1.955 ( -2.323 6.998 5.001) 8.909 2.255 ( 0.075 -0.230 2.547) 2.559 2.664 ( -0.561 6.287 18.055) 19.127 2.941 ( 5.931 23.121 8.376) 25.296 3.719 ( -6.753 11.866 17.911) 22.521 4.507 ( -9.407 23.320 20.006) 32.134 4.778 ( 5.304 -16.460 -9.229) 19.602 5.096 ( 2.062 -18.515 -19.926) 27.279 5.768 ( -5.862 3.907 10.710) 12.819 6.259 ( -3.476 3.157 0.872) 4.776 6.423 ( -0.923 3.953 -4.231) 5.863 6.803 ( -4.647 15.935 16.208) 23.199 7.061 ( -0.533 0.228 2.161) 2.238 7.683 ( 4.702 -5.111 -8.085) 10.658 8.695 ( -2.730 3.312 7.081) 8.281 9.083 ( 4.157 -3.858 -12.279) 13.525 9.200 ( -0.470 -12.082 -3.231) 12.515 10.058 ( -3.225 -1.131 8.596) 9.251 10.340 ( -0.863 9.623 0.900) 9.704 10.688 ( 9.484 -16.719 -21.696) 28.986 11.643 ( 12.055 -32.261 -27.991) 44.380 12.248 ( 1.065 -0.435 0.020) 1.151 13.274 ( -0.927 7.208 3.470) 8.053 14.256 ( -7.036 11.236 12.423) 18.169 15.188 ( -7.937 20.764 20.344) 30.134 16.142 ( -3.406 7.266 7.048) 10.681 17.382 ( -0.797 -4.132 2.394) 4.841 18.954 ( -1.043 -3.580 -6.596) 7.577 19.001 ( 4.451 -2.248 -1.599) 5.237 19.058 ( 2.749 -3.949 -7.161) 8.628 19.398 ( 2.771 -3.051 -4.121) 5.829 ======================= Grid point 376 (178/366) ======================= q-point: (-0.18 0.00 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.650 ( -1.126 -11.919 6.771) 13.754 0.793 ( 2.069 2.300 5.240) 6.085 0.927 ( 1.557 4.992 4.520) 6.912 1.357 ( 1.809 -8.184 -4.373) 9.454 1.716 ( -2.538 9.917 7.897) 12.929 1.859 ( -0.210 4.172 4.000) 5.784 2.301 ( 3.147 -2.491 6.432) 7.582 2.595 ( -2.249 12.615 15.897) 20.418 2.676 ( 2.439 4.656 16.455) 17.274 3.495 ( -8.258 11.836 19.713) 24.432 4.084 ( -10.143 21.503 18.126) 29.897 5.073 ( 9.312 -13.734 -13.526) 21.408 5.275 ( 0.727 -2.310 -12.578) 12.809 5.641 ( -6.743 5.410 12.242) 14.986 6.132 ( -1.221 10.377 2.534) 10.752 6.393 ( -3.058 -1.581 1.606) 3.799 6.555 ( -9.339 7.548 6.748) 13.774 7.054 ( 0.229 1.571 2.040) 2.585 7.800 ( 2.409 -7.227 -8.856) 11.682 8.581 ( -5.087 7.071 13.121) 15.749 9.244 ( 1.870 -12.422 -5.684) 13.789 9.469 ( 0.000 -18.172 -2.117) 18.295 9.914 ( 1.811 12.941 -5.960) 14.362 10.330 ( -7.430 -6.239 14.979) 17.847 10.930 ( 8.639 -9.242 -12.016) 17.448 12.152 ( 7.291 -12.471 -5.084) 15.315 12.455 ( 10.027 -28.628 -20.781) 36.769 12.932 ( -8.595 28.080 16.694) 33.779 14.204 ( -6.036 -7.175 -14.114) 16.945 14.827 ( -3.979 18.542 11.330) 22.091 15.902 ( 0.193 18.518 -1.902) 18.616 17.350 ( 3.866 6.969 -10.003) 12.790 18.939 ( -3.972 0.086 0.373) 3.991 19.129 ( 3.383 -6.379 3.489) 8.020 19.175 ( 0.423 -7.276 2.258) 7.630 19.471 ( 6.167 -3.417 -0.040) 7.051 ======================= Grid point 377 (179/366) ======================= q-point: (-0.09 0.00 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.779 ( 7.810 1.127 6.961) 10.522 0.860 ( -0.965 -0.302 4.995) 5.097 0.941 ( -0.038 -10.158 9.240) 13.732 1.456 ( -0.525 1.898 3.608) 4.111 1.567 ( 0.276 2.867 2.290) 3.680 1.797 ( 0.997 3.975 0.179) 4.102 2.391 ( 0.807 9.250 8.673) 12.706 2.406 ( 8.311 -1.658 6.025) 10.398 2.807 ( -4.208 -10.612 24.553) 27.077 3.326 ( -8.023 6.282 23.324) 25.453 3.703 ( -12.119 17.787 18.900) 28.644 5.153 ( -7.423 9.614 18.962) 22.518 5.295 ( 10.639 -7.142 -18.733) 22.696 5.524 ( -3.920 7.219 0.060) 8.215 5.994 ( 0.313 2.068 -1.070) 2.349 6.403 ( -2.532 -1.573 -4.684) 5.552 6.460 ( -9.140 -0.405 7.019) 11.531 7.016 ( -1.783 2.437 3.179) 4.384 7.898 ( -0.713 -4.556 -7.121) 8.484 8.478 ( -6.055 3.705 12.681) 14.533 9.428 ( 5.543 -6.891 -12.883) 15.626 9.703 ( 3.906 8.716 -7.679) 12.256 9.833 ( -5.648 -19.177 11.227) 22.928 10.492 ( -9.713 -14.493 18.556) 25.470 11.087 ( 9.401 -4.501 -8.394) 13.382 12.298 ( -5.143 22.058 11.554) 25.426 12.307 ( -3.650 9.763 12.435) 16.226 13.077 ( 8.096 -31.619 -21.160) 38.897 14.250 ( -8.710 -7.334 -23.990) 26.556 14.552 ( 3.555 12.155 -6.519) 14.244 15.527 ( 1.103 20.235 -3.378) 20.545 17.187 ( 6.264 9.108 -16.328) 19.718 18.926 ( -4.067 -0.456 8.229) 9.191 19.227 ( -1.938 -2.564 0.592) 3.268 19.303 ( -3.021 -5.472 9.631) 11.481 19.642 ( 20.297 -5.183 2.332) 21.078 ======================= Grid point 379 (180/366) ======================= q-point: ( 0.09 0.09 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.846 ( -1.474 0.000 3.102) 3.434 1.000 ( 4.709 -0.000 5.446) 7.200 1.142 ( -1.264 0.000 9.202) 9.289 1.416 ( 3.163 -0.000 4.183) 5.245 1.617 ( 1.673 -0.000 -0.680) 1.806 1.769 ( 2.232 -0.000 -2.438) 3.305 2.305 ( -3.450 0.000 -0.852) 3.554 2.741 ( 15.278 -0.000 5.697) 16.306 3.003 ( -6.738 0.000 14.104) 15.631 3.357 ( -7.260 0.000 29.984) 30.850 3.382 ( -11.758 0.000 20.542) 23.669 5.009 ( -18.905 0.000 34.231) 39.104 5.318 ( 5.520 -0.000 -19.267) 20.042 5.434 ( 4.527 -0.000 -12.718) 13.500 5.924 ( -5.764 0.000 -2.449) 6.263 6.348 ( 0.566 -0.000 -4.718) 4.752 6.470 ( -0.882 0.000 14.826) 14.852 6.951 ( -5.349 0.000 7.597) 9.291 7.857 ( -0.589 0.000 -6.042) 6.071 8.389 ( -7.806 0.000 10.904) 13.410 9.505 ( 7.037 -0.000 -16.058) 17.532 9.680 ( 6.377 -0.000 -6.629) 9.198 9.980 ( -6.291 0.000 11.176) 12.825 10.708 ( -9.542 0.000 23.415) 25.285 11.215 ( 1.209 -0.000 0.416) 1.279 11.556 ( -21.766 0.000 13.958) 25.857 12.570 ( 9.354 -0.000 9.075) 13.032 13.400 ( 3.639 -0.000 -9.108) 9.808 13.962 ( -5.162 0.000 -23.693) 24.249 14.465 ( 12.500 -0.000 -26.687) 29.469 15.320 ( 0.357 -0.000 1.128) 1.183 17.093 ( 6.724 -0.000 -17.276) 18.539 18.934 ( -8.951 0.000 21.765) 23.534 19.115 ( -8.232 0.000 -2.002) 8.472 19.371 ( -4.123 0.000 12.407) 13.074 20.273 ( 35.109 -0.000 -19.039) 39.939 ======================= Grid point 380 (181/366) ======================= q-point: ( 0.18 0.09 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.847 ( -1.146 -0.239 3.068) 3.284 0.902 ( -2.858 11.698 8.094) 14.509 1.169 ( 7.132 -0.684 4.392) 8.404 1.492 ( 2.002 2.061 -0.793) 2.981 1.594 ( 0.320 -2.682 0.086) 2.702 1.849 ( 2.418 -5.996 -0.557) 6.489 2.355 ( -4.712 -9.071 -4.419) 11.136 2.799 ( 8.436 6.556 16.336) 19.519 2.895 ( -3.406 6.149 8.987) 11.410 3.342 ( -8.044 -0.915 18.507) 20.200 3.585 ( -11.560 -16.173 23.673) 30.913 5.063 ( -12.247 -9.127 18.813) 24.233 5.373 ( 1.216 -5.729 -8.830) 10.596 5.403 ( 3.840 3.646 -10.936) 12.151 5.884 ( -5.207 -3.124 -3.115) 6.824 6.344 ( -0.162 0.282 1.981) 2.008 6.444 ( -2.424 6.129 14.950) 16.339 6.971 ( -4.449 -3.714 6.756) 8.901 7.833 ( 2.047 1.384 -7.887) 8.265 8.437 ( -6.725 -7.855 13.197) 16.766 9.446 ( 5.519 7.457 -12.319) 15.421 9.737 ( 2.371 2.947 -3.576) 5.205 9.802 ( -2.548 10.696 5.099) 12.120 10.417 ( -9.356 14.498 17.109) 24.299 11.261 ( 9.005 4.077 -7.895) 12.650 11.913 ( -26.223 -41.368 27.022) 55.939 12.628 ( 9.904 2.893 5.924) 11.898 13.094 ( 9.138 29.973 -20.654) 37.530 13.786 ( -2.651 8.888 -23.196) 24.982 14.585 ( 2.968 -11.021 -4.516) 12.274 15.552 ( 2.858 -21.157 -3.739) 21.674 17.179 ( 6.073 -8.553 -16.467) 19.524 18.904 ( -9.218 2.595 20.210) 22.364 19.054 ( -8.548 -0.125 -1.525) 8.683 19.322 ( -3.503 5.747 10.212) 12.230 20.328 ( 30.734 12.371 -21.073) 39.265 ======================= Grid point 381 (182/366) ======================= q-point: ( 0.27 0.09 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.687 ( -2.017 11.158 6.214) 12.930 0.858 ( -0.828 -0.839 2.847) 3.081 1.242 ( 8.506 -0.108 2.076) 8.756 1.372 ( 2.600 9.122 -5.511) 10.970 1.681 ( -3.746 -5.251 -0.180) 6.452 1.980 ( 2.198 -6.088 1.797) 6.718 2.525 ( -5.403 -14.899 -8.843) 18.149 2.727 ( -4.528 6.922 26.644) 27.898 2.838 ( 5.171 3.288 -2.927) 6.790 3.352 ( -12.062 -3.336 15.266) 19.740 3.902 ( -12.196 -21.082 22.100) 32.888 5.116 ( 2.495 8.198 -9.321) 12.662 5.343 ( 7.562 1.730 -5.583) 9.558 5.499 ( -6.886 -13.129 11.072) 18.503 5.966 ( -8.589 -7.613 3.921) 12.129 6.340 ( -4.663 3.477 11.013) 12.455 6.361 ( -1.254 -2.529 3.809) 4.741 7.057 ( -1.866 -6.068 6.357) 8.985 7.780 ( 3.925 4.161 -9.994) 11.515 8.642 ( -4.158 -13.631 15.786) 21.267 9.228 ( 0.165 15.460 -1.150) 15.504 9.444 ( 3.123 14.748 -7.959) 17.047 9.878 ( 1.373 -5.846 -6.020) 8.503 10.249 ( -5.953 4.296 11.495) 13.639 11.145 ( 9.858 12.592 -14.288) 21.445 12.401 ( 12.564 31.501 -24.007) 41.551 12.617 ( -18.558 -33.453 24.390) 45.369 12.716 ( 4.885 -2.392 6.589) 8.544 13.519 ( -1.980 12.069 -19.733) 23.216 14.857 ( -4.273 -18.163 12.899) 22.684 15.958 ( 2.401 -20.106 -0.680) 20.261 17.331 ( 3.552 -6.868 -10.871) 13.340 18.837 ( -6.583 2.891 11.010) 13.150 18.998 ( -7.927 -0.134 -0.747) 7.963 19.189 ( -1.189 8.490 3.286) 9.181 20.156 ( 22.580 20.033 -17.669) 34.977 ======================= Grid point 382 (183/366) ======================= q-point: ( 0.36 0.09 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.541 ( 0.784 4.934 0.397) 5.012 0.881 ( -0.613 -1.558 1.919) 2.547 1.193 ( 3.199 10.753 -8.223) 13.910 1.285 ( 7.618 2.119 -0.490) 7.923 1.720 ( -6.260 -3.490 0.900) 7.224 2.090 ( 1.230 -4.014 2.952) 5.132 2.594 ( -8.477 5.134 7.156) 12.224 2.778 ( -2.500 -9.269 1.483) 9.714 2.851 ( 0.151 -8.949 -2.748) 9.363 3.426 ( -11.838 -10.891 11.444) 19.741 4.275 ( -11.962 -22.017 22.246) 33.507 4.862 ( 6.372 16.789 -12.278) 21.754 5.250 ( 9.293 15.181 0.367) 17.804 5.797 ( -6.502 -15.472 17.923) 24.553 6.027 ( -7.468 -6.399 6.514) 11.797 6.323 ( -3.098 -2.985 6.764) 8.016 6.502 ( -3.480 -13.193 -4.981) 14.525 7.183 ( 0.574 -5.559 9.774) 11.259 7.694 ( 3.643 4.516 -10.868) 12.320 8.853 ( -1.915 -1.978 8.959) 9.372 9.025 ( 3.682 3.739 -10.488) 11.728 9.228 ( 3.237 7.440 -1.072) 8.184 9.899 ( -4.143 2.709 1.534) 5.183 10.253 ( -1.612 -5.884 1.939) 6.402 10.843 ( 12.515 23.960 -27.146) 38.310 11.811 ( 12.103 29.322 -25.611) 40.770 12.732 ( 8.212 -0.040 2.178) 8.496 13.164 ( 0.665 5.884 -9.397) 11.107 13.431 ( -22.725 -36.507 29.591) 52.200 15.224 ( -7.532 -21.150 21.305) 30.950 16.244 ( -1.343 -9.253 9.780) 13.530 17.361 ( -1.112 3.957 1.507) 4.377 18.790 ( -1.410 0.001 -4.811) 5.014 18.952 ( -4.991 -0.014 -0.997) 5.089 19.051 ( 2.185 5.722 -7.283) 9.516 19.861 ( 14.038 20.964 -12.216) 28.032 ======================= Grid point 383 (184/366) ======================= q-point: ( 0.45 0.09 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.534 ( 3.293 -3.383 -6.768) 8.252 0.914 ( -0.230 -1.828 0.068) 1.844 0.991 ( 3.769 11.104 -9.853) 15.316 1.257 ( 4.694 5.024 -3.186) 7.578 1.762 ( -5.858 -5.407 4.644) 9.226 2.153 ( 0.024 -1.501 4.537) 4.779 2.430 ( -11.245 5.688 3.587) 13.102 2.874 ( 3.056 -3.827 7.123) 8.644 3.162 ( -3.563 -23.940 -11.120) 26.636 3.639 ( -9.153 -17.382 5.560) 20.417 4.483 ( 1.006 11.042 5.110) 12.209 4.665 ( 2.826 1.108 6.389) 7.073 5.016 ( -2.400 7.621 7.871) 11.216 5.888 ( -6.326 5.963 21.857) 23.522 6.172 ( -1.129 -9.500 4.898) 10.748 6.470 ( 1.189 -11.122 -6.852) 13.117 6.725 ( -6.152 -16.776 -3.607) 18.229 7.290 ( 2.293 -1.298 11.939) 12.226 7.654 ( 2.561 -2.436 -9.284) 9.934 8.642 ( 2.257 21.529 -7.055) 22.767 9.036 ( 9.205 -6.670 -22.378) 25.100 9.344 ( -2.505 -11.542 16.102) 19.969 9.766 ( -6.018 8.394 6.051) 11.971 10.330 ( 13.124 26.692 -33.590) 44.866 10.416 ( 2.556 -6.974 -9.643) 12.172 11.412 ( 7.942 17.949 -14.913) 24.650 12.807 ( 7.258 -2.067 -2.478) 7.943 12.912 ( 1.698 13.025 -14.130) 19.292 14.143 ( -20.655 -42.253 40.597) 62.130 15.567 ( -10.382 -13.130 29.382) 33.815 16.343 ( -5.131 -2.761 17.930) 18.853 17.178 ( -5.377 15.561 12.703) 20.795 18.789 ( 3.360 -2.150 -18.683) 19.104 18.940 ( 0.997 -1.467 -5.286) 5.576 18.989 ( 4.508 0.748 -14.554) 15.255 19.565 ( 7.209 16.219 -6.890) 19.039 ======================= Grid point 384 (185/366) ======================= q-point: (-0.45 0.09 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.649 ( 4.008 -8.560 -10.315) 13.991 0.780 ( 4.793 11.321 -11.513) 16.844 0.963 ( 0.076 -2.533 -0.753) 2.644 1.165 ( 1.913 6.107 -3.414) 7.253 1.851 ( -5.486 -6.288 6.450) 10.547 2.174 ( -0.099 0.402 5.907) 5.922 2.299 ( -7.498 2.230 0.767) 7.861 2.981 ( 2.128 -2.434 9.106) 9.663 3.563 ( -1.959 -25.582 -13.218) 28.861 3.928 ( -6.467 -18.927 0.107) 20.002 4.195 ( 10.254 20.576 -3.803) 23.302 4.476 ( 1.842 19.628 14.037) 24.201 5.173 ( -10.864 -18.500 13.661) 25.434 5.696 ( -7.357 15.432 22.625) 28.358 6.315 ( -0.013 -4.980 0.306) 4.989 6.595 ( 3.980 -3.859 -11.307) 12.593 6.954 ( -7.155 -11.272 -0.435) 13.359 7.340 ( 3.726 -0.035 10.806) 11.430 7.813 ( 2.500 -15.706 -5.795) 16.927 8.186 ( 2.357 26.889 -6.984) 27.881 9.271 ( 11.328 -16.651 -27.091) 33.757 9.551 ( -3.602 -2.228 5.696) 7.098 9.592 ( -3.144 1.028 6.837) 7.595 9.828 ( 13.572 23.841 -32.748) 42.720 10.610 ( 1.556 -12.264 -6.626) 14.026 11.142 ( 5.225 14.440 -10.397) 18.545 12.645 ( 1.656 12.408 -11.127) 16.749 12.923 ( 5.520 -5.821 -5.961) 9.994 14.832 ( -17.758 -35.883 40.994) 57.302 15.568 ( -13.643 14.426 38.065) 42.932 16.516 ( -6.391 -16.799 17.955) 25.405 16.830 ( -7.054 21.786 16.913) 28.468 18.805 ( 6.965 -1.946 -23.279) 24.377 18.971 ( -0.434 -1.608 -2.211) 2.768 19.002 ( 11.164 -2.005 -25.636) 28.034 19.363 ( 2.826 8.118 -3.259) 9.193 ======================= Grid point 385 (186/366) ======================= q-point: (-0.36 0.09 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.590 ( 5.180 9.810 -11.528) 15.999 0.823 ( 3.871 -10.517 -10.702) 15.496 0.983 ( 0.229 1.712 -1.025) 2.008 1.076 ( 0.779 2.581 -1.471) 3.071 1.925 ( -5.627 -4.036 5.756) 9.005 2.157 ( -2.450 3.083 4.746) 6.167 2.258 ( 0.496 -0.127 1.233) 1.335 2.991 ( 0.758 5.712 9.696) 11.279 3.788 ( 5.334 14.581 -5.450) 16.455 4.037 ( 1.525 -6.823 1.975) 7.264 4.113 ( 0.179 -1.989 3.469) 4.003 4.346 ( -2.488 -13.309 -3.815) 14.067 5.340 ( -8.354 15.188 17.822) 24.861 5.496 ( -8.563 -10.503 17.943) 22.486 6.335 ( -2.058 0.754 -4.229) 4.763 6.623 ( 5.763 1.766 -10.286) 11.922 7.023 ( -6.121 -3.188 1.989) 7.182 7.358 ( 0.490 7.089 15.133) 16.719 7.759 ( 3.877 16.729 -7.936) 18.917 8.187 ( 3.364 -23.371 -6.578) 24.511 9.267 ( -2.058 11.887 -4.729) 12.957 9.412 ( 8.938 16.225 -19.641) 26.999 9.761 ( 8.282 -19.628 -18.553) 28.250 9.813 ( 1.290 -16.063 -3.786) 16.553 10.824 ( 5.728 -4.469 -7.439) 10.398 10.903 ( 1.495 5.108 -9.932) 11.268 12.433 ( 2.397 9.646 -6.923) 12.113 13.067 ( 3.717 -8.824 -8.752) 12.973 15.153 ( -15.495 26.150 38.389) 48.965 15.373 ( -14.950 -19.591 38.282) 45.529 16.437 ( -6.551 19.880 16.278) 26.516 16.874 ( -6.665 -20.556 17.389) 27.737 18.832 ( 9.027 -1.955 -22.743) 24.547 18.986 ( 1.672 -0.596 -2.233) 2.853 19.030 ( 9.088 -0.142 -23.784) 25.462 19.300 ( 1.345 -0.215 -4.240) 4.453 ======================= Grid point 386 (187/366) ======================= q-point: (-0.27 0.09 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.460 ( 4.178 4.268 -7.758) 9.791 0.910 ( -0.154 4.565 0.901) 4.656 1.013 ( 3.524 -10.676 -9.598) 14.782 1.065 ( 1.486 1.029 0.051) 1.809 1.941 ( -4.556 0.450 5.251) 6.967 2.067 ( -2.253 5.622 3.398) 6.945 2.280 ( 3.882 0.726 3.078) 5.007 2.865 ( -0.101 10.154 12.436) 16.055 3.426 ( 4.966 24.442 1.758) 25.003 3.907 ( -6.899 10.279 15.007) 19.454 4.436 ( 2.236 -19.413 -4.252) 19.999 4.668 ( -0.489 -22.283 -15.136) 26.942 4.956 ( -6.464 22.869 17.278) 29.382 5.702 ( -6.559 -9.212 14.826) 18.646 6.276 ( -3.256 2.030 -3.183) 4.985 6.531 ( 3.058 8.432 -9.460) 13.036 7.042 ( -3.910 -1.462 5.640) 7.017 7.126 ( -3.793 17.397 13.551) 22.376 7.653 ( 5.125 0.194 -7.117) 8.773 8.586 ( 3.755 -17.398 -5.135) 18.525 9.066 ( 1.573 4.836 -11.911) 12.951 9.179 ( 1.688 9.886 -2.956) 10.456 9.950 ( -6.333 -8.207 14.540) 17.858 10.289 ( 14.407 -27.220 -35.492) 46.991 10.590 ( 1.398 15.761 -7.041) 17.319 11.171 ( 8.535 -21.118 -15.940) 27.801 12.309 ( 4.231 5.072 -1.806) 6.848 13.226 ( 1.877 -8.459 -9.263) 12.684 14.619 ( -17.228 28.670 31.593) 46.010 15.493 ( -11.322 8.940 29.869) 33.170 16.212 ( -5.119 4.369 14.626) 16.100 17.204 ( -5.136 -15.099 12.891) 20.507 18.879 ( 7.310 -2.988 -17.438) 19.143 18.998 ( 2.207 0.367 -6.145) 6.539 19.032 ( 7.451 -1.121 -11.217) 13.512 19.335 ( 1.207 -3.656 -6.459) 7.520 ======================= Grid point 387 (188/366) ======================= q-point: (-0.18 0.09 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.484 ( 1.120 -6.066 0.804) 6.221 0.850 ( 0.448 2.577 2.896) 3.902 1.039 ( 2.863 3.626 1.839) 4.973 1.197 ( 2.976 -9.749 -7.615) 12.723 1.866 ( -3.545 6.170 5.737) 9.140 1.964 ( 0.555 5.850 4.136) 7.186 2.313 ( 4.311 -0.683 7.057) 8.298 2.738 ( -1.684 6.841 15.597) 17.115 3.034 ( 2.516 22.042 3.848) 22.516 3.694 ( -10.099 11.408 15.969) 22.071 4.459 ( -11.627 20.875 17.428) 29.575 4.846 ( 9.558 -13.795 -4.688) 17.425 5.008 ( 0.846 -19.187 -20.088) 27.792 5.756 ( -4.807 4.117 12.149) 13.699 6.211 ( -4.993 2.201 2.570) 6.032 6.386 ( -1.877 3.975 -2.158) 4.897 6.786 ( -8.113 18.516 10.852) 22.943 7.072 ( -0.141 -0.423 2.989) 3.022 7.699 ( 4.179 -3.761 -8.758) 10.407 8.713 ( -1.465 4.344 10.462) 11.422 9.070 ( 3.674 -4.025 -12.485) 13.622 9.183 ( 0.869 -12.857 -4.021) 13.500 10.045 ( -4.844 -1.032 7.192) 8.732 10.323 ( -2.089 9.555 0.481) 9.793 10.716 ( 11.658 -18.158 -22.210) 30.966 11.673 ( 13.818 -32.294 -27.284) 44.478 12.304 ( 6.233 -0.672 2.365) 6.700 13.271 ( -1.765 6.415 1.944) 6.932 14.135 ( -18.997 14.510 10.230) 26.001 15.191 ( -7.638 20.683 20.684) 30.232 16.145 ( -2.065 7.751 7.917) 11.270 17.382 ( -1.126 -4.152 2.259) 4.859 18.913 ( -0.161 -0.432 -5.991) 6.008 19.027 ( 2.674 -5.507 -5.668) 8.343 19.111 ( 6.261 -3.307 -1.538) 7.246 19.419 ( 5.294 -5.908 -5.477) 9.640 ======================= Grid point 388 (189/366) ======================= q-point: (-0.09 0.09 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.668 ( -1.501 -12.205 6.579) 13.946 0.838 ( 0.596 0.378 3.659) 3.727 1.002 ( 6.229 3.915 3.762) 8.263 1.360 ( 2.175 -8.273 -4.688) 9.754 1.723 ( -2.084 8.916 5.968) 10.929 1.889 ( 1.748 4.802 3.348) 6.109 2.416 ( 6.679 -4.071 11.194) 13.656 2.629 ( -3.605 12.051 11.706) 17.183 2.774 ( 1.274 4.646 10.330) 11.398 3.474 ( -9.885 9.665 18.458) 23.061 4.028 ( -12.190 21.733 18.398) 30.974 5.138 ( 9.562 -10.680 -12.724) 19.167 5.223 ( 2.617 -7.539 -13.166) 15.396 5.601 ( -9.142 8.321 13.806) 18.532 6.112 ( -5.250 7.783 6.032) 11.159 6.363 ( -3.523 -1.533 4.275) 5.747 6.462 ( -7.785 9.548 2.817) 12.638 7.059 ( -1.231 2.335 2.707) 3.781 7.788 ( 2.812 -5.517 -8.950) 10.883 8.590 ( -4.368 8.619 14.592) 17.501 9.239 ( 1.238 -13.375 -4.324) 14.110 9.457 ( 0.759 -17.475 -4.178) 17.984 9.904 ( 1.486 11.429 -6.061) 13.022 10.303 ( -7.711 -5.798 13.937) 16.951 10.997 ( 10.576 -10.453 -12.304) 19.301 12.249 ( 12.096 -18.095 -9.821) 23.879 12.493 ( 9.653 -23.386 -14.255) 29.039 12.879 ( -13.513 32.795 19.397) 40.428 13.971 ( -14.173 -7.053 -17.257) 23.418 14.835 ( -3.931 18.354 11.858) 22.202 15.906 ( 1.611 19.003 -1.212) 19.109 17.347 ( 3.618 6.954 -10.251) 12.905 18.901 ( -4.674 -0.922 6.083) 7.727 19.158 ( -1.621 -5.756 2.944) 6.665 19.190 ( -0.355 -4.851 -0.046) 4.865 19.633 ( 19.758 -10.380 -4.546) 22.777 ======================= Grid point 391 (190/366) ======================= q-point: ( 0.18 0.18 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.844 ( -1.205 0.000 2.866) 3.109 1.055 ( -1.139 0.000 8.142) 8.222 1.171 ( -0.937 0.000 7.571) 7.629 1.486 ( 6.137 -0.000 -2.203) 6.521 1.637 ( 1.483 -0.000 0.073) 1.485 1.783 ( 2.044 -0.000 -3.467) 4.025 2.223 ( -4.914 0.000 -8.187) 9.549 2.948 ( -9.340 0.000 9.640) 13.422 2.968 ( 9.747 -0.000 13.317) 16.503 3.353 ( -7.296 0.000 15.182) 16.844 3.416 ( -7.677 0.000 29.886) 30.856 4.920 ( -19.577 0.000 31.264) 36.887 5.292 ( 5.275 -0.000 -18.333) 19.077 5.427 ( 4.037 -0.000 -11.257) 11.959 5.828 ( -5.759 0.000 -3.275) 6.625 6.357 ( 2.900 -0.000 -0.520) 2.946 6.545 ( -1.215 0.000 17.048) 17.091 6.926 ( -5.487 0.000 10.927) 12.228 7.832 ( 2.015 -0.000 -6.832) 7.123 8.342 ( -7.585 0.000 11.256) 13.573 9.515 ( 7.011 -0.000 -16.234) 17.683 9.728 ( 5.837 -0.000 -6.719) 8.900 9.955 ( -5.617 0.000 9.897) 11.380 10.709 ( -8.788 0.000 23.527) 25.114 11.158 ( -18.987 0.000 23.983) 30.589 11.421 ( -1.752 0.000 -4.081) 4.441 12.731 ( 8.082 -0.000 6.560) 10.410 13.405 ( 4.443 -0.000 -9.520) 10.506 13.814 ( 0.991 -0.000 -22.506) 22.527 14.490 ( 11.495 -0.000 -25.313) 27.801 15.331 ( 0.537 -0.000 0.646) 0.840 17.092 ( 6.681 -0.000 -17.258) 18.506 18.924 ( -10.611 0.000 24.986) 27.146 18.988 ( -8.610 0.000 -1.987) 8.836 19.379 ( -4.522 0.000 12.454) 13.249 20.589 ( 29.943 -0.000 -27.797) 40.857 ======================= Grid point 392 (191/366) ======================= q-point: ( 0.27 0.18 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.848 ( -1.088 -0.410 2.959) 3.180 0.903 ( -3.492 12.103 8.653) 15.282 1.271 ( 4.301 -4.152 5.124) 7.873 1.515 ( 2.925 4.286 -3.164) 6.078 1.590 ( 0.414 -0.060 -3.431) 3.456 1.874 ( 1.678 -6.976 -0.637) 7.203 2.244 ( -5.459 -8.688 -10.925) 14.988 2.850 ( -12.267 5.328 21.822) 25.594 2.998 ( 10.374 6.374 3.788) 12.752 3.315 ( -8.834 1.798 13.905) 16.572 3.572 ( -10.154 -13.123 26.038) 30.875 4.996 ( -14.048 -12.767 23.232) 30.001 5.326 ( -0.226 -1.252 -7.217) 7.328 5.417 ( 7.635 -0.944 -17.106) 18.756 5.804 ( -3.932 -3.653 -2.854) 6.079 6.372 ( 1.445 1.035 5.005) 5.311 6.495 ( -2.911 8.688 17.618) 19.858 6.953 ( -4.320 -4.231 8.966) 10.815 7.829 ( 4.013 1.011 -8.943) 9.854 8.420 ( -6.307 -10.296 13.902) 18.413 9.454 ( 5.292 7.650 -12.167) 15.316 9.742 ( -1.140 12.840 2.301) 13.094 9.802 ( 1.111 2.006 -1.821) 2.928 10.387 ( -8.386 14.173 16.849) 23.560 11.328 ( 7.497 4.482 -9.079) 12.598 11.730 ( -23.883 -43.459 32.084) 59.063 12.769 ( 7.306 3.158 2.584) 8.368 13.109 ( 8.821 29.565 -19.595) 36.550 13.673 ( 3.605 9.467 -22.584) 24.752 14.598 ( 2.197 -10.613 -3.740) 11.466 15.570 ( 2.762 -21.739 -3.962) 22.269 17.174 ( 6.086 -8.201 -16.462) 19.373 18.886 ( -9.448 3.064 20.608) 22.876 18.936 ( -8.042 -0.470 0.809) 8.096 19.325 ( -3.950 5.834 10.268) 12.453 20.572 ( 24.451 13.652 -27.499) 39.248 ======================= Grid point 393 (192/366) ======================= q-point: ( 0.36 0.18 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.690 ( -2.373 10.608 6.023) 12.427 0.861 ( -0.917 -0.856 2.910) 3.169 1.364 ( 7.388 1.060 0.831) 7.509 1.379 ( 3.542 8.369 -4.829) 10.290 1.613 ( -5.411 -3.353 -2.443) 6.819 2.009 ( 0.763 -6.445 1.464) 6.653 2.385 ( -5.644 -14.040 -14.456) 20.927 2.729 ( -11.530 5.583 21.400) 24.941 2.929 ( 5.882 6.830 1.903) 9.212 3.269 ( -11.517 -1.681 14.658) 18.717 3.867 ( -10.979 -19.985 24.002) 33.107 5.116 ( 4.353 8.229 -7.887) 12.201 5.377 ( -6.716 -16.592 15.493) 23.673 5.495 ( 5.796 -3.204 -9.800) 11.828 5.878 ( -5.988 -6.493 1.198) 8.913 6.349 ( -3.287 5.471 13.208) 14.669 6.377 ( -1.239 0.618 7.490) 7.617 7.071 ( -1.697 -8.148 7.813) 11.415 7.782 ( 4.557 4.544 -10.800) 12.572 8.665 ( -4.739 -14.985 15.445) 22.035 9.225 ( 0.153 15.974 -0.420) 15.980 9.447 ( 3.665 13.314 -8.547) 16.241 9.866 ( 1.614 -3.596 -5.911) 7.104 10.235 ( -4.780 3.665 10.785) 12.353 11.185 ( 7.597 13.107 -15.621) 21.760 12.437 ( 13.192 37.085 -31.229) 50.245 12.496 ( -21.152 -46.382 38.300) 63.763 12.812 ( 4.233 2.350 2.300) 5.360 13.435 ( 4.550 13.377 -19.352) 23.961 14.865 ( -4.728 -18.219 13.087) 22.925 15.983 ( 1.759 -20.597 -0.678) 20.683 17.322 ( 3.779 -6.824 -11.040) 13.517 18.812 ( -6.304 3.725 12.721) 14.677 18.901 ( -5.643 -0.903 -0.030) 5.715 19.188 ( -1.602 8.641 3.488) 9.456 20.316 ( 16.661 21.803 -22.113) 35.241 ======================= Grid point 394 (193/366) ======================= q-point: ( 0.45 0.18 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.547 ( -0.039 4.661 0.028) 4.661 0.882 ( -0.700 -1.394 1.942) 2.491 1.193 ( 3.230 10.926 -8.239) 14.060 1.374 ( 6.262 4.844 -3.399) 8.616 1.640 ( -6.464 -4.839 2.944) 8.595 2.111 ( -0.551 -4.119 2.665) 4.937 2.465 ( -8.865 1.834 -5.296) 10.488 2.720 ( -6.012 -12.618 3.635) 14.442 2.895 ( 1.117 -0.629 5.343) 5.494 3.341 ( -9.518 -10.457 12.122) 18.625 4.246 ( -10.362 -22.223 24.028) 34.331 4.903 ( 8.691 14.834 -11.067) 20.447 5.349 ( 4.584 17.120 -0.676) 17.736 5.798 ( -7.675 -20.318 19.768) 29.368 5.973 ( -4.215 -8.427 4.833) 10.589 6.323 ( -2.403 -1.771 7.685) 8.245 6.455 ( -0.185 -9.067 -3.957) 9.895 7.237 ( -0.548 -7.796 9.978) 12.674 7.685 ( 3.577 5.319 -11.156) 12.866 8.858 ( -2.899 0.034 5.632) 6.335 9.024 ( 4.235 3.793 -9.984) 11.489 9.267 ( 2.423 4.584 0.936) 5.269 9.863 ( -2.225 3.688 1.385) 4.525 10.246 ( -1.039 -5.245 2.290) 5.816 10.858 ( 11.271 24.468 -28.147) 38.961 11.824 ( 9.916 28.721 -25.815) 39.870 12.817 ( 3.525 -0.237 -0.913) 3.649 13.136 ( 3.138 8.545 -10.552) 13.936 13.335 ( -16.912 -39.679 35.761) 56.029 15.232 ( -7.928 -21.361 21.128) 31.073 16.270 ( -2.589 -9.471 9.638) 13.758 17.356 ( -0.830 3.828 1.357) 4.146 18.754 ( -0.450 1.104 -3.244) 3.456 18.899 ( -2.172 -1.788 0.070) 2.814 19.045 ( 2.558 6.116 -7.545) 10.043 19.945 ( 8.967 22.374 -15.020) 28.401 ======================= Grid point 395 (194/366) ======================= q-point: ( 0.55 0.18 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.534 ( 2.023 -3.336 -7.184) 8.175 0.913 ( 0.019 -1.860 0.329) 1.889 0.991 ( 3.938 11.134 -9.882) 15.399 1.280 ( 1.691 6.386 -5.211) 8.414 1.717 ( -4.625 -6.059 6.557) 10.054 2.166 ( -1.542 -2.088 3.962) 4.737 2.325 ( -5.620 4.661 1.674) 7.491 2.912 ( -2.357 -6.953 4.073) 8.396 3.085 ( -1.466 -21.338 -5.286) 22.032 3.561 ( -7.057 -16.586 7.521) 19.531 4.537 ( 0.127 3.056 12.573) 12.939 4.739 ( 4.645 -1.797 2.300) 5.486 5.011 ( -3.238 17.238 3.631) 17.912 5.903 ( -7.744 5.963 20.084) 22.336 6.192 ( -0.961 -10.458 9.260) 14.001 6.453 ( 1.169 -11.206 -5.508) 12.541 6.655 ( -0.953 -14.668 -5.083) 15.553 7.361 ( 0.016 -2.611 8.441) 8.835 7.639 ( 1.751 -3.163 -7.468) 8.297 8.630 ( 1.527 20.994 -7.444) 22.327 9.045 ( 9.937 -6.998 -22.853) 25.883 9.384 ( -4.075 -10.654 15.841) 19.521 9.731 ( -3.739 9.100 6.259) 11.661 10.326 ( 11.242 23.529 -29.856) 39.640 10.412 ( 5.527 -3.401 -12.697) 14.259 11.419 ( 5.010 17.315 -15.486) 23.764 12.851 ( 2.770 -0.574 -5.779) 6.434 12.887 ( 4.555 12.173 -12.125) 17.775 14.113 ( -16.406 -42.735 43.061) 62.847 15.575 ( -11.130 -13.485 28.834) 33.721 16.357 ( -6.667 -2.507 17.570) 18.959 17.174 ( -5.136 15.629 12.834) 20.865 18.755 ( 5.866 -1.915 -16.943) 18.031 18.932 ( 0.494 -2.242 -0.433) 2.336 18.984 ( 7.428 0.476 -19.138) 20.534 19.594 ( 3.142 16.843 -8.719) 19.224 ======================= Grid point 396 (195/366) ======================= q-point: (-0.36 0.18 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.641 ( 2.964 -8.764 -10.834) 14.247 0.785 ( 4.972 11.173 -11.278) 16.636 0.964 ( 0.550 -2.556 -0.609) 2.684 1.160 ( 0.251 5.938 -3.926) 7.123 1.810 ( -5.124 -5.562 7.213) 10.451 2.184 ( -2.564 0.536 4.403) 5.123 2.273 ( 2.096 0.053 2.785) 3.486 3.003 ( -5.164 -3.986 6.620) 9.294 3.499 ( 1.256 -25.384 -9.843) 27.255 3.857 ( -4.827 -18.725 3.390) 19.632 4.309 ( 9.574 19.186 -5.340) 22.097 4.554 ( -0.694 21.927 10.606) 24.367 5.115 ( -7.899 -19.414 14.788) 25.651 5.703 ( -8.942 14.942 21.887) 27.969 6.307 ( -0.630 -2.124 -0.479) 2.266 6.614 ( 6.023 -5.193 -7.340) 10.822 6.875 ( -4.509 -10.065 -0.162) 11.030 7.411 ( 0.119 -1.896 6.121) 6.409 7.813 ( 1.233 -16.498 -4.115) 17.048 8.180 ( 2.256 26.318 -7.254) 27.393 9.286 ( 12.325 -16.010 -27.860) 34.415 9.534 ( -0.803 6.793 1.619) 7.029 9.588 ( -5.077 -6.413 10.478) 13.293 9.835 ( 12.492 22.955 -31.161) 40.670 10.614 ( 4.090 -12.602 -6.164) 14.613 11.134 ( 2.131 14.297 -11.157) 18.260 12.643 ( 6.068 12.778 -9.291) 16.924 12.926 ( 0.411 -6.021 -8.149) 10.140 14.835 ( -14.460 -35.733 42.493) 57.373 15.568 ( -15.815 14.687 37.033) 42.863 16.518 ( -7.240 -16.805 17.574) 25.371 16.828 ( -6.587 21.818 17.168) 28.534 18.799 ( 10.044 -2.423 -22.418) 24.684 18.974 ( 2.475 -1.750 -1.998) 3.631 19.007 ( 9.515 -1.919 -25.023) 26.840 19.358 ( -0.545 8.202 -4.619) 9.429 ======================= Grid point 397 (196/366) ======================= q-point: (-0.27 0.18 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.600 ( 5.275 9.588 -11.142) 15.618 0.813 ( 3.317 -10.921 -11.146) 15.953 0.981 ( 0.264 2.176 -1.038) 2.425 1.082 ( 1.205 1.198 -1.286) 2.131 1.880 ( -5.061 -3.827 6.333) 8.965 2.139 ( -2.577 3.181 3.738) 5.543 2.330 ( 6.332 -0.626 4.229) 7.640 2.997 ( -6.517 2.388 6.970) 9.836 3.806 ( 3.450 5.470 -6.774) 9.365 4.088 ( 0.666 1.049 8.649) 8.737 4.126 ( 2.492 -6.221 -6.184) 9.118 4.288 ( -3.814 -5.335 -2.402) 6.985 5.325 ( -8.090 12.645 19.670) 24.743 5.494 ( -6.247 -8.473 19.097) 21.806 6.286 ( -1.294 2.067 -4.561) 5.172 6.657 ( 6.615 3.573 -9.568) 12.168 6.970 ( -4.388 -4.916 5.443) 8.547 7.394 ( -5.186 8.171 10.193) 14.055 7.773 ( 4.442 15.086 -8.394) 17.827 8.195 ( 2.890 -24.168 -6.266) 25.133 9.235 ( 1.959 13.599 -7.055) 15.445 9.428 ( 6.958 15.795 -14.355) 22.449 9.767 ( 6.950 -18.826 -18.112) 27.032 9.804 ( 1.501 -16.845 -6.311) 18.051 10.854 ( -0.158 14.792 -9.431) 17.544 10.878 ( 7.336 -14.754 -8.290) 18.445 12.469 ( 7.385 9.209 -4.780) 12.735 13.037 ( -0.466 -9.090 -10.769) 14.100 15.122 ( -18.630 28.283 37.264) 50.355 15.386 ( -13.361 -19.884 39.256) 45.988 16.441 ( -5.768 19.647 16.745) 26.451 16.872 ( -7.116 -20.621 17.149) 27.748 18.849 ( 11.282 -1.725 -23.110) 25.775 19.009 ( 5.525 0.718 -14.947) 15.952 19.029 ( 6.879 -1.946 -9.739) 12.081 19.270 ( -1.939 -0.478 -5.163) 5.536 ======================= Grid point 398 (197/366) ======================= q-point: (-0.18 0.18 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.478 ( 4.308 3.990 -7.269) 9.344 0.915 ( 0.096 3.775 0.811) 3.863 1.007 ( 3.267 -11.012 -9.853) 15.133 1.094 ( 2.865 0.176 -0.101) 2.872 1.900 ( -5.088 -0.069 4.884) 7.053 2.071 ( -0.100 4.155 3.313) 5.315 2.377 ( 6.310 1.392 6.467) 9.142 2.889 ( -4.901 6.535 9.182) 12.290 3.456 ( 0.269 23.487 -4.176) 23.857 3.877 ( -8.430 13.314 13.338) 20.646 4.458 ( 2.292 -17.717 -0.260) 17.866 4.581 ( 0.442 -21.617 -15.794) 26.776 4.964 ( -6.060 20.060 17.791) 27.489 5.720 ( -3.857 -8.691 18.087) 20.434 6.219 ( -2.947 2.434 -2.039) 4.332 6.523 ( 2.823 10.839 -8.947) 14.335 7.041 ( -2.293 -1.672 10.482) 10.860 7.101 ( -7.584 16.999 6.107) 19.591 7.673 ( 3.970 0.541 -8.532) 9.426 8.611 ( 3.826 -18.702 -4.997) 19.732 9.039 ( 4.012 4.920 -12.796) 14.284 9.194 ( 1.412 11.095 0.953) 11.225 9.928 ( -7.565 -7.965 12.578) 16.700 10.300 ( 15.092 -28.067 -35.966) 48.053 10.553 ( -0.792 15.107 -7.710) 16.979 11.221 ( 10.838 -20.865 -15.079) 27.932 12.395 ( 8.959 4.345 0.030) 9.957 13.178 ( -0.783 -9.679 -11.785) 15.270 14.515 ( -22.513 32.431 31.961) 50.795 15.504 ( -10.630 9.662 30.201) 33.443 16.231 ( -3.972 4.214 15.701) 16.734 17.200 ( -5.436 -15.148 12.758) 20.538 18.890 ( 7.854 -1.283 -17.771) 19.472 18.978 ( 4.073 0.314 -16.259) 16.764 19.101 ( 5.075 -2.013 -0.489) 5.481 19.311 ( 2.057 -6.421 -7.376) 9.994 ======================= Grid point 399 (198/366) ======================= q-point: (-0.09 0.18 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.504 ( 1.216 -5.816 0.835) 6.000 0.868 ( 0.093 1.941 2.394) 3.084 1.100 ( 4.986 1.820 1.329) 5.471 1.196 ( 3.031 -10.029 -7.912) 13.129 1.838 ( -4.166 4.411 3.377) 6.944 2.005 ( 2.083 5.028 3.577) 6.513 2.433 ( 5.922 -1.535 11.206) 12.767 2.778 ( -3.252 5.671 12.022) 13.684 3.037 ( -2.167 20.031 -3.763) 20.496 3.623 ( -12.069 10.912 14.420) 21.741 4.391 ( -12.083 20.697 18.045) 30.000 4.919 ( 1.145 -19.120 -17.032) 25.632 4.969 ( 11.319 -13.222 -3.055) 17.671 5.765 ( -4.292 6.881 14.134) 16.295 6.154 ( -6.337 1.894 4.808) 8.177 6.354 ( -2.390 4.237 1.034) 4.973 6.708 ( -9.088 19.371 4.170) 21.799 7.090 ( -0.111 0.298 5.206) 5.216 7.704 ( 3.785 -3.507 -9.687) 10.975 8.761 ( -0.625 4.803 12.402) 13.314 9.052 ( 3.293 -4.073 -11.935) 13.033 9.181 ( 2.165 -12.342 -4.299) 13.247 10.007 ( -5.574 -1.128 4.987) 7.564 10.295 ( -2.470 8.423 0.841) 8.817 10.762 ( 12.939 -20.221 -23.628) 33.683 11.722 ( 14.348 -31.662 -26.669) 43.813 12.430 ( 9.616 -0.500 3.889) 10.384 13.248 ( -2.109 4.032 -0.760) 4.613 13.889 ( -25.509 21.218 13.458) 35.805 15.200 ( -7.451 20.747 21.034) 30.469 16.169 ( -0.980 8.293 8.796) 12.129 17.376 ( -1.304 -4.149 2.063) 4.814 18.878 ( -0.442 0.704 -6.162) 6.218 19.029 ( 2.337 -6.443 -6.332) 9.331 19.138 ( -1.826 -1.253 -1.402) 2.622 19.521 ( 14.901 -12.804 -6.962) 20.843 ======================= Grid point 403 (199/366) ======================= q-point: ( 0.27 0.27 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.844 ( -1.068 0.000 2.969) 3.155 1.068 ( -4.130 0.000 10.528) 11.309 1.194 ( -1.096 0.000 6.280) 6.375 1.547 ( 6.578 -0.000 -7.604) 10.055 1.655 ( 0.802 -0.000 0.624) 1.016 1.785 ( 1.182 -0.000 -4.015) 4.185 2.098 ( -4.949 0.000 -12.800) 13.723 2.862 ( -13.249 0.000 18.795) 22.995 3.145 ( 7.273 -0.000 7.980) 10.797 3.321 ( -7.676 0.000 9.424) 12.155 3.460 ( -9.255 0.000 29.791) 31.195 4.824 ( -18.270 0.000 29.679) 34.852 5.267 ( 5.801 -0.000 -19.552) 20.394 5.427 ( 3.703 -0.000 -8.273) 9.064 5.748 ( -3.292 0.000 -3.117) 4.534 6.415 ( 4.810 -0.000 2.164) 5.274 6.606 ( -3.242 0.000 17.505) 17.803 6.921 ( -5.160 0.000 13.999) 14.919 7.839 ( 4.769 -0.000 -7.865) 9.198 8.308 ( -6.520 0.000 12.110) 13.754 9.521 ( 6.766 -0.000 -16.464) 17.800 9.762 ( 4.545 -0.000 -7.135) 8.460 9.935 ( -4.765 0.000 9.268) 10.422 10.719 ( -8.273 0.000 23.629) 25.035 11.024 ( -21.949 0.000 33.893) 40.379 11.408 ( 4.000 -0.000 -10.817) 11.532 12.841 ( 3.976 -0.000 3.412) 5.239 13.420 ( 4.953 -0.000 -8.899) 10.184 13.747 ( 6.102 -0.000 -21.994) 22.825 14.505 ( 10.027 -0.000 -24.474) 26.448 15.341 ( 0.591 -0.000 0.336) 0.680 17.091 ( 6.654 -0.000 -17.226) 18.467 18.878 ( -6.206 0.000 -0.896) 6.270 18.915 ( -10.850 0.000 26.688) 28.809 19.380 ( -4.992 0.000 12.395) 13.363 20.779 ( 22.280 -0.000 -33.049) 39.858 ======================= Grid point 404 (200/366) ======================= q-point: ( 0.36 0.27 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.849 ( -1.274 -0.124 3.269) 3.511 0.900 ( -3.877 11.747 8.889) 15.232 1.334 ( 0.264 -8.246 6.605) 10.569 1.537 ( 3.401 6.271 -4.563) 8.468 1.571 ( 0.942 3.157 -7.195) 7.914 1.883 ( 0.028 -7.609 -0.644) 7.637 2.109 ( -4.413 -8.283 -13.600) 16.524 2.792 ( -12.994 3.818 22.151) 25.963 3.114 ( 3.410 8.280 0.937) 9.003 3.258 ( -9.543 2.574 14.568) 17.605 3.578 ( -9.984 -11.196 27.167) 31.034 4.935 ( -14.110 -15.891 25.669) 33.324 5.300 ( 3.301 -0.285 -10.702) 11.204 5.425 ( 6.890 -2.565 -16.420) 17.991 5.755 ( -1.539 -3.657 -1.773) 4.346 6.428 ( 2.077 2.536 6.398) 7.189 6.550 ( -3.163 9.464 19.041) 21.498 6.948 ( -3.995 -4.565 10.101) 11.782 7.846 ( 5.897 1.608 -9.960) 11.686 8.414 ( -5.677 -11.891 14.548) 19.628 9.459 ( 4.950 7.673 -12.230) 15.263 9.737 ( -2.427 16.491 5.454) 17.538 9.807 ( 2.260 -1.095 -5.419) 5.972 10.372 ( -7.074 13.756 17.069) 23.035 11.354 ( 3.794 5.765 -12.024) 13.864 11.624 ( -18.081 -45.291 36.895) 61.151 12.841 ( 2.338 3.211 -0.667) 4.027 13.124 ( 8.323 29.736 -18.603) 36.049 13.640 ( 8.548 9.581 -21.734) 25.244 14.602 ( 1.219 -10.571 -3.510) 11.205 15.584 ( 2.412 -22.068 -4.146) 22.583 17.170 ( 6.207 -7.951 -16.398) 19.252 18.847 ( -4.006 -0.443 1.180) 4.200 18.884 ( -9.484 3.036 22.988) 25.052 19.323 ( -4.386 5.871 10.219) 12.575 20.694 ( 16.870 14.135 -31.830) 38.698 ======================= Grid point 405 (201/366) ======================= q-point: ( 0.45 0.27 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.686 ( -2.913 10.335 5.817) 12.212 0.863 ( -1.153 -0.790 3.131) 3.429 1.379 ( 2.300 9.624 -5.677) 11.408 1.483 ( 7.979 0.540 -0.221) 8.000 1.510 ( -7.890 -2.927 -1.959) 8.641 2.010 ( -1.754 -6.722 0.576) 6.971 2.244 ( -3.190 -12.638 -14.296) 19.346 2.673 ( -12.964 5.100 20.938) 25.149 2.963 ( -2.668 6.624 -0.534) 7.161 3.223 ( -6.934 -1.086 17.690) 19.031 3.860 ( -9.247 -19.305 25.279) 33.125 5.150 ( 6.285 7.048 -6.683) 11.569 5.344 ( -11.552 -22.174 20.240) 32.168 5.520 ( 7.451 -1.763 -16.657) 18.332 5.835 ( -0.554 -6.479 0.337) 6.511 6.387 ( -3.591 8.135 17.431) 19.569 6.404 ( 0.016 2.041 6.958) 7.252 7.089 ( -2.045 -9.503 7.891) 12.520 7.790 ( 5.265 5.613 -11.300) 13.672 8.675 ( -5.476 -14.936 14.430) 21.478 9.228 ( 0.517 15.908 -0.433) 15.923 9.452 ( 3.511 12.232 -8.013) 15.038 9.861 ( 2.216 -2.703 -5.802) 6.773 10.234 ( -3.834 3.508 10.872) 12.050 11.182 ( 4.469 12.655 -16.343) 21.147 12.377 ( -4.227 -1.397 -3.526) 5.679 12.517 ( 0.187 -8.023 13.109) 15.370 12.839 ( -1.202 2.114 -0.155) 2.437 13.431 ( 9.281 13.880 -18.017) 24.565 14.867 ( -5.298 -18.407 12.915) 23.101 15.996 ( 0.817 -20.763 -0.947) 20.800 17.317 ( 4.141 -6.790 -11.005) 13.578 18.805 ( -5.244 4.334 14.041) 15.602 18.857 ( -1.252 -1.541 1.328) 2.389 19.183 ( -1.918 8.657 3.479) 9.525 20.368 ( 9.781 22.322 -25.547) 35.307 ======================= Grid point 406 (202/366) ======================= q-point: (-0.45 -0.73 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.538 ( -1.142 4.764 -0.456) 4.920 0.883 ( -0.778 -1.416 2.086) 2.639 1.193 ( 3.188 10.914 -8.133) 13.980 1.375 ( -2.750 5.499 -7.049) 9.354 1.619 ( 0.374 -4.941 6.756) 8.378 2.097 ( -3.247 -4.672 1.521) 5.889 2.347 ( -3.497 -1.228 -5.528) 6.655 2.666 ( -6.152 -11.221 6.726) 14.457 2.890 ( -5.838 -1.871 3.059) 6.851 3.318 ( -4.533 -8.753 16.097) 18.875 4.253 ( -7.841 -22.498 25.089) 34.599 4.973 ( 10.149 13.658 -11.093) 20.312 5.344 ( -3.649 15.386 -3.756) 16.253 5.811 ( -5.488 -21.142 18.710) 28.760 5.983 ( 1.628 -8.470 6.901) 11.046 6.338 ( -1.484 -0.155 7.574) 7.720 6.447 ( 1.090 -6.944 -1.887) 7.277 7.265 ( -2.621 -8.675 8.225) 12.238 7.674 ( 3.527 6.291 -10.884) 13.057 8.838 ( -3.400 0.995 3.176) 4.757 9.033 ( 4.708 4.167 -9.708) 11.566 9.297 ( 0.848 2.946 1.704) 3.507 9.858 ( 0.003 4.137 2.401) 4.784 10.249 ( -0.454 -5.061 2.625) 5.719 10.850 ( 9.573 23.639 -28.178) 38.006 11.806 ( 7.881 28.659 -26.376) 39.739 12.809 ( -2.928 -0.793 -3.804) 4.865 13.138 ( 3.630 5.471 -6.272) 9.080 13.358 ( -7.591 -35.595 35.514) 50.851 15.232 ( -8.437 -21.516 20.798) 31.092 16.275 ( -4.002 -9.387 9.038) 13.631 17.354 ( -0.534 3.781 1.429) 4.077 18.750 ( 2.028 1.585 -2.014) 3.268 18.897 ( 1.316 -2.238 1.272) 2.891 19.040 ( 2.523 5.943 -7.588) 9.964 19.942 ( 3.289 22.379 -17.422) 28.550 ======================= Grid point 407 (203/366) ======================= q-point: (-0.36 -0.73 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.513 ( 0.931 -3.361 -7.925) 8.658 0.918 ( 0.175 -2.251 0.700) 2.364 0.993 ( 4.081 11.162 -9.901) 15.469 1.244 ( -2.501 5.055 -5.611) 7.956 1.719 ( -0.801 -4.275 8.087) 9.182 2.152 ( -3.123 -3.266 2.687) 5.257 2.307 ( 0.930 1.529 3.329) 3.779 2.868 ( -6.015 -7.596 2.013) 9.896 3.042 ( -2.202 -21.509 -3.561) 21.912 3.544 ( -3.077 -14.479 12.901) 19.635 4.613 ( -0.958 -3.395 17.426) 17.780 4.803 ( 5.412 -1.856 -5.447) 7.899 4.967 ( -4.792 21.536 1.807) 22.137 5.896 ( -8.405 6.339 18.940) 21.669 6.250 ( 1.282 -7.083 11.749) 13.778 6.449 ( 1.840 -13.469 -2.423) 13.809 6.636 ( 2.038 -12.383 -6.109) 13.957 7.375 ( -2.721 -3.217 3.834) 5.696 7.622 ( 0.741 -3.483 -5.547) 6.592 8.607 ( 1.238 20.237 -7.824) 21.733 9.062 ( 10.387 -7.339 -22.902) 26.197 9.397 ( -6.036 -9.868 14.306) 18.397 9.736 ( -1.247 9.908 8.354) 13.020 10.320 ( 11.172 23.592 -29.684) 39.529 10.428 ( 6.587 -4.322 -12.289) 14.598 11.385 ( 2.515 17.141 -16.112) 23.658 12.810 ( -3.827 -3.541 -7.115) 8.820 12.916 ( 8.800 14.617 -11.213) 20.417 14.156 ( -11.622 -41.767 44.383) 62.044 15.571 ( -11.998 -13.156 28.441) 33.555 16.348 ( -8.058 -2.519 16.685) 18.700 17.175 ( -4.881 15.587 12.999) 20.875 18.769 ( 9.099 -1.864 -16.320) 18.777 18.947 ( 3.167 -1.688 -4.991) 6.148 18.989 ( 6.649 -0.099 -13.265) 14.839 19.558 ( -0.962 16.363 -10.345) 19.383 ======================= Grid point 408 (204/366) ======================= q-point: (-0.27 -0.73 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.618 ( 2.624 -9.227 -11.462) 14.947 0.794 ( 5.009 11.000 -11.068) 16.389 0.971 ( 0.875 -2.540 -0.476) 2.728 1.135 ( -0.947 4.248 -3.567) 5.627 1.805 ( -1.713 -3.721 8.826) 9.730 2.164 ( -3.458 0.536 3.700) 5.092 2.359 ( 7.231 -2.303 4.856) 9.009 2.919 ( -10.801 -4.287 3.632) 12.175 3.482 ( 3.313 -26.494 -8.757) 28.100 3.846 ( -1.741 -17.354 9.476) 19.849 4.378 ( 6.258 20.811 -10.588) 24.174 4.551 ( -5.649 21.041 4.943) 22.340 5.135 ( -2.987 -19.626 20.185) 28.311 5.688 ( -10.063 14.715 20.797) 27.392 6.305 ( 1.265 0.803 -1.621) 2.207 6.673 ( 7.409 -5.352 -5.799) 10.824 6.831 ( -2.868 -9.399 3.410) 10.402 7.407 ( -3.816 -2.147 2.297) 4.945 7.801 ( 0.187 -17.460 -3.981) 17.909 8.172 ( 2.535 25.316 -7.839) 26.623 9.309 ( 13.461 -16.503 -29.410) 36.311 9.544 ( -0.464 8.302 0.182) 8.317 9.570 ( -5.056 -5.879 13.706) 15.748 9.835 ( 11.502 22.667 -30.102) 39.398 10.652 ( 6.094 -13.179 -6.076) 15.740 11.086 ( -0.110 14.056 -11.647) 18.255 12.706 ( 9.453 12.328 -7.509) 17.255 12.853 ( -3.674 -6.658 -9.932) 12.508 14.887 ( -11.569 -34.663 43.368) 56.710 15.535 ( -17.650 16.114 36.380) 43.528 16.507 ( -7.882 -17.316 17.022) 25.529 16.834 ( -6.182 21.613 17.442) 28.453 18.833 ( 12.543 -2.372 -23.082) 26.377 18.984 ( 8.044 -2.376 -24.504) 25.900 19.026 ( 4.801 -1.166 -0.874) 5.018 19.303 ( -3.381 7.943 -5.513) 10.243 ======================= Grid point 409 (205/366) ======================= q-point: (-0.18 0.27 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.614 ( 5.288 9.276 -10.741) 15.145 0.798 ( 3.374 -11.368 -11.559) 16.559 0.979 ( 0.132 2.575 -0.980) 2.759 1.096 ( 1.951 -0.938 -1.241) 2.495 1.865 ( -2.858 -1.742 7.833) 8.519 2.127 ( -2.144 2.029 3.761) 4.780 2.456 ( 7.879 -0.149 6.417) 10.162 2.898 ( -11.711 -0.915 3.739) 12.328 3.817 ( 3.201 9.014 -7.158) 11.947 4.096 ( 2.210 -11.343 -17.435) 20.917 4.140 ( -2.182 8.471 13.020) 15.686 4.230 ( -3.202 -8.110 1.751) 8.893 5.323 ( -8.894 16.962 21.180) 28.555 5.531 ( -3.803 -12.972 20.771) 24.783 6.261 ( 0.872 3.633 -3.673) 5.239 6.684 ( 5.268 5.619 -11.900) 14.175 6.975 ( -0.652 -6.212 10.825) 12.497 7.332 ( -9.598 9.341 5.370) 14.430 7.788 ( 4.434 14.358 -8.595) 17.311 8.198 ( 2.525 -25.267 -6.610) 26.239 9.240 ( 6.299 15.548 -13.329) 21.426 9.452 ( 4.084 14.517 -4.563) 15.756 9.748 ( -3.744 -11.036 1.997) 11.824 9.797 ( 11.517 -24.369 -28.964) 39.565 10.783 ( -2.224 12.788 -9.350) 15.997 10.952 ( 9.480 -13.562 -8.510) 18.607 12.572 ( 10.696 8.274 -3.332) 13.927 12.949 ( -3.240 -9.759 -12.388) 16.100 15.050 ( -21.012 31.288 37.169) 52.934 15.426 ( -11.829 -19.188 39.903) 45.830 16.457 ( -5.263 19.005 17.302) 26.235 16.864 ( -7.440 -20.840 16.933) 27.864 18.887 ( 12.525 -0.943 -23.962) 27.054 18.977 ( 6.511 1.121 -25.375) 26.221 19.099 ( 4.690 -1.989 0.405) 5.110 19.207 ( -2.231 -2.022 -4.620) 5.514 ======================= Grid point 410 (206/366) ======================= q-point: (-0.09 0.27 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.499 ( 4.317 3.703 -6.909) 8.949 0.919 ( -0.105 2.998 0.510) 3.042 0.999 ( 3.402 -11.287 -10.015) 15.469 1.141 ( 4.267 -1.113 -0.522) 4.440 1.859 ( -4.787 1.260 4.565) 6.734 2.093 ( 0.615 2.496 3.642) 4.458 2.500 ( 4.803 1.378 9.540) 10.769 2.835 ( -7.888 1.325 5.241) 9.563 3.396 ( -3.102 24.071 -9.965) 26.236 3.821 ( -9.292 16.173 10.109) 21.216 4.469 ( 0.790 -19.211 -4.916) 19.846 4.549 ( 2.503 -14.638 -1.893) 14.971 4.980 ( -4.720 13.736 15.559) 21.285 5.779 ( -3.187 -7.491 21.057) 22.576 6.180 ( -1.818 4.126 -0.218) 4.514 6.510 ( 2.088 12.095 -8.501) 14.931 6.995 ( -10.931 18.256 2.542) 21.430 7.093 ( 1.129 -2.480 11.575) 11.891 7.674 ( 3.488 1.136 -9.683) 10.354 8.633 ( 3.487 -20.399 -5.817) 21.497 9.033 ( 6.651 5.612 -17.294) 19.360 9.230 ( 0.187 11.946 8.775) 14.824 9.882 ( -8.019 -7.880 10.037) 15.072 10.314 ( 15.322 -28.913 -36.536) 49.047 10.497 ( -1.296 13.396 -7.595) 15.454 11.295 ( 11.422 -19.949 -14.620) 27.243 12.537 ( 11.295 3.617 0.672) 11.879 13.088 ( -2.065 -11.281 -14.006) 18.102 14.370 ( -24.454 36.993 34.507) 56.189 15.524 ( -10.136 10.880 30.214) 33.675 16.268 ( -3.522 3.767 16.827) 17.599 17.193 ( -5.571 -15.261 12.673) 20.605 18.892 ( 5.963 2.360 -18.436) 19.520 18.948 ( 5.656 -2.149 -18.107) 19.091 19.104 ( -3.622 -0.094 -1.651) 3.982 19.361 ( 10.045 -11.739 -5.320) 16.340 ======================= Grid point 415 (207/366) ======================= q-point: ( 0.36 0.36 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.846 ( -1.217 0.000 3.435) 3.644 1.058 ( -5.698 0.000 11.282) 12.639 1.207 ( -1.628 0.000 5.631) 5.862 1.576 ( 4.547 -0.000 -10.669) 11.597 1.662 ( -0.326 0.000 0.528) 0.621 1.773 ( 0.318 -0.000 -3.915) 3.928 1.971 ( -3.439 0.000 -12.761) 13.217 2.803 ( -11.635 0.000 22.388) 25.230 3.209 ( -2.792 0.000 -5.105) 5.819 3.270 ( -6.755 0.000 18.581) 19.771 3.476 ( -11.601 0.000 29.535) 31.731 4.748 ( -15.839 0.000 28.654) 32.741 5.245 ( 7.015 -0.000 -21.205) 22.335 5.441 ( 3.713 -0.000 -5.731) 6.829 5.713 ( 0.286 -0.000 -2.010) 2.030 6.499 ( 5.598 -0.000 2.290) 6.049 6.646 ( -4.056 0.000 17.281) 17.751 6.929 ( -5.472 0.000 15.404) 16.347 7.876 ( 7.060 -0.000 -8.743) 11.238 8.297 ( -5.058 0.000 13.215) 14.150 9.522 ( 6.352 -0.000 -16.648) 17.819 9.773 ( 2.925 -0.000 -7.767) 8.299 9.927 ( -3.826 0.000 9.618) 10.351 10.733 ( -8.099 0.000 23.667) 25.014 10.941 ( -17.616 0.000 35.453) 39.588 11.402 ( 3.566 -0.000 -10.331) 10.929 12.866 ( -2.074 0.000 0.612) 2.162 13.443 ( 4.678 -0.000 -7.315) 8.683 13.743 ( 10.539 -0.000 -21.883) 24.289 14.501 ( 8.560 -0.000 -24.610) 26.056 15.350 ( 0.636 -0.000 0.095) 0.643 17.090 ( 6.680 -0.000 -17.191) 18.443 18.823 ( -1.649 0.000 0.965) 1.911 18.916 ( -10.210 0.000 27.526) 29.359 19.375 ( -5.392 0.000 12.269) 13.402 20.840 ( 14.189 -0.000 -36.927) 39.559 ======================= Grid point 416 (208/366) ======================= q-point: (-0.55 -0.64 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.847 ( -1.855 0.770 4.077) 4.545 0.893 ( -4.027 10.721 8.672) 14.365 1.340 ( -4.342 -8.769 5.445) 11.198 1.541 ( 0.128 6.653 -5.600) 8.697 1.559 ( 3.719 3.716 -6.662) 8.487 1.862 ( -2.054 -7.216 -2.551) 7.925 2.004 ( -1.426 -8.481 -9.633) 12.913 2.741 ( -12.936 4.915 24.235) 27.908 3.062 ( -7.865 8.432 -4.572) 12.405 3.253 ( -5.532 2.022 18.616) 19.526 3.587 ( -10.026 -11.581 27.340) 31.339 4.890 ( -12.733 -17.635 25.956) 33.865 5.298 ( 6.176 -2.313 -14.807) 16.210 5.435 ( 6.366 -1.257 -12.872) 14.416 5.745 ( 1.125 -3.245 -0.867) 3.542 6.486 ( 1.305 4.447 6.434) 7.929 6.614 ( -2.131 8.788 18.909) 20.960 6.948 ( -3.940 -4.926 9.563) 11.456 7.882 ( 7.305 2.837 -10.441) 13.055 8.419 ( -5.065 -12.109 14.793) 19.777 9.458 ( 4.590 7.491 -12.516) 15.292 9.738 ( -2.220 17.225 7.157) 18.784 9.803 ( 1.862 -1.979 -6.715) 7.244 10.378 ( -5.689 13.544 17.734) 23.028 11.298 ( -3.289 1.271 -8.752) 9.435 11.638 ( -8.409 -40.704 34.398) 53.952 12.821 ( -4.130 2.434 -2.265) 5.302 13.136 ( 7.986 30.667 -18.570) 36.730 13.671 ( 12.476 9.440 -20.297) 25.627 14.594 ( 0.451 -10.952 -3.948) 11.651 15.591 ( 2.015 -21.959 -4.352) 22.476 17.169 ( 6.417 -7.893 -16.301) 19.214 18.833 ( 0.823 -0.883 2.209) 2.517 18.889 ( -8.340 3.374 24.403) 26.009 19.316 ( -4.681 5.860 10.095) 12.577 20.690 ( 8.846 14.111 -35.336) 39.064 ======================= Grid point 417 (209/366) ======================= q-point: (-0.45 -0.64 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.673 ( -3.469 10.486 5.636) 12.400 0.863 ( -1.478 -0.739 3.447) 3.823 1.370 ( -9.794 0.546 -4.668) 10.864 1.378 ( 1.928 9.597 -5.751) 11.353 1.586 ( 5.748 -3.223 2.746) 7.139 1.966 ( -3.698 -7.000 -1.920) 8.146 2.168 ( 0.400 -11.633 -7.400) 13.793 2.608 ( -13.608 4.700 22.972) 27.110 2.860 ( -9.797 4.498 -3.477) 11.327 3.262 ( -3.099 -1.426 19.877) 20.168 3.885 ( -7.065 -19.521 25.623) 32.977 5.209 ( 5.907 2.498 -3.556) 7.333 5.285 ( -8.417 -13.666 9.202) 18.501 5.523 ( 3.585 -6.040 -8.858) 11.305 5.864 ( 4.757 -9.171 -1.575) 10.450 6.418 ( -2.766 5.358 11.235) 12.751 6.463 ( -0.121 7.847 14.450) 16.444 7.094 ( -2.882 -9.736 6.235) 11.915 7.805 ( 5.665 7.191 -11.192) 14.459 8.670 ( -5.964 -13.767 13.003) 19.854 9.234 ( 1.046 15.255 -1.147) 15.333 9.457 ( 2.914 11.999 -6.472) 13.941 9.865 ( 2.924 -3.490 -5.772) 7.352 10.247 ( -3.198 3.920 11.818) 12.856 11.135 ( 1.312 11.136 -15.935) 19.485 12.318 ( -0.260 4.964 -7.853) 9.294 12.605 ( 0.951 -11.851 16.696) 20.496 12.779 ( -6.801 1.029 -1.435) 7.026 13.494 ( 13.227 13.677 -15.522) 24.555 14.859 ( -5.689 -18.679 12.470) 23.169 15.995 ( -0.032 -20.482 -1.452) 20.533 17.318 ( 4.503 -6.772 -10.777) 13.502 18.820 ( -3.524 4.168 13.973) 15.001 18.883 ( 3.156 -1.499 3.415) 4.886 19.174 ( -2.041 8.591 3.315) 9.432 20.309 ( 2.394 21.737 -28.265) 35.737 ======================= Grid point 418 (210/366) ======================= q-point: (-0.36 -0.64 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.513 ( -1.942 5.202 -0.926) 5.629 0.883 ( -0.915 -1.637 2.281) 2.953 1.192 ( 2.724 10.681 -7.895) 13.559 1.261 ( -7.775 2.243 -5.317) 9.683 1.690 ( 4.027 -2.779 6.215) 7.910 2.047 ( -4.662 -5.582 0.824) 7.319 2.320 ( 1.179 -3.420 0.207) 3.623 2.630 ( -4.968 -12.273 8.809) 15.903 2.778 ( -11.222 -3.640 -0.212) 11.799 3.382 ( -0.715 -7.457 19.858) 21.225 4.296 ( -5.527 -22.650 24.939) 34.140 5.052 ( 10.439 13.825 -12.163) 21.167 5.231 ( -8.162 11.606 -6.338) 15.540 5.833 ( -4.891 -16.700 15.190) 23.099 6.091 ( 7.052 -11.012 10.377) 16.693 6.356 ( -1.151 1.474 5.646) 5.948 6.463 ( 1.299 -5.299 1.599) 5.685 7.251 ( -4.682 -8.232 5.067) 10.741 7.666 ( 3.358 7.337 -10.060) 12.896 8.805 ( -3.404 1.063 1.865) 4.025 9.047 ( 5.019 4.481 -9.651) 11.765 9.306 ( -0.804 2.917 1.308) 3.297 9.887 ( 1.667 3.741 4.222) 5.882 10.262 ( 0.171 -5.300 2.944) 6.065 10.820 ( 7.681 21.661 -27.204) 35.613 11.763 ( 7.009 29.239 -27.178) 40.530 12.707 ( -8.277 -1.546 -4.995) 9.791 13.163 ( 2.773 0.474 -1.001) 2.986 13.498 ( 1.627 -28.555 31.959) 42.888 15.225 ( -8.808 -21.566 20.450) 30.998 16.258 ( -5.087 -8.970 8.154) 13.147 17.356 ( -0.326 3.847 1.714) 4.224 18.784 ( 4.343 1.283 -1.988) 4.946 18.944 ( 4.043 -0.999 2.014) 4.626 19.036 ( 2.800 5.118 -6.933) 9.061 19.851 ( -2.418 20.876 -19.149) 28.431 ======================= Grid point 419 (211/366) ======================= q-point: (-0.27 -0.64 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.481 ( 0.988 -3.630 -8.587) 9.375 0.924 ( 0.018 -2.733 0.881) 2.871 0.996 ( 4.069 10.935 -9.750) 15.205 1.170 ( -4.068 2.201 -4.227) 6.266 1.777 ( 2.535 -2.422 8.749) 9.425 2.115 ( -4.005 -4.180 1.796) 6.061 2.376 ( 4.846 -2.094 7.085) 8.835 2.764 ( -11.066 -4.956 1.161) 12.181 3.009 ( 1.318 -24.945 -3.475) 25.220 3.609 ( 0.120 -12.097 17.863) 21.574 4.684 ( -3.420 -7.560 19.326) 21.032 4.788 ( 0.717 14.755 -16.581) 22.207 4.940 ( -1.029 7.257 4.635) 8.672 5.878 ( -8.968 7.050 18.198) 21.478 6.328 ( 2.570 0.273 4.600) 5.276 6.502 ( 5.218 -18.312 7.418) 20.435 6.634 ( 2.039 -10.497 -5.709) 12.122 7.333 ( -5.123 -3.659 1.110) 6.393 7.600 ( 0.478 -2.871 -5.437) 6.167 8.584 ( 1.585 19.480 -7.973) 21.108 9.082 ( 10.612 -7.667 -22.882) 26.362 9.372 ( -7.941 -8.893 12.010) 16.923 9.782 ( 0.066 10.091 11.513) 15.310 10.314 ( 12.120 25.654 -32.226) 42.936 10.459 ( 6.386 -8.191 -9.262) 13.916 11.323 ( 1.332 17.505 -16.675) 24.212 12.688 ( -7.754 -4.414 -8.132) 12.072 12.994 ( 10.573 13.682 -9.465) 19.712 14.262 ( -7.494 -39.241 44.097) 59.503 15.554 ( -12.672 -12.225 28.314) 33.342 16.318 ( -8.845 -2.801 15.546) 18.104 17.180 ( -4.670 15.457 13.145) 20.821 18.819 ( 10.837 -1.677 -16.702) 19.980 18.948 ( 5.628 0.043 -16.313) 17.257 19.038 ( 5.511 -1.062 -0.316) 5.622 19.465 ( -4.122 14.606 -11.458) 19.016 ======================= Grid point 420 (212/366) ======================= q-point: (-0.18 -0.64 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.596 ( 3.303 -9.684 -11.836) 15.645 0.803 ( 5.000 10.752 -10.842) 16.067 0.980 ( 0.797 -2.400 -0.533) 2.585 1.104 ( -0.936 1.767 -2.743) 3.395 1.853 ( 1.056 -1.540 10.136) 10.306 2.133 ( -3.642 -0.399 3.035) 4.758 2.502 ( 7.955 -2.977 7.674) 11.447 2.767 ( -12.519 -4.253 0.864) 13.250 3.501 ( 6.189 -27.317 -7.297) 28.944 3.902 ( 0.193 -15.754 14.337) 21.302 4.343 ( -1.210 23.710 -16.093) 28.682 4.494 ( -4.384 18.497 2.371) 19.157 5.222 ( -1.877 -19.334 22.569) 29.778 5.652 ( -10.896 15.058 19.219) 26.736 6.324 ( 3.046 2.325 -2.390) 4.516 6.711 ( 4.328 -2.395 -13.511) 14.388 6.870 ( 2.441 -10.783 15.384) 18.945 7.340 ( -6.883 -0.766 0.400) 6.937 7.780 ( 0.372 -18.449 -5.161) 19.161 8.167 ( 3.091 24.214 -8.158) 25.738 9.335 ( 14.158 -17.502 -31.061) 38.361 9.499 ( -7.125 -4.239 5.860) 10.152 9.617 ( 1.211 8.305 9.369) 12.578 9.829 ( 10.708 22.761 -29.043) 38.422 10.708 ( 6.761 -13.176 -6.085) 16.011 11.018 ( -0.549 13.164 -11.700) 17.621 12.720 ( -5.455 -6.409 -10.346) 13.337 12.822 ( 10.745 10.122 -6.782) 16.245 14.973 ( -9.948 -32.794 43.310) 55.228 15.482 ( -18.514 18.091 36.209) 44.510 16.487 ( -8.132 -18.154 16.483) 25.834 16.845 ( -5.962 21.265 17.631) 28.259 18.880 ( 12.214 -1.995 -24.353) 27.317 18.958 ( 8.419 -1.136 -25.431) 26.813 19.097 ( 4.506 -1.541 1.410) 4.967 19.221 ( -3.548 6.899 -5.707) 9.631 ======================= Grid point 421 (213/366) ======================= q-point: (-0.09 0.36 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.629 ( 5.220 8.925 -10.393) 14.660 0.785 ( 3.881 -11.551 -11.755) 16.931 0.974 ( -0.071 2.632 -0.889) 2.779 1.120 ( 2.686 -3.075 -1.604) 4.386 1.876 ( -2.280 1.691 8.184) 8.662 2.124 ( -1.276 0.167 4.307) 4.495 2.561 ( -2.317 0.703 6.788) 7.207 2.779 ( -3.607 -2.491 3.241) 5.451 3.792 ( -0.763 22.358 -11.574) 25.187 4.036 ( 2.944 -18.944 -13.373) 23.375 4.123 ( -5.347 15.963 2.731) 17.054 4.268 ( 1.997 -18.784 12.173) 22.472 5.300 ( -10.532 19.223 19.368) 29.250 5.600 ( -3.547 -15.490 22.597) 27.625 6.270 ( 2.586 5.130 -2.139) 6.131 6.668 ( 2.478 5.353 -13.333) 14.579 7.066 ( 4.067 -4.712 13.637) 14.990 7.209 ( -11.200 10.259 2.295) 15.360 7.800 ( 4.047 14.439 -8.383) 17.179 8.195 ( 2.443 -26.251 -6.988) 27.275 9.255 ( 9.218 17.042 -21.162) 28.692 9.491 ( 1.222 12.960 5.724) 14.221 9.694 ( -6.531 -9.337 4.759) 12.349 9.805 ( 14.261 -25.604 -34.405) 45.196 10.705 ( -2.149 12.637 -8.588) 15.429 11.035 ( 9.516 -14.231 -9.015) 19.348 12.705 ( 10.697 6.284 -3.333) 12.846 12.835 ( -3.012 -9.722 -12.744) 16.309 14.959 ( -21.611 33.588 37.983) 55.117 15.483 ( -11.259 -17.330 39.857) 44.896 16.480 ( -5.207 18.128 17.782) 25.921 16.852 ( -7.550 -21.176 16.791) 28.060 18.912 ( 7.224 -0.810 -25.754) 26.760 18.941 ( 11.347 2.393 -25.354) 27.880 19.080 ( -4.754 1.508 -2.177) 5.441 19.236 ( 6.798 -6.840 -0.992) 9.694 ======================= Grid point 427 (214/366) ======================= q-point: (-0.55 -0.55 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.847 ( -1.651 0.000 4.155) 4.471 1.035 ( -6.256 0.000 10.614) 12.321 1.209 ( -2.617 0.000 5.644) 6.221 1.545 ( -1.413 0.000 -10.436) 10.531 1.649 ( -1.391 0.000 -0.757) 1.583 1.759 ( 0.794 -0.000 -3.793) 3.875 1.887 ( -0.832 0.000 -7.269) 7.316 2.772 ( -10.587 0.000 19.357) 22.063 3.101 ( -8.092 0.000 0.666) 8.119 3.280 ( -7.324 0.000 17.257) 18.747 3.458 ( -13.976 0.000 29.100) 32.282 4.701 ( -13.332 0.000 27.893) 30.916 5.236 ( 8.670 -0.000 -21.997) 23.644 5.463 ( 3.767 -0.000 -5.114) 6.351 5.734 ( 3.409 -0.000 -0.275) 3.420 6.580 ( 5.229 -0.000 -0.012) 5.229 6.686 ( -3.117 0.000 16.619) 16.908 6.929 ( -6.393 0.000 14.796) 16.118 7.933 ( 8.255 -0.000 -9.023) 12.230 8.311 ( -3.698 0.000 14.133) 14.609 9.517 ( 5.946 -0.000 -16.680) 17.708 9.759 ( 1.364 -0.000 -8.460) 8.569 9.934 ( -3.018 0.000 10.861) 11.272 10.748 ( -8.236 0.000 23.662) 25.054 10.919 ( -12.524 0.000 32.021) 34.383 11.405 ( 3.467 -0.000 -5.262) 6.301 12.793 ( -8.430 0.000 -0.947) 8.483 13.465 ( 3.702 -0.000 -6.082) 7.120 13.799 ( 14.389 -0.000 -20.803) 25.294 14.478 ( 7.857 -0.000 -25.660) 26.836 15.359 ( 0.704 -0.000 -0.156) 0.721 17.090 ( 6.747 -0.000 -17.173) 18.451 18.846 ( 3.318 -0.000 2.881) 4.395 18.931 ( -9.145 0.000 27.591) 29.067 19.365 ( -5.601 0.000 12.127) 13.358 20.771 ( 5.593 -0.000 -40.357) 40.743 ======================= Grid point 428 (215/366) ======================= q-point: (-0.45 -0.55 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.841 ( -2.678 2.314 5.283) 6.359 0.885 ( -3.655 9.038 8.074) 12.658 1.269 ( -8.818 -3.195 0.568) 9.396 1.511 ( -0.815 2.008 -3.636) 4.233 1.569 ( 1.333 1.760 -2.866) 3.617 1.816 ( -1.284 -5.742 -4.169) 7.211 1.970 ( 0.408 -9.085 -1.825) 9.275 2.691 ( -12.614 5.611 20.341) 24.583 2.910 ( -12.061 10.653 0.889) 16.117 3.275 ( -6.097 -0.232 19.156) 20.104 3.600 ( -8.978 -14.290 26.780) 31.654 4.867 ( -10.630 -18.266 25.331) 32.990 5.303 ( 7.310 -4.214 -18.257) 20.113 5.465 ( 6.417 0.151 -8.807) 10.897 5.773 ( 3.298 -2.448 -0.468) 4.133 6.529 ( 0.574 5.963 5.230) 7.952 6.688 ( -1.301 7.922 17.588) 19.334 6.939 ( -4.103 -5.528 7.369) 10.084 7.929 ( 7.613 4.329 -10.245) 13.478 8.433 ( -4.537 -10.980 14.601) 18.824 9.451 ( 4.343 7.209 -12.865) 15.374 9.753 ( -1.495 16.787 8.091) 18.695 9.787 ( 0.968 -2.373 -6.580) 7.062 10.405 ( -4.600 13.640 18.580) 23.504 11.195 ( -5.673 -1.157 -5.903) 8.268 11.741 ( -2.432 -37.362 31.417) 48.876 12.711 ( -10.092 1.338 -2.226) 10.421 13.143 ( 7.750 31.393 -19.024) 37.517 13.760 ( 15.713 9.125 -17.786) 25.427 14.575 ( 0.349 -11.603 -4.822) 12.570 15.593 ( 1.755 -21.409 -4.593) 21.966 17.171 ( 6.617 -8.047 -16.213) 19.272 18.886 ( 2.424 0.350 7.247) 7.650 18.919 ( -4.364 1.996 20.612) 21.163 19.305 ( -4.746 5.820 9.946) 12.463 20.558 ( 0.089 13.542 -38.139) 40.472 ======================= Grid point 429 (216/366) ======================= q-point: (-0.36 -0.55 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.654 ( -3.706 11.108 5.644) 12.999 0.860 ( -1.723 -0.717 3.753) 4.191 1.198 ( -12.116 0.340 -3.775) 12.695 1.374 ( 1.769 9.404 -5.510) 11.042 1.664 ( 3.171 -5.527 3.683) 7.360 1.910 ( -3.159 -6.362 -1.067) 7.183 2.169 ( 2.501 -11.998 -0.112) 12.256 2.555 ( -13.220 4.228 25.606) 29.126 2.687 ( -11.932 2.909 -5.326) 13.387 3.331 ( -2.870 -3.989 20.926) 21.495 3.938 ( -4.887 -20.127 24.881) 32.373 5.194 ( -7.691 -10.863 4.610) 14.086 5.288 ( 8.202 6.684 -9.928) 14.509 5.536 ( 1.382 -9.836 1.639) 10.067 5.932 ( 7.020 -12.774 -3.491) 14.988 6.436 ( -2.114 5.513 8.085) 10.012 6.542 ( -0.601 9.256 16.901) 19.279 7.076 ( -3.520 -8.904 3.555) 10.213 7.822 ( 5.288 8.884 -10.655) 14.847 8.654 ( -6.054 -12.025 11.654) 17.807 9.242 ( 1.536 14.152 -2.542) 14.460 9.463 ( 2.204 12.928 -4.262) 13.789 9.877 ( 3.376 -5.704 -5.774) 8.790 10.272 ( -2.964 4.731 13.277) 14.403 11.057 ( -0.590 9.303 -14.749) 17.447 12.282 ( 3.683 14.495 -15.448) 21.502 12.644 ( -7.836 6.705 -4.369) 11.200 12.722 ( -1.826 -23.612 22.901) 32.944 13.625 ( 16.908 12.136 -11.108) 23.591 14.847 ( -5.671 -18.915 11.948) 23.079 15.982 ( -0.500 -19.783 -2.043) 19.895 17.324 ( 4.700 -6.778 -10.445) 13.309 18.854 ( -1.898 3.603 12.876) 13.504 18.970 ( 6.054 -1.042 4.961) 7.896 19.164 ( -1.931 8.478 3.048) 9.214 20.136 ( -5.324 19.769 -29.675) 36.052 ======================= Grid point 430 (217/366) ======================= q-point: (-0.27 -0.55 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.482 ( -1.785 5.604 -1.017) 5.969 0.881 ( -1.263 -1.868 2.327) 3.240 1.120 ( -8.050 -0.234 -2.727) 8.502 1.197 ( 2.710 9.555 -7.630) 12.525 1.777 ( 3.779 -3.130 6.111) 7.837 1.991 ( -4.662 -6.001 1.997) 7.857 2.370 ( 2.859 -4.683 7.446) 9.249 2.606 ( -12.755 -5.412 -1.162) 13.905 2.632 ( -1.928 -13.904 9.134) 16.747 3.490 ( 0.270 -8.138 21.387) 22.884 4.360 ( -4.055 -22.290 23.652) 32.752 5.070 ( -6.476 12.825 -9.934) 17.467 5.127 ( 7.566 12.687 -12.081) 19.083 5.837 ( -5.453 -12.633 12.988) 18.921 6.250 ( 7.936 -15.578 6.797) 18.758 6.372 ( 0.561 1.541 4.337) 4.637 6.499 ( 0.535 -1.878 8.181) 8.411 7.198 ( -5.767 -6.979 2.280) 9.337 7.659 ( 3.207 8.164 -9.309) 12.791 8.769 ( -3.238 0.474 1.582) 3.635 9.064 ( 5.111 4.513 -9.866) 11.993 9.291 ( -1.834 4.435 0.256) 4.806 9.941 ( 1.963 2.752 6.223) 7.082 10.284 ( 0.754 -5.983 3.079) 6.771 10.773 ( 6.220 19.215 -25.519) 32.544 11.714 ( 7.487 30.389 -28.181) 42.116 12.550 ( -10.547 -1.829 -4.983) 11.807 13.198 ( 1.864 -3.161 2.177) 4.267 13.723 ( 7.602 -22.542 28.611) 37.209 15.212 ( -8.888 -21.466 20.197) 30.785 16.227 ( -5.508 -8.289 7.277) 12.329 17.363 ( -0.260 3.972 2.086) 4.494 18.839 ( 5.396 0.671 -2.712) 6.076 18.996 ( 3.252 5.013 -4.463) 7.459 19.064 ( 5.047 0.241 0.150) 5.055 19.683 ( -7.036 17.507 -19.407) 27.068 ======================= Grid point 431 (218/366) ======================= q-point: (-0.18 -0.55 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.455 ( 2.076 -4.101 -8.839) 9.963 0.926 ( -0.461 -3.283 0.816) 3.415 1.000 ( 3.902 10.231 -9.296) 14.364 1.103 ( -2.963 0.048 -2.671) 3.989 1.867 ( 3.436 -1.963 8.872) 9.715 2.071 ( -3.566 -4.591 1.805) 6.087 2.497 ( 5.194 -4.887 10.963) 13.079 2.594 ( -13.102 -5.117 -1.144) 14.112 3.053 ( 6.430 -25.411 -0.002) 26.212 3.719 ( 0.878 -10.461 19.859) 22.463 4.653 ( -6.334 10.267 -6.586) 13.744 4.753 ( -0.236 9.359 5.073) 10.648 4.958 ( -0.099 -4.954 3.063) 5.825 5.844 ( -9.686 7.721 16.623) 20.731 6.359 ( 1.604 0.044 -1.872) 2.466 6.605 ( 4.502 -8.498 -11.827) 15.243 6.682 ( 5.049 -16.472 21.178) 27.301 7.257 ( -6.823 -3.777 1.035) 7.867 7.583 ( 1.799 -1.865 -6.489) 6.987 8.568 ( 2.220 18.709 -7.770) 20.379 9.104 ( 10.624 -7.982 -23.130) 26.675 9.314 ( -9.072 -7.728 9.991) 15.552 9.848 ( -0.564 9.695 14.144) 17.157 10.305 ( 12.845 27.065 -34.642) 45.799 10.501 ( 6.024 -11.815 -6.426) 14.737 11.253 ( 1.697 18.305 -17.116) 25.118 12.532 ( -8.636 -5.282 -7.877) 12.827 13.089 ( 10.172 11.876 -8.023) 17.575 14.407 ( -5.112 -35.302 42.026) 55.123 15.530 ( -12.938 -10.937 28.464) 33.124 16.278 ( -8.770 -3.271 14.510) 17.267 17.187 ( -4.551 15.296 13.225) 20.726 18.872 ( 9.997 -0.514 -17.710) 20.343 18.938 ( 6.412 0.322 -16.766) 17.953 19.111 ( 3.720 -0.495 1.332) 3.983 19.345 ( -3.578 11.156 -11.398) 16.346 ======================= Grid point 432 (219/366) ======================= q-point: (-0.09 -0.55 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.584 ( 4.249 -9.923 -11.937) 16.093 0.814 ( 4.893 10.507 -10.615) 15.717 0.985 ( 0.485 -2.045 -0.737) 2.227 1.084 ( -0.221 -0.702 -2.027) 2.157 1.922 ( 0.705 0.894 9.487) 9.555 2.109 ( -2.044 -1.683 3.749) 4.590 2.514 ( -12.503 -0.555 1.157) 12.568 2.733 ( 7.280 -7.128 7.546) 12.678 3.577 ( 9.548 -26.581 -4.233) 28.559 3.985 ( -0.242 -13.909 15.759) 21.020 4.212 ( -4.608 23.683 -14.758) 28.283 4.451 ( -2.627 19.640 -2.158) 19.932 5.303 ( -3.811 -20.264 21.788) 29.998 5.598 ( -11.383 15.749 17.400) 26.083 6.355 ( 3.057 2.069 -2.392) 4.398 6.670 ( 1.454 -1.610 -14.162) 14.327 7.024 ( 5.876 -9.443 17.357) 20.614 7.241 ( -7.547 1.181 0.851) 7.686 7.761 ( 1.493 -18.860 -6.380) 19.966 8.169 ( 3.477 23.414 -7.981) 24.980 9.360 ( 14.175 -18.321 -32.746) 40.111 9.427 ( -8.327 -6.361 7.246) 12.740 9.684 ( 2.331 11.676 6.101) 13.379 9.819 ( 9.532 22.400 -25.949) 35.580 10.761 ( 5.730 -10.331 -6.200) 13.342 10.958 ( 0.979 9.661 -11.292) 14.893 12.585 ( -5.596 -8.612 -10.346) 14.578 12.938 ( 10.719 10.122 -6.282) 16.025 15.065 ( -10.155 -30.344 42.206) 52.964 15.426 ( -18.111 19.777 36.525) 45.312 16.464 ( -7.937 -19.025 16.121) 26.170 16.858 ( -5.980 20.907 17.683) 28.028 18.880 ( 7.940 -0.353 -26.035) 27.221 18.966 ( 10.727 -1.093 -21.649) 24.185 19.092 ( -3.317 3.187 -4.734) 6.600 19.218 ( 5.417 0.713 -1.593) 5.691 ======================= Grid point 439 (220/366) ======================= q-point: (-0.45 -0.45 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.845 ( -2.138 0.000 4.927) 5.371 1.001 ( -6.570 0.000 8.259) 10.553 1.195 ( -4.092 0.000 6.073) 7.323 1.430 ( -8.719 0.000 -6.048) 10.611 1.624 ( -1.160 0.000 -1.487) 1.886 1.754 ( 1.245 -0.000 -3.673) 3.879 1.875 ( 1.398 -0.000 0.740) 1.582 2.684 ( -11.543 0.000 3.219) 11.984 3.039 ( -8.047 0.000 15.144) 17.149 3.276 ( -6.421 0.000 20.599) 21.576 3.411 ( -15.537 0.000 28.702) 32.638 4.683 ( -11.141 0.000 28.308) 30.421 5.247 ( 10.189 -0.000 -22.123) 24.356 5.484 ( 3.721 -0.000 -6.297) 7.314 5.793 ( 4.618 -0.000 1.570) 4.878 6.633 ( 3.987 -0.000 -3.777) 5.492 6.741 ( -1.010 0.000 14.918) 14.952 6.909 ( -7.622 0.000 12.864) 14.952 7.996 ( 7.745 -0.000 -8.564) 11.546 8.344 ( -2.709 0.000 14.491) 14.742 9.508 ( 5.712 -0.000 -16.558) 17.515 9.723 ( 0.224 -0.000 -9.013) 9.016 9.959 ( -2.639 0.000 12.524) 12.799 10.760 ( -8.597 0.000 23.669) 25.182 10.930 ( -7.176 0.000 21.689) 22.845 11.456 ( 4.529 -0.000 5.728) 7.303 12.641 ( -12.925 0.000 -0.797) 12.950 13.476 ( 2.763 -0.000 -6.089) 6.687 13.910 ( 17.349 -0.000 -17.742) 24.814 14.446 ( 8.274 -0.000 -27.099) 28.334 15.367 ( 0.781 -0.000 -0.466) 0.910 17.090 ( 6.802 -0.000 -17.185) 18.482 18.935 ( 6.795 -0.000 4.099) 7.936 18.959 ( -7.966 0.000 26.638) 27.804 19.353 ( -5.553 0.000 12.018) 13.239 20.563 ( -4.068 0.000 -42.703) 42.897 ======================= Grid point 440 (221/366) ======================= q-point: (-0.36 -0.45 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.832 ( -3.094 3.516 6.337) 7.879 0.881 ( -2.979 7.418 7.520) 10.975 1.111 ( -13.659 1.959 -2.327) 13.994 1.480 ( -2.497 -3.590 0.425) 4.394 1.566 ( -0.317 -0.196 -0.359) 0.517 1.792 ( 0.140 -4.429 -2.434) 5.055 1.992 ( 1.778 -9.260 4.735) 10.551 2.596 ( -10.408 1.410 1.464) 10.604 2.780 ( -14.894 17.420 20.293) 30.612 3.293 ( -7.022 -2.326 21.067) 22.328 3.634 ( -6.293 -17.720 25.440) 31.635 4.874 ( -8.002 -18.111 24.925) 31.833 5.303 ( 7.317 -3.144 -18.943) 20.549 5.507 ( 6.055 -1.435 -7.500) 9.745 5.824 ( 4.418 -1.397 -0.137) 4.635 6.555 ( 0.322 6.689 2.095) 7.017 6.755 ( -2.470 7.936 16.447) 18.427 6.917 ( -3.308 -6.831 4.129) 8.640 7.972 ( 6.364 5.767 -9.602) 12.883 8.450 ( -4.130 -8.942 14.138) 17.230 9.441 ( 4.312 6.958 -13.112) 15.457 9.758 ( 1.441 -5.768 -8.819) 10.636 9.785 ( -2.181 18.800 11.594) 22.195 10.446 ( -4.193 13.942 19.255) 24.139 11.094 ( -4.605 -0.550 -5.640) 7.302 11.895 ( 1.423 -35.368 29.065) 45.800 12.543 ( -13.065 0.191 -0.653) 13.083 13.143 ( 7.283 31.439 -19.508) 37.709 13.906 ( 18.604 8.456 -14.083) 24.819 14.555 ( 0.928 -12.251 -5.774) 13.576 15.591 ( 1.649 -20.581 -4.866) 21.212 17.176 ( 6.714 -8.354 -16.161) 19.392 18.940 ( -4.649 3.191 20.204) 20.976 19.009 ( 6.108 -0.969 6.696) 9.115 19.294 ( -4.560 5.779 9.829) 12.280 20.292 ( -9.434 12.084 -38.640) 41.570 ======================= Grid point 441 (222/366) ======================= q-point: (-0.27 -0.45 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.636 ( -3.423 11.986 6.026) 13.845 0.855 ( -2.172 -0.540 3.590) 4.230 1.018 ( -12.174 -2.237 -0.938) 12.413 1.368 ( 1.581 9.035 -5.217) 10.552 1.707 ( -0.129 -8.318 5.209) 9.815 1.873 ( -2.523 -4.812 1.540) 5.647 2.234 ( 4.761 -13.482 6.187) 15.579 2.493 ( -13.726 4.396 3.967) 14.948 2.534 ( -8.989 0.754 17.734) 19.896 3.399 ( -3.680 -7.329 21.461) 22.975 4.009 ( -3.705 -20.470 23.194) 31.157 5.115 ( -3.730 -1.063 -4.234) 5.742 5.336 ( 5.947 1.824 -9.183) 11.092 5.576 ( 0.594 -9.032 7.674) 11.867 6.008 ( 7.186 -15.636 -4.222) 17.719 6.445 ( -1.870 5.556 5.484) 8.027 6.617 ( -1.914 8.164 16.886) 18.853 7.043 ( -2.984 -7.221 1.384) 7.935 7.831 ( 4.193 10.119 -10.062) 14.873 8.632 ( -5.963 -10.128 10.794) 15.958 9.248 ( 1.936 12.946 -4.257) 13.764 9.471 ( 1.440 14.730 -2.103) 14.949 9.893 ( 3.457 -8.551 -5.707) 10.846 10.304 ( -3.354 5.589 14.658) 16.042 10.974 ( -0.371 8.034 -13.507) 15.720 12.242 ( 2.924 18.025 -18.161) 25.754 12.513 ( -5.105 10.416 -7.595) 13.865 12.823 ( -1.950 -25.333 22.681) 34.058 13.829 ( 19.693 9.304 -5.651) 22.501 14.834 ( -5.305 -19.007 11.505) 22.843 15.962 ( -0.576 -18.871 -2.556) 19.052 17.334 ( 4.672 -6.810 -10.121) 13.063 18.901 ( -0.684 3.081 11.250) 11.684 19.082 ( 6.274 -0.324 4.745) 7.872 19.155 ( -1.646 8.310 2.674) 8.884 19.865 ( -11.917 15.807 -27.706) 34.051 ======================= Grid point 442 (223/366) ======================= q-point: (-0.18 -0.45 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.460 ( -0.743 5.745 -0.607) 5.825 0.869 ( -2.395 -2.206 1.985) 3.813 1.021 ( -5.222 -3.892 0.531) 6.535 1.196 ( 2.941 9.763 -7.577) 12.703 1.846 ( 1.084 -5.161 6.199) 8.138 1.951 ( -3.027 -5.983 3.867) 7.741 2.418 ( -10.375 -3.938 2.979) 11.490 2.475 ( 0.902 -4.023 9.548) 10.401 2.689 ( 2.903 -19.534 9.724) 22.013 3.602 ( -0.689 -9.809 21.250) 23.415 4.431 ( -3.528 -21.803 22.052) 31.210 4.925 ( -6.296 12.444 -9.881) 17.092 5.161 ( 7.262 15.732 -15.552) 23.283 5.824 ( -6.152 -9.178 11.482) 15.935 6.311 ( 0.070 -7.099 -0.267) 7.104 6.433 ( 4.651 -8.322 -2.193) 9.782 6.588 ( 2.016 -2.289 20.749) 20.972 7.130 ( -5.396 -5.248 1.176) 7.619 7.656 ( 3.551 8.194 -8.810) 12.544 8.735 ( -3.246 -0.630 2.266) 4.009 9.079 ( 4.968 4.280 -10.442) 12.331 9.262 ( -2.072 7.031 -1.048) 7.405 9.998 ( 0.861 1.819 7.872) 8.125 10.312 ( 0.992 -7.140 2.775) 7.724 10.724 ( 5.985 17.223 -23.676) 29.883 11.672 ( 8.633 31.504 -28.935) 43.638 12.390 ( -9.206 -1.519 -3.918) 10.120 13.233 ( 0.977 -5.486 3.677) 6.676 13.980 ( 9.068 -17.197 24.405) 31.202 15.200 ( -8.705 -21.235 20.090) 30.501 16.191 ( -5.224 -7.564 6.684) 11.366 17.371 ( -0.322 4.075 2.377) 4.728 18.896 ( 5.449 0.477 -3.386) 6.433 19.000 ( 2.634 6.787 -7.434) 10.405 19.134 ( 2.786 0.216 1.282) 3.075 19.485 ( -6.825 11.690 -16.147) 21.070 ======================= Grid point 443 (224/366) ======================= q-point: (-0.09 -0.45 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.445 ( 3.212 -4.425 -8.700) 10.276 0.920 ( -0.933 -4.136 0.685) 4.295 1.005 ( 3.864 9.323 -8.605) 13.262 1.065 ( -1.028 -0.480 -1.676) 2.024 1.942 ( 0.544 -2.486 7.263) 7.696 2.053 ( -0.640 -4.718 3.725) 6.046 2.402 ( -11.979 -2.312 -2.285) 12.412 2.642 ( 4.928 -9.482 13.698) 17.373 3.170 ( 9.240 -25.469 3.177) 27.279 3.827 ( -0.571 -9.522 19.362) 21.584 4.533 ( -3.728 18.211 -10.696) 21.446 4.766 ( -1.336 12.324 2.577) 12.661 4.963 ( -2.559 -13.933 5.821) 15.316 5.793 ( -10.022 8.348 14.566) 19.552 6.359 ( 0.152 -1.888 -2.822) 3.398 6.577 ( 1.931 -5.972 -11.819) 13.382 6.882 ( 6.472 -15.058 20.486) 26.236 7.170 ( -7.508 -3.508 3.272) 8.910 7.585 ( 4.060 -0.999 -7.146) 8.280 8.562 ( 2.806 17.918 -7.195) 19.511 9.121 ( 10.180 -8.142 -24.091) 27.392 9.240 ( -9.090 -6.791 9.074) 14.528 9.908 ( -2.384 9.129 15.526) 18.168 10.295 ( 13.166 27.151 -35.545) 46.626 10.549 ( 5.539 -13.942 -5.340) 15.924 11.195 ( 3.211 19.317 -17.263) 26.105 12.390 ( -6.360 -5.757 -6.474) 10.748 13.173 ( 8.071 9.810 -7.239) 14.621 14.549 ( -5.870 -30.905 38.334) 49.589 15.508 ( -12.707 -9.697 28.841) 32.974 16.240 ( -7.897 -3.784 13.913) 16.440 17.196 ( -4.573 15.165 13.196) 20.617 18.888 ( 7.253 2.609 -19.334) 20.814 18.954 ( 7.167 -1.185 -12.976) 14.871 19.105 ( -3.106 2.178 -4.708) 6.046 19.300 ( 4.160 4.904 -6.616) 9.226 ======================= Grid point 451 (225/366) ======================= q-point: (-0.36 -0.36 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.842 ( -2.321 0.000 5.592) 6.055 0.921 ( -10.977 0.000 2.260) 11.207 1.164 ( -5.427 0.000 6.966) 8.830 1.284 ( -9.877 0.000 3.683) 10.541 1.607 ( -0.372 0.000 -1.277) 1.330 1.752 ( 0.986 -0.000 -2.855) 3.021 1.928 ( 2.964 -0.000 8.058) 8.585 2.528 ( -9.448 0.000 -6.068) 11.229 3.000 ( -11.782 0.000 19.801) 23.042 3.349 ( -1.615 0.000 25.798) 25.848 3.350 ( -15.782 0.000 28.594) 32.660 4.704 ( -8.784 0.000 30.880) 32.105 5.274 ( 11.099 -0.000 -22.080) 24.713 5.495 ( 3.615 -0.000 -8.535) 9.269 5.864 ( 3.760 -0.000 3.090) 4.867 6.645 ( 2.225 -0.000 -7.733) 8.046 6.813 ( 1.100 -0.000 10.973) 11.028 6.859 ( -9.021 0.000 11.335) 14.486 8.043 ( 5.378 -0.000 -7.578) 9.293 8.387 ( -2.206 0.000 14.146) 14.317 9.498 ( 5.698 -0.000 -16.363) 17.326 9.675 ( -0.130 0.000 -9.231) 9.232 9.992 ( -2.967 0.000 13.936) 14.248 10.766 ( -9.106 0.000 23.706) 25.395 10.949 ( -1.786 0.000 8.389) 8.577 11.591 ( 6.347 -0.000 16.782) 17.942 12.458 ( -13.723 0.000 1.051) 13.763 13.475 ( 2.040 -0.000 -6.783) 7.083 14.077 ( 19.713 -0.000 -13.628) 23.965 14.419 ( 9.456 -0.000 -28.395) 29.929 15.374 ( 0.732 -0.000 -0.875) 1.141 17.091 ( 6.819 -0.000 -17.216) 18.517 18.994 ( -6.741 0.000 23.781) 24.718 19.058 ( 7.756 -0.000 4.253) 8.846 19.344 ( -5.257 0.000 11.978) 13.081 20.217 ( -14.354 0.000 -40.763) 43.216 ======================= Grid point 452 (226/366) ======================= q-point: (-0.27 -0.36 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.822 ( -4.381 2.415 5.394) 7.357 0.873 ( -6.867 -1.765 3.925) 8.104 0.909 ( -10.808 11.966 4.429) 16.722 1.452 ( -3.193 -7.035 3.854) 8.634 1.559 ( -0.758 -0.251 0.410) 0.898 1.788 ( 0.426 -3.752 -0.950) 3.893 2.068 ( 3.424 -9.466 10.741) 14.721 2.450 ( -7.586 0.528 -8.036) 11.064 2.720 ( -14.570 18.302 30.936) 38.785 3.305 ( -8.360 -4.144 22.676) 24.521 3.694 ( -4.335 -18.897 23.206) 30.239 4.918 ( -4.784 -16.863 24.796) 30.366 5.300 ( 6.791 -0.351 -18.243) 19.469 5.543 ( 4.961 -4.500 -7.301) 9.908 5.884 ( 4.301 -0.856 0.056) 4.386 6.556 ( -0.336 6.439 -2.052) 6.766 6.768 ( -7.852 6.125 12.599) 16.059 6.918 ( 1.022 -6.038 3.611) 7.109 7.993 ( 3.865 6.777 -8.781) 11.746 8.469 ( -4.013 -6.556 13.563) 15.590 9.430 ( 4.529 6.767 -13.227) 15.532 9.730 ( 1.320 -7.838 -8.534) 11.662 9.818 ( -2.495 19.263 12.294) 22.988 10.489 ( -4.836 14.290 19.620) 24.749 11.020 ( -1.459 0.987 -6.448) 6.684 12.071 ( 3.360 -30.635 23.565) 38.796 12.378 ( -11.496 -2.551 3.201) 12.203 13.133 ( 6.651 31.226 -20.010) 37.679 14.107 ( 20.672 7.455 -10.725) 24.453 14.541 ( 1.844 -12.685 -6.580) 14.409 15.585 ( 1.433 -19.730 -5.176) 20.448 17.181 ( 6.691 -8.709 -16.146) 19.527 18.982 ( -4.254 2.801 18.083) 18.787 19.125 ( 6.329 -0.531 4.037) 7.526 19.287 ( -4.172 5.770 9.801) 12.114 19.917 ( -17.382 9.139 -32.289) 37.792 ======================= Grid point 453 (227/366) ======================= q-point: (-0.18 -0.36 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.627 ( -2.825 12.385 6.598) 14.315 0.816 ( -6.545 -2.122 2.125) 7.201 0.905 ( -4.551 -4.565 4.434) 7.823 1.362 ( 1.489 8.657 -4.812) 10.015 1.717 ( -2.830 -10.171 6.851) 12.585 1.857 ( -1.994 -3.880 3.422) 5.545 2.343 ( -8.307 2.356 -1.072) 8.701 2.356 ( 6.300 -15.238 10.752) 19.685 2.537 ( -8.165 1.123 25.110) 26.428 3.454 ( -4.963 -10.337 21.383) 24.263 4.073 ( -4.468 -20.690 21.096) 29.884 5.057 ( 0.820 6.589 -9.624) 11.692 5.348 ( 3.247 -1.037 -9.586) 10.174 5.623 ( -0.897 -6.269 10.051) 11.880 6.075 ( 5.635 -16.289 -3.472) 17.582 6.442 ( -1.991 4.586 3.009) 5.835 6.656 ( -5.027 3.856 14.513) 15.836 7.022 ( -0.729 -4.537 1.074) 4.719 7.828 ( 3.037 10.283 -9.508) 14.331 8.608 ( -5.896 -8.349 10.709) 14.804 9.250 ( 2.200 12.110 -5.627) 13.534 9.477 ( 0.622 16.635 -0.840) 16.668 9.908 ( 3.142 -11.140 -5.652) 12.881 10.331 ( -4.522 6.184 15.484) 17.276 10.914 ( 1.927 7.681 -12.616) 14.895 12.171 ( -0.733 13.552 -12.273) 18.298 12.446 ( 3.964 21.057 -15.690) 26.557 12.899 ( -3.354 -25.528 19.502) 32.299 14.071 ( 18.614 7.278 -3.523) 20.294 14.826 ( -4.798 -18.940 11.212) 22.527 15.940 ( -0.536 -18.121 -2.854) 18.352 17.342 ( 4.468 -6.868 -9.910) 12.858 18.951 ( 0.334 2.484 8.436) 8.800 19.145 ( -1.766 7.911 1.562) 8.255 19.164 ( 2.183 1.878 1.899) 3.450 19.569 ( -11.670 9.127 -17.727) 23.103 ======================= Grid point 454 (228/366) ======================= q-point: (-0.09 -0.36 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.456 ( 0.357 5.858 -0.005) 5.869 0.842 ( -2.689 -3.473 2.297) 4.957 0.989 ( -1.131 -4.994 2.405) 5.657 1.196 ( 2.925 9.625 -7.424) 12.503 1.865 ( -2.272 -6.718 6.169) 9.399 1.953 ( -1.353 -6.877 5.675) 9.019 2.293 ( -6.613 -1.441 -0.262) 6.773 2.570 ( 0.348 -4.886 17.869) 18.528 2.806 ( 6.386 -22.629 9.526) 25.369 3.686 ( -3.222 -11.332 19.921) 23.144 4.491 ( -4.906 -22.720 21.404) 31.598 4.811 ( -2.012 15.014 -10.736) 18.567 5.153 ( 4.577 17.432 -18.106) 25.547 5.796 ( -6.435 -6.025 10.526) 13.730 6.294 ( -2.027 -4.164 -0.187) 4.635 6.448 ( 1.042 -5.559 -4.843) 7.446 6.730 ( 1.003 -10.510 20.668) 23.209 7.076 ( -3.318 -2.767 1.479) 4.567 7.664 ( 4.371 7.014 -8.288) 11.704 8.707 ( -3.297 -2.004 4.068) 5.607 9.086 ( 4.623 3.954 -11.372) 12.897 9.228 ( -1.566 9.930 -2.275) 10.307 10.041 ( -1.105 1.318 8.779) 8.945 10.335 ( 0.451 -8.571 1.917) 8.794 10.691 ( 7.254 16.334 -22.255) 28.543 11.645 ( 10.085 32.052 -28.813) 44.263 12.278 ( -4.716 -0.536 -2.158) 5.214 13.260 ( 0.041 -6.827 4.039) 7.932 14.190 ( 4.161 -12.724 18.426) 22.775 15.191 ( -8.345 -20.966 20.137) 30.245 16.160 ( -4.465 -7.140 6.577) 10.686 17.378 ( -0.495 4.117 2.471) 4.827 18.948 ( 5.128 1.283 -3.548) 6.367 18.991 ( 1.571 6.377 -7.267) 9.795 19.109 ( -3.957 2.656 -5.287) 7.118 19.388 ( 1.489 4.400 -6.777) 8.216 ======================= Grid point 463 (229/366) ======================= q-point: (-0.27 -0.27 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.726 ( -17.113 0.000 0.988) 17.142 0.843 ( -2.093 0.000 5.881) 6.243 1.128 ( -5.879 0.000 8.452) 10.295 1.237 ( -3.455 0.000 10.881) 11.417 1.598 ( 0.093 -0.000 -1.523) 1.526 1.751 ( 0.874 -0.000 -2.046) 2.225 2.032 ( 3.774 -0.000 13.272) 13.798 2.387 ( -5.647 0.000 -7.568) 9.443 2.947 ( -11.520 0.000 21.108) 24.047 3.295 ( -14.702 0.000 28.857) 32.386 3.466 ( -2.383 0.000 25.720) 25.830 4.777 ( -6.307 0.000 35.415) 35.972 5.309 ( 11.253 -0.000 -22.174) 24.866 5.491 ( 3.462 -0.000 -10.909) 11.445 5.922 ( 2.130 -0.000 3.829) 4.382 6.613 ( 0.361 -0.000 -10.749) 10.756 6.766 ( -10.649 0.000 6.735) 12.600 6.898 ( 1.972 -0.000 9.564) 9.765 8.056 ( 1.985 -0.000 -6.533) 6.828 8.429 ( -2.482 0.000 13.303) 13.533 9.490 ( 5.893 -0.000 -16.168) 17.208 9.628 ( 0.556 -0.000 -9.000) 9.017 10.020 ( -4.080 0.000 14.584) 15.144 10.764 ( -9.731 0.000 23.714) 25.633 10.975 ( 2.985 -0.000 -1.098) 3.180 11.781 ( 6.699 -0.000 19.217) 20.352 12.305 ( -10.297 0.000 4.109) 11.086 13.461 ( 1.456 -0.000 -7.408) 7.549 14.286 ( 20.433 -0.000 -11.701) 23.546 14.403 ( 10.841 -0.000 -29.234) 31.179 15.375 ( -0.003 0.000 -1.353) 1.353 17.092 ( 6.809 -0.000 -17.247) 18.542 19.020 ( -5.325 0.000 15.771) 16.646 19.174 ( 6.205 -0.000 3.452) 7.100 19.339 ( -4.792 0.000 11.994) 12.916 19.788 ( -20.614 0.000 -26.846) 33.847 ======================= Grid point 464 (230/366) ======================= q-point: (-0.18 -0.27 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.678 ( -12.005 -5.104 4.377) 13.760 0.841 ( -2.313 2.501 7.197) 7.962 0.900 ( -2.418 11.336 8.260) 14.233 1.440 ( -2.352 -7.102 5.626) 9.361 1.553 ( -0.492 -0.240 0.670) 0.865 1.790 ( 0.255 -3.397 -0.384) 3.429 2.187 ( 3.961 -9.859 14.203) 17.738 2.334 ( -3.520 1.015 -5.788) 6.850 2.709 ( -11.514 15.779 31.579) 37.131 3.309 ( -8.927 -6.121 23.435) 25.814 3.745 ( -5.727 -18.148 20.586) 28.035 5.003 ( -1.921 -14.254 24.093) 28.059 5.292 ( 6.118 2.953 -17.878) 19.125 5.562 ( 2.985 -7.146 -5.790) 9.670 5.936 ( 3.584 -1.185 -0.281) 3.785 6.524 ( -1.482 5.232 -5.246) 7.556 6.690 ( -10.972 2.218 7.821) 13.655 6.966 ( 2.202 -3.095 4.310) 5.745 7.983 ( 1.215 6.969 -7.992) 10.673 8.483 ( -4.399 -4.465 13.061) 14.487 9.424 ( 4.923 6.656 -13.226) 15.603 9.707 ( 1.949 -9.416 -8.186) 12.628 9.842 ( -3.790 19.531 12.367) 23.426 10.517 ( -6.602 14.497 19.690) 25.327 10.993 ( 2.941 2.597 -7.590) 8.544 12.187 ( -1.060 -9.482 9.717) 13.618 12.313 ( -3.203 -20.913 13.888) 25.308 13.112 ( 6.219 31.285 -20.478) 37.905 14.319 ( 17.912 6.929 -11.867) 22.576 14.536 ( 2.836 -12.787 -7.223) 14.957 15.572 ( 0.506 -19.266 -5.342) 19.999 17.185 ( 6.577 -9.002 -16.170) 19.641 19.005 ( -3.220 1.365 7.734) 8.488 19.200 ( 1.870 2.150 1.353) 3.154 19.286 ( -3.508 5.623 9.804) 11.834 19.559 ( -14.831 4.194 -11.049) 18.964 ======================= Grid point 465 (231/366) ======================= q-point: (-0.09 -0.27 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.631 ( -1.730 11.478 6.912) 13.510 0.763 ( -2.694 -4.339 4.978) 7.132 0.901 ( -0.955 -4.069 4.898) 6.439 1.358 ( 1.548 8.352 -4.447) 9.588 1.713 ( -3.317 -10.323 7.961) 13.452 1.851 ( -1.714 -3.928 4.134) 5.954 2.272 ( -2.265 1.933 1.922) 3.544 2.503 ( 5.398 -17.663 12.480) 22.290 2.577 ( -5.084 1.424 24.680) 25.238 3.488 ( -6.546 -12.059 20.746) 24.873 4.102 ( -7.082 -21.114 19.218) 29.415 5.041 ( 5.539 11.859 -12.590) 18.161 5.324 ( 1.441 -0.555 -11.108) 11.215 5.649 ( -3.657 -4.738 11.166) 12.669 6.119 ( 2.601 -14.054 -1.082) 14.334 6.423 ( -2.449 2.862 1.318) 3.991 6.631 ( -8.306 -2.449 10.619) 13.702 7.034 ( 0.962 -2.091 1.822) 2.935 7.815 ( 2.421 9.136 -9.044) 13.081 8.589 ( -5.687 -7.108 11.573) 14.725 9.248 ( 2.210 11.938 -6.162) 13.615 9.477 ( 0.012 17.909 -0.870) 17.930 9.916 ( 2.472 -12.783 -5.764) 14.238 10.342 ( -6.163 6.390 15.564) 17.918 10.898 ( 5.399 8.188 -12.132) 15.601 12.122 ( 1.648 11.160 -6.643) 13.091 12.438 ( 8.776 27.661 -20.883) 35.752 12.937 ( -5.377 -25.874 16.930) 31.385 14.241 ( 9.235 7.280 -7.781) 14.100 14.824 ( -4.294 -18.762 11.108) 22.223 15.918 ( -0.558 -18.013 -2.685) 18.220 17.349 ( 4.176 -6.934 -9.875) 12.769 18.986 ( -0.379 0.457 0.553) 0.811 19.100 ( -3.788 6.828 0.434) 7.821 19.168 ( -1.027 7.115 2.273) 7.539 19.439 ( -0.615 2.360 -2.144) 3.247 ======================= Grid point 475 (232/366) ======================= q-point: (-0.18 -0.18 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.567 ( -6.812 0.000 8.856) 11.173 0.847 ( -1.754 0.000 5.462) 5.737 1.101 ( -5.262 0.000 10.076) 11.367 1.276 ( -0.301 0.000 11.093) 11.097 1.593 ( 0.499 -0.000 -1.844) 1.910 1.752 ( 0.608 -0.000 -1.842) 1.940 2.156 ( 3.322 -0.000 14.867) 15.233 2.314 ( 0.101 -0.000 -4.392) 4.393 2.923 ( -8.581 0.000 21.404) 23.060 3.263 ( -12.639 0.000 29.370) 31.974 3.533 ( -6.989 0.000 22.933) 23.974 4.897 ( -5.834 0.000 39.626) 40.053 5.339 ( 10.671 -0.000 -22.538) 24.936 5.474 ( 3.289 -0.000 -12.447) 12.874 5.962 ( 1.181 -0.000 3.422) 3.620 6.546 ( -1.120 0.000 -12.075) 12.127 6.643 ( -12.186 0.000 5.567) 13.397 6.963 ( 1.232 -0.000 6.245) 6.366 8.029 ( -1.030 0.000 -5.852) 5.942 8.455 ( -3.710 0.000 12.375) 12.919 9.487 ( 6.235 -0.000 -16.023) 17.194 9.600 ( 2.210 -0.000 -8.370) 8.657 10.032 ( -5.523 0.000 14.425) 15.446 10.754 ( -10.351 0.000 23.623) 25.791 11.020 ( 6.588 -0.000 -5.945) 8.874 11.934 ( 1.539 -0.000 14.496) 14.578 12.238 ( -3.934 0.000 7.375) 8.359 13.438 ( 1.219 -0.000 -7.639) 7.735 14.403 ( 12.019 -0.000 -29.464) 31.821 14.456 ( 13.769 -0.000 -16.726) 21.664 15.354 ( -2.131 0.000 -1.040) 2.372 17.093 ( 6.793 -0.000 -17.270) 18.557 18.994 ( -4.649 0.000 -1.179) 4.797 19.251 ( 2.777 -0.000 2.127) 3.498 19.341 ( -4.284 0.000 11.959) 12.704 19.490 ( -10.939 0.000 4.226) 11.727 ======================= Grid point 476 (233/366) ======================= q-point: (-0.09 -0.18 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.646 ( 2.140 -5.983 9.349) 11.304 0.850 ( -1.575 1.098 5.980) 6.281 0.913 ( -2.245 11.706 8.943) 14.901 1.445 ( -1.244 -4.570 5.154) 7.000 1.554 ( -0.013 -1.357 1.444) 1.981 1.790 ( 0.074 -3.333 -0.116) 3.336 2.308 ( 3.171 -7.756 9.518) 12.681 2.312 ( 2.372 -1.180 4.033) 4.825 2.742 ( -7.516 13.051 29.184) 32.841 3.314 ( -8.614 -7.069 23.635) 26.130 3.749 ( -9.135 -17.621 18.861) 27.380 5.104 ( -2.324 -11.964 23.066) 26.088 5.279 ( 7.027 6.608 -19.527) 21.780 5.559 ( -0.306 -8.197 -2.560) 8.593 5.976 ( 2.698 -1.830 -0.804) 3.358 6.466 ( -2.395 3.487 -6.094) 7.418 6.571 ( -11.661 0.379 6.040) 13.138 7.007 ( 0.656 -2.280 3.362) 4.115 7.946 ( -0.473 6.160 -7.409) 9.647 8.486 ( -5.190 -3.364 12.778) 14.196 9.424 ( 5.311 6.692 -13.111) 15.648 9.698 ( 2.958 -9.970 -7.943) 13.085 9.845 ( -5.157 19.674 12.005) 23.617 10.517 ( -8.597 14.493 19.313) 25.631 11.019 ( 7.038 3.877 -8.335) 11.577 12.212 ( 0.921 1.138 7.120) 7.269 12.357 ( -4.925 -30.642 14.636) 34.314 13.089 ( 6.693 31.712 -20.873) 38.550 14.402 ( 4.765 7.151 -18.886) 20.749 14.541 ( 3.609 -12.444 -7.527) 14.984 15.544 ( -0.358 -19.675 -4.490) 20.184 17.187 ( 6.419 -9.148 -16.236) 19.710 18.961 ( -3.639 -0.330 -2.674) 4.527 19.215 ( 0.035 5.345 4.831) 7.205 19.293 ( -3.110 5.416 9.503) 11.372 19.469 ( 1.267 0.911 7.177) 7.345 ======================= Grid point 487 (234/366) ======================= q-point: (-0.09 -0.09 0.27) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.657 ( 9.823 -0.000 10.808) 14.605 0.851 ( -1.650 0.000 4.505) 4.798 1.095 ( -3.809 0.000 11.005) 11.646 1.328 ( -0.427 0.000 9.505) 9.514 1.593 ( 0.988 -0.000 -1.819) 2.070 1.749 ( 0.466 -0.000 -1.626) 1.691 2.264 ( 1.545 -0.000 12.481) 12.576 2.356 ( 7.957 -0.000 0.124) 7.958 2.941 ( -5.198 0.000 20.146) 20.806 3.266 ( -10.182 0.000 29.865) 31.553 3.521 ( -11.823 0.000 21.166) 24.244 5.011 ( -9.576 0.000 40.746) 41.856 5.354 ( 9.174 -0.000 -22.912) 24.680 5.453 ( 3.511 -0.000 -12.604) 13.084 5.990 ( 0.734 -0.000 1.975) 2.108 6.463 ( -1.742 0.000 -11.383) 11.515 6.513 ( -11.045 0.000 6.471) 12.801 6.992 ( -1.245 0.000 4.667) 4.831 7.973 ( -2.598 0.000 -5.583) 6.158 8.457 ( -5.466 0.000 11.592) 12.816 9.489 ( 6.600 -0.000 -15.956) 17.267 9.602 ( 4.255 -0.000 -7.577) 8.690 10.025 ( -6.502 0.000 13.705) 15.169 10.736 ( -10.606 0.000 23.475) 25.759 11.087 ( 8.515 -0.000 -7.583) 11.402 11.947 ( -10.108 0.000 11.301) 15.162 12.277 ( 2.750 -0.000 9.656) 10.040 13.416 ( 1.683 -0.000 -7.766) 7.947 14.415 ( 12.750 -0.000 -29.049) 31.723 14.427 ( -2.182 0.000 -24.657) 24.753 15.320 ( -2.286 0.000 1.165) 2.566 17.093 ( 6.777 -0.000 -17.281) 18.563 18.935 ( -2.824 0.000 2.525) 3.788 19.267 ( -1.492 0.000 0.566) 1.596 19.349 ( -3.962 0.000 11.977) 12.615 19.552 ( 12.354 -0.000 10.789) 16.401 ======================= Grid point 488 (235/366) ======================= q-point: ( 0.00 0.00 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.917 ( -3.007 0.000 3.103) 4.321 0.942 ( 9.276 -0.000 2.382) 9.577 1.295 ( -2.748 0.000 8.675) 9.100 1.473 ( -1.366 0.000 3.596) 3.847 1.574 ( 2.436 -0.000 -1.227) 2.727 1.699 ( 1.571 -0.000 -3.865) 4.172 2.374 ( -8.634 0.000 -0.345) 8.641 2.483 ( 16.579 -0.000 -5.179) 17.369 3.383 ( -6.283 0.000 22.997) 23.840 3.811 ( -4.829 0.000 21.276) 21.817 3.821 ( -12.524 0.000 17.449) 21.479 4.908 ( 8.531 -0.000 -23.121) 24.645 5.250 ( 4.583 -0.000 -6.151) 7.671 5.643 ( -13.739 0.000 16.299) 21.317 5.892 ( -3.764 0.000 -4.114) 5.576 6.254 ( 3.531 -0.000 -5.319) 6.385 6.736 ( -0.761 0.000 20.029) 20.044 7.244 ( -9.143 0.000 21.867) 23.702 7.744 ( -1.366 0.000 -10.990) 11.075 8.630 ( -4.714 0.000 5.353) 7.133 9.141 ( 6.648 -0.000 -17.171) 18.413 9.479 ( 7.175 -0.000 -9.006) 11.514 10.268 ( -9.270 0.000 14.177) 16.938 10.999 ( 10.556 -0.000 -10.109) 14.616 11.234 ( -12.523 0.000 30.043) 32.549 12.108 ( -17.259 0.000 18.584) 25.362 12.596 ( 6.123 -0.000 9.661) 11.438 13.088 ( 7.883 -0.000 -23.596) 24.877 13.743 ( -9.052 0.000 -21.236) 23.085 13.891 ( 15.679 -0.000 -27.997) 32.089 15.480 ( -5.956 0.000 15.246) 16.368 16.721 ( 8.312 -0.000 -21.246) 22.814 19.158 ( 7.852 -0.000 7.922) 11.154 19.209 ( -8.271 0.000 0.313) 8.277 19.568 ( -2.306 0.000 9.000) 9.291 19.799 ( 11.282 -0.000 -3.153) 11.715 ======================= Grid point 489 (236/366) ======================= q-point: ( 0.09 0.00 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.906 ( -1.874 -0.086 2.713) 3.298 0.995 ( 3.925 3.229 3.372) 6.099 1.144 ( 1.823 9.605 5.547) 11.240 1.441 ( 1.885 8.705 -3.277) 9.491 1.635 ( -2.872 -8.216 2.366) 9.019 1.793 ( 2.946 -7.206 -2.092) 8.061 2.388 ( -9.367 -8.369 -3.846) 13.136 2.581 ( 15.038 -0.258 -4.496) 15.698 3.353 ( -7.528 5.118 26.909) 28.407 3.749 ( -10.395 -0.090 19.880) 22.434 4.003 ( -7.425 -14.239 15.796) 22.525 4.903 ( 9.623 -0.040 -21.052) 23.148 5.166 ( 3.746 8.247 -5.511) 10.603 5.607 ( -5.657 2.645 -3.747) 7.282 5.964 ( -11.368 -16.114 8.740) 21.571 6.357 ( 2.473 -7.369 0.186) 7.775 6.735 ( -1.315 5.791 21.160) 21.978 7.232 ( -8.329 0.593 20.026) 21.698 7.674 ( 0.611 3.537 -11.328) 11.883 8.668 ( -2.669 -5.694 4.231) 7.580 9.122 ( 5.884 1.860 -14.544) 15.799 9.566 ( 5.739 -6.461 -9.135) 12.575 10.072 ( -9.342 20.249 15.378) 27.088 10.834 ( -11.196 22.816 21.024) 32.983 10.987 ( 10.076 8.408 -10.409) 16.750 12.431 ( 10.076 22.119 -17.434) 29.912 12.592 ( -13.988 -31.161 21.462) 40.340 12.752 ( 7.273 12.878 -0.388) 14.795 13.579 ( -10.740 3.224 -17.768) 21.010 14.373 ( 9.986 -34.369 -16.644) 39.472 15.610 ( -4.187 -13.794 12.184) 18.874 16.819 ( 7.969 -10.209 -21.194) 24.837 19.138 ( -7.829 1.911 0.942) 8.114 19.188 ( 1.865 3.376 8.652) 9.473 19.492 ( -2.220 9.118 8.115) 12.407 19.798 ( 15.321 8.027 -8.374) 19.217 ======================= Grid point 490 (237/366) ======================= q-point: ( 0.18 0.00 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.817 ( -2.406 13.710 7.683) 15.899 0.910 ( -1.303 -0.617 2.751) 3.106 1.137 ( 7.636 0.140 -0.542) 7.657 1.254 ( 2.556 11.767 -6.424) 13.648 1.746 ( -4.705 -6.385 0.941) 7.987 1.947 ( 3.628 -7.336 -0.798) 8.223 2.502 ( -8.857 -11.996 -7.186) 16.552 2.674 ( 9.977 -2.027 -1.912) 10.359 3.253 ( -9.542 7.583 29.664) 32.070 3.748 ( -13.100 -2.764 16.834) 21.509 4.296 ( -6.331 -18.694 11.614) 22.900 4.929 ( 7.913 2.347 -12.653) 15.107 4.979 ( 7.807 11.389 -11.288) 17.835 5.599 ( 0.893 -8.013 -7.955) 11.327 6.237 ( -13.786 -16.838 10.125) 24.002 6.480 ( -1.832 -4.301 7.393) 8.747 6.643 ( -3.760 6.689 19.590) 21.040 7.239 ( -4.740 -2.077 14.784) 15.664 7.581 ( 2.438 4.618 -10.279) 11.529 8.774 ( 4.516 -2.820 -8.178) 9.758 9.117 ( 1.148 -2.664 2.066) 3.562 9.526 ( -6.300 27.383 10.528) 30.006 9.749 ( 1.662 -6.531 -7.468) 10.059 10.540 ( -8.871 9.567 14.586) 19.569 10.768 ( 11.390 21.727 -18.581) 30.774 11.807 ( 13.793 33.985 -27.915) 46.092 12.688 ( 7.059 5.251 8.250) 12.061 13.098 ( -1.882 -7.007 -2.410) 7.645 13.573 ( -23.756 -29.104 16.071) 40.861 14.996 ( 2.794 -32.332 -0.936) 32.466 15.943 ( -0.588 -20.688 6.349) 21.648 17.041 ( 6.713 -13.705 -19.548) 24.799 19.024 ( -4.865 8.047 4.697) 10.511 19.114 ( -5.378 3.860 2.969) 7.256 19.264 ( -1.542 16.232 4.716) 16.974 19.691 ( 16.428 12.434 -10.489) 23.120 ======================= Grid point 491 (238/366) ======================= q-point: ( 0.27 0.00 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.589 ( -1.134 11.532 5.644) 12.889 0.922 ( -0.975 -0.719 2.495) 2.774 1.030 ( 3.159 12.879 -8.889) 15.965 1.170 ( 6.247 1.468 -2.301) 6.817 1.819 ( -5.482 -5.612 1.990) 8.094 2.088 ( 3.205 -5.680 0.696) 6.559 2.628 ( -9.496 -9.915 -10.099) 17.044 2.783 ( 6.275 -3.991 1.837) 7.660 3.133 ( -10.589 4.463 24.032) 26.638 3.770 ( -13.884 -6.203 13.035) 20.029 4.510 ( 6.733 5.325 -13.459) 15.963 4.783 ( -6.475 -3.260 16.655) 18.164 5.004 ( 11.701 -1.580 -9.885) 15.399 5.830 ( 4.041 -15.799 -7.970) 18.151 6.297 ( -8.204 2.210 12.072) 14.762 6.563 ( -3.524 5.747 16.599) 17.916 6.638 ( -10.850 -15.512 5.810) 19.802 7.339 ( 0.284 -6.534 11.743) 13.441 7.490 ( 1.816 4.188 -8.661) 9.791 8.715 ( 7.925 9.176 -18.629) 22.227 8.997 ( -3.602 22.207 6.153) 23.324 9.327 ( -0.469 -11.560 13.506) 17.784 9.882 ( -1.403 -7.361 -8.375) 11.238 10.232 ( 13.192 34.812 -30.295) 47.997 10.412 ( -5.857 5.357 9.782) 12.597 11.365 ( 10.742 18.743 -17.523) 27.816 12.677 ( 7.561 3.293 5.618) 9.979 12.951 ( -0.940 10.609 -15.373) 18.702 14.226 ( -22.279 -44.321 34.615) 60.489 15.571 ( -3.317 -30.457 12.540) 33.104 16.314 ( 1.242 -16.961 4.987) 17.723 17.254 ( 4.087 -9.624 -13.310) 16.926 18.784 ( -2.199 15.837 0.174) 15.990 18.938 ( 1.532 19.141 -3.095) 19.450 19.038 ( -7.082 0.459 -0.725) 7.134 19.536 ( 12.833 12.526 -7.946) 19.614 ======================= Grid point 492 (239/366) ======================= q-point: ( 0.36 0.00 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.447 ( 1.548 4.283 -0.326) 4.566 0.790 ( 3.647 13.140 -10.305) 17.093 0.939 ( -0.723 -1.040 1.225) 1.762 1.150 ( 4.073 3.563 -3.500) 6.445 1.901 ( -5.000 -6.495 4.707) 9.452 2.191 ( 2.060 -3.204 2.620) 4.623 2.599 ( -14.466 1.738 -6.268) 15.861 2.921 ( 7.090 -4.891 8.990) 12.450 3.162 ( -6.558 -10.598 4.035) 13.100 3.873 ( -10.776 -11.109 8.276) 17.550 4.252 ( 9.892 18.778 -13.749) 25.288 4.799 ( 7.929 11.023 5.948) 14.824 5.223 ( -9.965 -20.367 12.086) 25.694 6.085 ( 1.118 -10.101 -3.221) 10.661 6.279 ( -0.103 -0.544 8.847) 8.864 6.429 ( -2.741 8.881 7.874) 12.182 6.880 ( -10.215 -17.451 3.470) 20.517 7.405 ( -1.408 3.128 1.480) 3.736 7.525 ( 4.443 -8.440 3.830) 10.279 8.459 ( 5.552 20.017 -13.155) 24.588 8.720 ( 2.902 5.965 -9.117) 11.274 9.541 ( 8.494 14.939 -16.089) 23.541 9.637 ( 3.278 4.645 -2.459) 6.194 9.925 ( -5.138 1.340 -1.258) 5.457 10.391 ( -2.176 -4.188 1.715) 5.022 11.117 ( 8.600 13.168 -12.265) 19.945 12.693 ( 3.589 4.985 -4.357) 7.532 12.723 ( 2.600 5.776 -7.194) 9.585 14.956 ( -19.618 -41.360 36.814) 58.744 16.096 ( -8.751 -25.099 25.209) 36.634 16.550 ( 0.339 -7.067 8.085) 10.744 17.326 ( -0.836 2.325 0.416) 2.506 18.484 ( 2.726 13.476 -16.174) 21.228 18.623 ( 6.957 14.889 -15.094) 22.314 18.999 ( -4.888 -0.600 -0.876) 5.002 19.386 ( 7.573 9.629 -4.242) 12.964 ======================= Grid point 493 (240/366) ======================= q-point: (-0.55 0.00 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.469 ( 3.800 -5.371 -7.316) 9.839 0.560 ( 4.266 11.940 -10.860) 16.694 0.960 ( -0.430 -1.549 0.037) 1.608 1.091 ( 1.988 3.885 -3.272) 5.455 1.996 ( -3.795 -5.321 5.115) 8.299 2.241 ( 1.069 -0.145 4.286) 4.419 2.427 ( -13.149 3.846 -2.808) 13.985 3.072 ( 6.483 -2.636 12.309) 14.159 3.407 ( -1.890 -19.814 -11.173) 22.825 3.923 ( 10.432 15.908 -8.042) 20.653 4.082 ( -6.875 -10.534 3.251) 12.992 4.601 ( 3.611 15.232 8.222) 17.682 5.547 ( -13.086 -18.964 14.326) 27.131 6.105 ( -5.399 14.998 21.103) 26.447 6.245 ( 3.016 -3.003 -4.850) 6.453 6.399 ( 2.737 -1.919 -8.716) 9.334 7.118 ( -8.818 -12.257 4.885) 15.870 7.379 ( 2.325 -1.195 1.769) 3.156 7.731 ( 4.002 -10.623 0.300) 11.356 8.057 ( 3.298 22.972 -6.150) 24.008 8.758 ( 8.285 -9.990 -21.711) 25.295 9.090 ( 12.202 20.829 -30.975) 39.271 9.751 ( -7.388 4.047 7.028) 10.970 9.897 ( -2.935 -7.483 14.854) 16.889 10.512 ( 0.276 -9.386 -5.521) 10.892 10.916 ( 6.974 12.214 -10.298) 17.431 12.495 ( -1.451 8.561 -9.874) 13.149 12.781 ( 6.617 -3.252 -2.261) 7.712 15.610 ( -17.246 -33.509 36.393) 52.390 16.267 ( -12.212 11.144 36.660) 40.216 16.788 ( -3.039 -20.996 11.083) 23.936 17.129 ( -5.690 18.814 13.087) 23.614 18.310 ( 8.858 2.941 -29.967) 31.387 18.459 ( 12.754 4.176 -27.965) 31.018 18.986 ( -2.887 -0.937 -0.662) 3.107 19.283 ( 3.722 4.935 -1.747) 6.423 ======================= Grid point 494 (241/366) ======================= q-point: (-0.45 0.00 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.380 ( 3.955 7.048 -8.744) 11.906 0.625 ( 4.105 -10.487 -9.749) 14.895 0.975 ( -0.261 0.522 -0.026) 0.584 1.040 ( 0.743 1.107 -2.001) 2.405 2.048 ( -2.630 -1.340 3.333) 4.453 2.239 ( 1.142 2.428 4.881) 5.569 2.299 ( -8.202 1.664 -1.890) 8.579 3.130 ( 3.106 3.808 14.283) 15.105 3.632 ( 6.564 11.244 -4.919) 13.918 3.806 ( 6.598 -17.610 -16.403) 24.954 4.250 ( -4.570 -8.007 3.323) 9.800 4.412 ( -2.239 6.343 7.505) 10.079 5.707 ( -8.359 10.032 15.943) 20.608 5.854 ( -8.091 -0.880 14.367) 16.511 6.308 ( -0.860 -2.442 -1.143) 2.830 6.394 ( 4.418 1.710 -10.286) 11.324 7.176 ( -6.334 -0.486 6.876) 9.361 7.481 ( 4.569 -3.326 4.703) 7.352 7.632 ( 0.737 18.086 -3.958) 18.529 8.059 ( 4.174 -18.217 -3.983) 19.109 8.820 ( 8.500 9.121 -22.655) 25.859 9.056 ( 11.974 -22.345 -30.151) 39.393 9.574 ( -7.158 9.402 7.850) 14.187 10.082 ( -3.860 -8.849 15.163) 17.975 10.660 ( 3.899 -0.562 -7.047) 8.074 10.733 ( 3.122 2.200 -9.975) 10.681 12.338 ( -1.187 5.339 -5.126) 7.496 12.901 ( 5.238 -6.751 -6.079) 10.487 15.872 ( -13.361 28.106 36.273) 47.793 16.081 ( -14.126 -15.819 34.306) 40.332 16.702 ( -4.821 25.837 10.449) 28.284 17.166 ( -4.779 -17.388 13.053) 22.261 18.334 ( 10.210 -6.740 -27.589) 30.180 18.487 ( 12.776 -5.765 -29.593) 32.744 18.984 ( -1.459 -0.544 -0.700) 1.707 19.253 ( 1.730 0.239 -0.789) 1.917 ======================= Grid point 495 (242/366) ======================= q-point: (-0.36 0.00 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.361 ( 1.156 -4.916 -0.157) 5.052 0.831 ( 3.645 -11.961 -9.499) 15.703 0.938 ( -1.022 2.409 1.991) 3.288 1.044 ( 0.752 -0.142 -0.966) 1.232 2.028 ( -1.011 2.709 1.957) 3.491 2.168 ( -4.502 5.444 3.247) 7.775 2.265 ( 2.342 0.241 0.972) 2.547 3.090 ( -1.263 4.699 18.261) 18.898 3.377 ( 4.943 18.237 1.877) 18.988 4.175 ( 1.509 -10.915 -6.900) 13.001 4.244 ( -1.436 -5.025 2.234) 5.683 4.468 ( -0.277 -9.557 -10.112) 13.917 5.340 ( -7.416 22.841 19.072) 30.667 5.919 ( -3.106 -0.047 3.290) 4.525 6.310 ( -3.867 -0.976 1.059) 4.127 6.388 ( 2.264 -1.345 -3.392) 4.294 7.139 ( -1.751 3.465 6.623) 7.677 7.366 ( -3.619 10.639 4.394) 12.066 7.532 ( 2.563 1.110 2.894) 4.022 8.419 ( 5.888 -18.079 -10.522) 21.731 8.770 ( 3.527 -4.840 -10.532) 12.116 9.345 ( -4.553 6.079 7.014) 10.338 9.588 ( 12.157 -28.869 -32.003) 44.782 10.200 ( -2.833 -0.993 7.635) 8.203 10.498 ( 0.354 7.474 -0.808) 7.526 10.906 ( 4.743 -13.154 -11.517) 18.116 12.270 ( -0.004 0.990 0.567) 1.141 13.054 ( 3.601 -8.837 -9.270) 13.304 15.285 ( -13.898 35.123 33.117) 50.234 16.041 ( -9.763 23.932 25.030) 35.980 16.381 ( -1.864 6.204 4.389) 7.825 17.355 ( -0.511 -2.934 1.591) 3.376 18.540 ( 6.237 -15.831 -15.467) 22.995 18.671 ( 7.136 -13.735 -17.364) 23.261 18.981 ( 0.426 0.182 -0.346) 0.578 19.285 ( 0.494 -2.908 -0.857) 3.071 ======================= Grid point 496 (243/366) ======================= q-point: (-0.27 0.00 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.539 ( -1.293 -12.708 6.349) 14.264 0.900 ( -0.814 1.861 3.868) 4.369 1.031 ( 0.843 1.453 0.339) 1.713 1.047 ( 2.865 -11.434 -7.889) 14.184 1.957 ( 0.176 5.244 1.541) 5.468 2.021 ( -4.340 7.948 2.333) 9.351 2.298 ( 6.570 0.282 1.588) 6.766 3.026 ( 1.636 12.653 6.744) 14.431 3.128 ( -7.179 4.697 22.517) 24.096 4.056 ( -9.431 9.292 17.114) 21.637 4.542 ( 9.302 -11.631 -19.915) 24.868 4.597 ( 2.394 -5.021 -12.293) 13.493 4.981 ( -7.976 11.323 14.750) 20.233 5.805 ( 2.013 9.422 -7.293) 12.083 6.327 ( -2.991 -1.027 8.021) 8.622 6.450 ( -0.953 -4.154 4.764) 6.393 7.001 ( -5.119 13.218 3.933) 14.711 7.234 ( -5.983 2.509 15.383) 16.696 7.537 ( 2.574 -1.731 -5.690) 6.481 8.668 ( 7.639 -7.993 -15.427) 18.980 8.987 ( -2.010 -14.563 7.996) 16.735 9.242 ( -4.740 -2.527 6.670) 8.564 10.047 ( 1.536 14.018 -7.293) 15.876 10.173 ( 12.129 -31.615 -29.610) 44.982 10.507 ( -6.647 -6.181 13.477) 16.249 11.207 ( 9.125 -20.946 -18.120) 29.161 12.306 ( 1.833 -3.211 5.641) 6.744 13.192 ( 1.625 -6.045 -9.309) 11.218 14.637 ( -15.274 33.712 24.896) 44.605 15.516 ( -3.150 31.496 9.306) 32.993 16.216 ( -1.368 14.121 4.773) 14.969 17.288 ( 4.545 9.397 -12.017) 15.918 18.853 ( -0.150 -15.974 -2.805) 16.219 18.944 ( 0.155 -15.343 -3.896) 15.831 19.009 ( 6.390 -3.473 0.803) 7.317 19.352 ( -0.470 -4.967 -1.076) 5.104 ======================= Grid point 497 (244/366) ======================= q-point: (-0.18 0.00 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.792 ( -1.774 -12.613 7.602) 14.834 0.888 ( 0.713 -0.548 4.921) 5.003 0.994 ( 0.850 2.551 2.527) 3.690 1.254 ( 2.351 -11.067 -6.161) 12.883 1.831 ( -3.144 8.970 4.016) 10.319 1.875 ( 1.563 6.618 -1.177) 6.902 2.339 ( 9.703 1.214 -0.907) 9.821 2.755 ( -2.280 14.824 2.803) 15.258 3.188 ( -9.582 -5.774 31.172) 33.119 3.871 ( -9.905 8.261 19.222) 23.148 4.361 ( -5.403 18.369 7.465) 20.551 4.769 ( 11.697 -7.258 -17.719) 22.438 5.015 ( 0.097 -9.425 -8.818) 12.908 5.668 ( 1.375 2.435 -9.313) 9.724 6.298 ( -1.130 7.868 11.728) 14.167 6.491 ( -0.398 4.320 7.016) 8.248 6.698 ( -12.353 8.882 7.578) 16.997 7.226 ( -6.265 -0.328 17.119) 18.232 7.620 ( 2.294 -7.134 -9.346) 11.979 8.735 ( 3.674 1.300 -6.035) 7.184 9.080 ( 0.830 -1.387 -0.685) 1.755 9.595 ( -6.990 -28.444 11.489) 31.463 9.777 ( 2.111 11.799 -6.995) 13.878 10.628 ( -5.093 -12.211 7.431) 15.175 10.652 ( 6.413 -15.861 -8.622) 19.158 11.731 ( 13.199 -35.501 -27.874) 47.026 12.429 ( 3.752 -6.179 8.115) 10.868 13.156 ( -2.609 12.797 3.540) 13.532 14.071 ( -16.143 18.292 3.847) 24.698 14.940 ( 2.871 33.464 -3.974) 33.821 15.908 ( -2.209 18.941 6.652) 20.196 17.061 ( 7.105 14.258 -19.173) 24.928 18.979 ( 3.442 -2.211 2.866) 4.995 19.186 ( -0.691 -7.291 2.370) 7.698 19.237 ( -0.185 -15.907 4.109) 16.430 19.474 ( 1.845 -8.981 -0.005) 9.169 ======================= Grid point 498 (245/366) ======================= q-point: (-0.09 0.00 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.877 ( 5.364 0.298 3.731) 6.541 0.944 ( -1.192 1.278 3.583) 3.986 1.107 ( -1.341 -13.537 8.094) 15.829 1.434 ( 1.738 -8.357 -3.434) 9.201 1.650 ( -1.952 10.014 4.230) 11.044 1.770 ( 2.073 5.940 -2.363) 6.720 2.391 ( 12.795 0.570 -3.482) 13.273 2.513 ( -5.290 9.254 1.847) 10.819 3.315 ( -7.990 -5.263 26.928) 28.577 3.767 ( -8.795 1.603 21.531) 23.313 4.033 ( -8.388 14.823 14.111) 22.118 4.882 ( 10.062 -2.943 -21.573) 23.985 5.149 ( 3.732 -6.946 -7.335) 10.769 5.691 ( -3.503 -4.682 -4.257) 7.233 6.037 ( -6.644 16.837 12.971) 22.268 6.343 ( 0.852 7.985 -3.051) 8.590 6.672 ( -4.792 -3.010 15.597) 16.592 7.238 ( -8.284 -0.811 20.313) 21.952 7.727 ( -0.000 -5.601 -10.287) 11.713 8.681 ( -2.052 3.577 3.175) 5.205 9.120 ( 5.289 -2.167 -13.348) 14.521 9.542 ( 5.070 8.814 -9.282) 13.767 10.114 ( -9.190 -21.101 16.503) 28.321 10.869 ( -5.216 -17.136 10.440) 20.732 10.911 ( 3.870 -12.478 0.486) 13.074 12.369 ( 10.015 -21.636 -11.688) 26.552 12.620 ( -0.735 10.047 9.338) 13.736 12.713 ( -3.374 2.109 1.934) 4.424 13.834 ( -11.937 -1.040 -17.927) 21.563 14.331 ( 9.915 35.289 -18.453) 41.039 15.606 ( -4.713 13.263 12.302) 18.694 16.823 ( 8.061 10.571 -21.170) 24.998 19.064 ( 8.090 -1.700 5.474) 9.915 19.241 ( -6.063 -1.983 1.351) 6.521 19.476 ( -1.750 -9.063 7.821) 12.098 19.668 ( 6.667 -7.620 0.662) 10.146 ======================= Grid point 500 (246/366) ======================= q-point: ( 0.09 0.09 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.894 ( -2.169 0.000 1.514) 2.646 1.067 ( 7.755 -0.000 1.582) 7.914 1.304 ( -2.478 0.000 7.855) 8.236 1.464 ( -1.980 0.000 1.418) 2.435 1.604 ( 2.623 -0.000 -0.489) 2.668 1.701 ( 1.906 -0.000 -4.523) 4.908 2.225 ( -10.680 0.000 -5.687) 12.100 2.678 ( 16.255 -0.000 -6.337) 17.447 3.421 ( -6.480 0.000 23.951) 24.812 3.742 ( -12.711 0.000 17.422) 21.566 3.864 ( -3.945 0.000 20.824) 21.194 4.894 ( 7.460 -0.000 -23.252) 24.420 5.284 ( 4.004 -0.000 -3.178) 5.111 5.524 ( -15.219 0.000 13.987) 20.670 5.798 ( -5.784 0.000 -5.562) 8.024 6.295 ( 5.052 -0.000 -1.339) 5.226 6.856 ( 0.318 -0.000 23.937) 23.940 7.237 ( -8.879 0.000 21.792) 23.532 7.673 ( 0.272 -0.000 -12.516) 12.519 8.592 ( -5.455 0.000 6.664) 8.612 9.141 ( 7.345 -0.000 -18.676) 20.068 9.530 ( 7.257 -0.000 -8.969) 11.537 10.216 ( -8.879 0.000 12.904) 15.664 11.086 ( 10.109 -0.000 -10.298) 14.430 11.229 ( -11.886 0.000 30.433) 32.672 11.951 ( -21.983 0.000 23.876) 32.455 12.729 ( 6.623 -0.000 7.134) 9.734 13.076 ( 8.807 -0.000 -23.543) 25.137 13.538 ( -4.634 0.000 -20.522) 21.039 13.959 ( 14.906 -0.000 -24.866) 28.991 15.482 ( -5.669 0.000 15.096) 16.126 16.721 ( 8.294 -0.000 -21.238) 22.800 19.085 ( -9.487 0.000 -1.069) 9.547 19.269 ( 0.518 -0.000 12.850) 12.861 19.582 ( -2.748 0.000 9.170) 9.572 19.958 ( 18.124 -0.000 -13.764) 22.758 ======================= Grid point 501 (247/366) ======================= q-point: ( 0.18 0.09 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.893 ( -1.396 -0.823 1.412) 2.150 1.045 ( -0.254 9.657 6.368) 11.570 1.216 ( 5.994 3.629 0.948) 7.071 1.449 ( 1.813 8.776 -3.335) 9.562 1.598 ( -3.843 -6.231 0.588) 7.344 1.824 ( 3.100 -8.369 -1.810) 9.107 2.217 ( -10.760 -8.462 -7.705) 15.709 2.749 ( 13.002 1.290 -5.042) 14.005 3.393 ( -7.686 5.144 26.990) 28.531 3.695 ( -12.098 0.444 18.013) 21.703 4.003 ( -5.775 -11.750 17.642) 21.969 4.916 ( 8.770 -3.454 -21.181) 23.183 5.187 ( 2.999 9.124 -3.934) 10.378 5.506 ( -6.841 -0.831 -1.808) 7.125 5.854 ( -10.240 -14.150 6.290) 18.564 6.408 ( 3.540 -6.722 3.074) 8.196 6.833 ( -2.102 8.646 23.533) 25.159 7.228 ( -7.979 0.308 20.016) 21.549 7.628 ( 2.151 2.068 -12.784) 13.128 8.656 ( -2.785 -8.010 5.269) 9.983 9.125 ( 6.423 1.433 -15.570) 16.904 9.596 ( 5.691 -4.361 -9.181) 11.649 10.029 ( -8.711 19.465 14.421) 25.744 10.798 ( -11.206 24.220 22.496) 34.904 11.059 ( 9.320 8.471 -12.247) 17.567 12.428 ( -6.410 -14.990 4.678) 16.961 12.542 ( -0.017 5.709 -0.318) 5.718 12.855 ( 6.099 7.689 3.445) 10.401 13.383 ( -4.119 5.768 -17.933) 19.283 14.419 ( 9.010 -33.373 -14.601) 37.525 15.620 ( -3.857 -14.459 11.795) 19.055 16.814 ( 7.943 -9.784 -21.164) 24.632 19.018 ( -8.671 0.236 -1.133) 8.748 19.241 ( -2.921 6.298 13.413) 15.103 19.502 ( -2.682 9.291 8.051) 12.583 19.965 ( 18.232 8.119 -16.673) 26.006 ======================= Grid point 502 (248/366) ======================= q-point: ( 0.27 0.09 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.823 ( -2.721 13.395 7.663) 15.670 0.909 ( -0.789 -0.857 2.231) 2.517 1.237 ( 8.171 1.294 -2.596) 8.671 1.255 ( 2.701 12.101 -6.638) 14.064 1.683 ( -5.344 -6.051 1.023) 8.137 1.990 ( 3.274 -7.695 -0.600) 8.384 2.314 ( -10.586 -12.134 -10.440) 19.191 2.798 ( 7.999 -0.330 -0.320) 8.013 3.276 ( -9.956 9.156 28.452) 31.503 3.656 ( -13.266 -0.898 16.570) 21.245 4.279 ( -6.046 -18.163 13.641) 23.505 4.939 ( 3.059 10.568 -7.090) 13.089 5.053 ( 12.769 -0.464 -17.843) 21.946 5.575 ( 1.178 -11.397 -6.353) 13.102 6.092 ( -14.513 -16.337 9.342) 23.765 6.514 ( -0.690 -0.443 10.183) 10.216 6.696 ( -4.558 8.099 21.418) 23.347 7.260 ( -3.895 -4.199 14.824) 15.892 7.559 ( 2.975 4.005 -11.615) 12.641 8.788 ( 4.390 -2.776 -9.543) 10.865 9.143 ( 0.631 -4.707 3.194) 5.723 9.503 ( -5.352 27.296 10.666) 29.791 9.733 ( 2.031 -4.855 -7.937) 9.523 10.505 ( -7.798 9.219 14.840) 19.132 10.813 ( 10.329 23.242 -20.046) 32.383 11.840 ( 12.808 33.130 -27.824) 45.120 12.809 ( 4.758 4.671 6.543) 9.342 13.061 ( 0.399 -1.554 -7.096) 7.275 13.382 ( -20.555 -35.609 25.444) 48.352 15.026 ( 1.629 -31.715 0.643) 31.764 15.968 ( -0.478 -21.643 5.685) 22.383 17.029 ( 6.831 -13.348 -19.558) 24.644 18.956 ( -6.051 1.387 0.101) 6.209 19.076 ( -5.265 11.578 9.132) 15.658 19.267 ( -1.554 16.463 4.250) 17.074 19.839 ( 14.877 13.077 -14.946) 24.814 ======================= Grid point 503 (249/366) ======================= q-point: ( 0.36 0.09 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.600 ( -1.584 11.064 5.444) 12.432 0.923 ( -0.817 -0.509 2.300) 2.493 1.027 ( 3.428 12.993 -8.956) 16.149 1.237 ( 5.909 3.309 -4.322) 8.034 1.761 ( -4.985 -6.321 3.536) 8.792 2.131 ( 2.196 -5.632 1.114) 6.147 2.418 ( -10.157 -9.160 -13.035) 18.894 2.881 ( 2.980 -4.068 5.775) 7.667 3.121 ( -9.405 6.143 22.683) 25.312 3.666 ( -11.681 -5.881 14.027) 19.178 4.535 ( 6.613 1.292 -11.682) 13.486 4.776 ( -7.653 -5.559 18.648) 20.910 5.112 ( 12.695 2.882 -13.916) 19.056 5.841 ( 3.851 -15.853 -8.004) 18.171 6.224 ( -10.632 -5.887 9.787) 15.604 6.562 ( -5.471 -7.925 9.228) 13.338 6.600 ( -5.802 6.342 19.028) 20.879 7.405 ( -0.390 -8.524 12.527) 15.157 7.468 ( 2.622 4.452 -10.559) 11.755 8.719 ( 7.308 9.139 -18.667) 22.031 8.981 ( -3.385 21.978 5.693) 22.955 9.387 ( -1.201 -12.555 12.963) 18.086 9.830 ( 0.016 -5.130 -7.406) 9.010 10.246 ( 12.662 35.601 -30.296) 48.431 10.391 ( -4.614 5.130 8.904) 11.264 11.405 ( 8.838 17.990 -17.788) 26.799 12.782 ( 4.082 3.036 3.344) 6.088 12.877 ( 2.274 11.437 -14.937) 18.950 14.137 ( -19.250 -45.777 38.021) 62.544 15.589 ( -4.249 -30.164 13.326) 33.249 16.351 ( 0.463 -17.675 4.366) 18.212 17.241 ( 4.472 -9.708 -13.520) 17.235 18.759 ( -1.931 17.194 1.106) 17.337 18.939 ( 0.163 16.403 -1.804) 16.503 18.954 ( -3.783 1.998 -1.452) 4.517 19.640 ( 9.410 13.769 -10.451) 19.681 ======================= Grid point 504 (250/366) ======================= q-point: ( 0.45 0.09 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.460 ( 0.457 4.106 -0.532) 4.165 0.788 ( 4.093 13.083 -10.243) 17.112 0.936 ( -0.605 -0.791 1.245) 1.594 1.178 ( 3.002 4.859 -4.746) 7.426 1.867 ( -4.097 -7.135 5.955) 10.157 2.223 ( 0.374 -3.157 2.648) 4.137 2.398 ( -9.120 0.768 -6.354) 11.142 3.008 ( -1.986 -7.926 7.606) 11.163 3.131 ( -2.204 -7.302 7.594) 10.764 3.793 ( -8.075 -11.496 10.782) 17.709 4.318 ( 10.850 17.408 -14.863) 25.331 4.929 ( 6.368 11.488 6.220) 14.533 5.143 ( -10.814 -18.069 11.053) 23.783 6.078 ( 1.043 -10.057 -3.936) 10.850 6.319 ( 1.160 -5.688 3.264) 6.660 6.431 ( -4.683 11.838 11.978) 17.480 6.786 ( -7.863 -17.158 7.673) 20.374 7.385 ( -0.148 2.234 -4.275) 4.825 7.603 ( 1.972 -8.700 7.280) 11.514 8.459 ( 4.457 19.779 -12.647) 23.896 8.716 ( 3.715 5.629 -9.338) 11.519 9.556 ( 10.614 24.233 -26.220) 37.247 9.665 ( -0.800 -3.576 6.676) 7.615 9.872 ( -2.004 1.465 -0.616) 2.558 10.378 ( -1.428 -3.716 2.312) 4.604 11.151 ( 6.244 12.736 -13.061) 19.282 12.648 ( 2.606 11.076 -12.103) 16.612 12.785 ( 3.100 0.192 -0.491) 3.144 14.910 ( -16.731 -41.871 38.759) 59.459 16.107 ( -9.327 -25.195 24.982) 36.687 16.585 ( -1.565 -7.061 7.772) 10.616 17.319 ( -0.441 2.072 0.278) 2.137 18.446 ( 3.890 14.188 -14.859) 20.910 18.635 ( 6.596 14.146 -15.558) 22.038 18.948 ( -2.064 -1.344 0.194) 2.471 19.440 ( 4.262 10.584 -5.994) 12.889 ======================= Grid point 505 (251/366) ======================= q-point: (-0.45 0.09 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.472 ( 2.331 -5.260 -7.607) 9.538 0.564 ( 4.747 11.654 -10.753) 16.552 0.957 ( -0.072 -1.516 0.161) 1.527 1.095 ( 1.289 4.282 -3.691) 5.798 1.972 ( -4.118 -5.253 5.860) 8.882 2.263 ( -1.054 -0.510 3.249) 3.454 2.303 ( -3.323 2.481 0.384) 4.165 3.154 ( -2.534 -5.818 7.597) 9.899 3.357 ( 1.082 -17.614 -6.387) 18.768 3.979 ( 0.429 -2.824 0.350) 2.878 4.062 ( 5.062 6.722 -4.922) 9.749 4.669 ( 0.725 17.448 5.051) 18.179 5.470 ( -9.461 -18.705 16.625) 26.754 6.126 ( -7.474 14.273 19.943) 25.638 6.241 ( 1.333 -1.783 -6.816) 7.171 6.412 ( 5.007 -1.563 -6.684) 8.497 7.043 ( -7.260 -11.798 8.605) 16.308 7.405 ( 1.988 -5.874 -2.987) 6.883 7.776 ( 2.317 -7.600 0.097) 7.946 8.065 ( 1.705 21.192 -4.854) 21.807 8.759 ( 8.861 -9.806 -21.763) 25.462 9.087 ( 11.642 20.740 -30.695) 38.831 9.713 ( -3.168 6.443 7.225) 10.186 9.921 ( -5.319 -9.177 14.581) 18.031 10.499 ( 1.774 -9.214 -4.577) 10.440 10.935 ( 4.314 12.161 -11.285) 17.142 12.457 ( 3.085 8.978 -8.144) 12.508 12.822 ( 1.793 -3.225 -4.310) 5.674 15.592 ( -14.380 -33.556 37.701) 52.480 16.280 ( -14.209 10.686 35.785) 39.958 16.798 ( -4.066 -20.415 10.735) 23.421 17.125 ( -5.294 19.018 13.376) 23.846 18.286 ( 10.792 2.248 -29.032) 31.054 18.473 ( 11.488 3.940 -28.580) 31.054 18.966 ( 0.115 -1.079 0.480) 1.187 19.302 ( 0.820 5.152 -2.988) 6.012 ======================= Grid point 506 (252/366) ======================= q-point: (-0.36 0.09 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.391 ( 4.455 6.745 -8.577) 11.786 0.621 ( 3.007 -10.694 -10.138) 15.039 0.972 ( -0.156 0.738 0.004) 0.755 1.043 ( 1.122 0.769 -1.950) 2.377 2.022 ( -3.795 -1.960 4.292) 6.055 2.219 ( -3.001 3.478 2.711) 5.334 2.308 ( 4.660 -0.158 3.451) 5.801 3.187 ( -4.418 1.756 10.084) 11.149 3.650 ( 3.371 -1.999 -8.809) 9.642 3.830 ( 6.623 -4.778 -16.149) 18.096 4.229 ( -0.657 -9.877 4.473) 10.862 4.407 ( -4.816 10.544 7.787) 13.964 5.696 ( -5.632 4.982 17.394) 18.950 5.837 ( -6.175 3.783 15.036) 16.689 6.268 ( -3.467 -1.331 -0.112) 3.716 6.419 ( 6.322 2.264 -10.359) 12.345 7.141 ( -5.004 -2.781 9.409) 11.014 7.531 ( 0.955 -4.041 0.198) 4.157 7.625 ( 1.028 18.311 -3.907) 18.752 8.083 ( 2.313 -17.784 -4.089) 18.394 8.808 ( 7.527 8.921 -22.464) 25.316 9.062 ( 12.451 -21.947 -30.292) 39.425 9.556 ( -2.460 10.078 10.199) 14.548 10.087 ( -6.719 -8.671 13.702) 17.552 10.681 ( 5.024 -3.229 -7.480) 9.572 10.714 ( 1.685 4.701 -9.830) 11.025 12.336 ( 4.001 5.213 -2.922) 7.192 12.903 ( 0.572 -6.684 -8.047) 10.476 15.863 ( -15.888 28.089 35.128) 47.701 16.086 ( -12.389 -15.430 35.203) 40.383 16.700 ( -3.834 25.883 10.837) 28.321 17.167 ( -5.195 -17.354 12.830) 22.198 18.336 ( 11.397 -7.122 -27.001) 30.161 18.489 ( 11.029 -5.710 -30.400) 32.839 18.989 ( 2.168 -0.524 0.695) 2.336 19.250 ( -1.147 0.051 -1.838) 2.167 ======================= Grid point 507 (253/366) ======================= q-point: (-0.27 0.09 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.379 ( 1.607 -4.885 -0.184) 5.145 0.824 ( 3.100 -12.275 -9.915) 16.081 0.938 ( -0.637 2.081 2.015) 2.966 1.054 ( 1.695 -0.287 -1.212) 2.103 2.016 ( -2.706 1.407 2.702) 4.074 2.122 ( -2.733 5.801 2.205) 6.781 2.363 ( 8.133 0.228 5.127) 9.617 3.128 ( -6.152 3.121 14.128) 15.723 3.398 ( -1.013 17.834 -3.712) 18.245 4.153 ( -0.778 -7.346 -5.165) 9.013 4.217 ( -1.584 -7.550 -3.226) 8.362 4.453 ( 3.990 -9.505 -3.664) 10.940 5.335 ( -7.894 23.425 18.073) 30.621 5.932 ( 1.403 0.910 5.723) 5.962 6.265 ( -4.097 -2.484 2.730) 5.515 6.402 ( 1.618 -0.850 -1.559) 2.402 7.141 ( -2.569 3.461 4.974) 6.582 7.347 ( -3.468 11.262 6.471) 13.444 7.544 ( -1.080 1.176 -1.438) 2.149 8.438 ( 5.591 -18.439 -11.697) 22.541 8.760 ( 2.892 -5.550 -9.674) 11.522 9.352 ( -0.903 7.576 9.664) 12.313 9.588 ( 12.798 -29.208 -31.916) 45.117 10.177 ( -5.672 -0.714 5.458) 7.904 10.485 ( -1.470 7.420 -1.189) 7.657 10.929 ( 7.393 -13.608 -10.945) 18.964 12.315 ( 5.289 0.517 2.529) 5.885 13.021 ( -0.387 -8.924 -11.171) 14.303 15.240 ( -18.153 36.189 32.266) 51.771 16.047 ( -9.094 24.191 25.188) 36.088 16.395 ( 0.057 6.325 5.611) 8.455 17.354 ( -0.880 -2.929 1.367) 3.350 18.545 ( 6.597 -15.283 -15.325) 22.626 18.660 ( 5.049 -13.813 -17.680) 22.997 19.027 ( 5.614 -0.952 1.048) 5.790 19.263 ( -2.310 -3.222 -2.145) 4.507 ======================= Grid point 508 (254/366) ======================= q-point: (-0.18 0.09 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.556 ( -1.098 -12.469 6.101) 13.925 0.913 ( -0.492 1.079 3.619) 3.808 1.042 ( 2.891 -12.170 -8.450) 15.096 1.054 ( 2.629 1.551 -0.246) 3.063 1.940 ( -4.620 5.250 2.287) 7.357 2.005 ( 1.609 6.500 0.275) 6.702 2.428 ( 9.749 0.873 4.473) 10.762 3.014 ( -4.612 14.472 -4.018) 15.712 3.143 ( -8.713 1.138 24.308) 25.847 3.993 ( -12.400 8.292 15.182) 21.284 4.518 ( 4.907 -8.199 -18.897) 21.176 4.648 ( 10.285 -10.216 -7.912) 16.515 4.950 ( -7.497 13.831 13.669) 20.841 5.804 ( 3.493 11.474 -7.368) 14.076 6.327 ( -4.301 -3.710 10.661) 12.080 6.474 ( -1.060 -4.640 9.409) 10.544 6.917 ( -9.597 16.845 2.289) 19.522 7.247 ( -3.724 2.194 14.131) 14.777 7.530 ( 1.556 -2.023 -7.080) 7.526 8.688 ( 8.057 -8.315 -17.120) 20.668 9.004 ( -2.434 -17.614 9.006) 19.932 9.232 ( -2.607 2.175 8.802) 9.434 10.011 ( -0.801 12.931 -7.928) 15.190 10.188 ( 13.372 -32.898 -30.163) 46.593 10.479 ( -7.395 -5.810 12.505) 15.647 11.248 ( 10.867 -20.540 -17.725) 29.226 12.396 ( 6.313 -3.500 6.815) 9.927 13.141 ( -0.839 -7.370 -11.808) 13.944 14.521 ( -21.321 37.106 26.340) 50.252 15.528 ( -2.664 31.256 10.095) 32.953 16.234 ( 0.009 14.885 5.311) 15.804 17.282 ( 4.150 9.449 -12.431) 16.156 18.836 ( -0.872 -14.629 -1.507) 14.732 18.933 ( 1.123 -17.322 -3.609) 17.730 19.114 ( 6.614 -3.303 1.190) 7.488 19.332 ( 0.912 -6.993 -3.748) 7.986 ======================= Grid point 509 (255/366) ======================= q-point: (-0.09 0.09 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.807 ( -2.070 -13.581 7.625) 15.712 0.910 ( -0.969 -0.185 3.830) 3.955 1.046 ( 5.405 1.534 0.965) 5.700 1.254 ( 2.435 -11.362 -6.245) 13.192 1.797 ( -4.077 7.455 2.176) 8.771 1.904 ( 3.277 6.925 -0.926) 7.717 2.483 ( 10.930 1.372 0.039) 11.016 2.689 ( -6.267 14.097 -3.998) 15.937 3.223 ( -9.362 -6.271 30.208) 32.241 3.824 ( -11.615 5.606 17.900) 22.062 4.326 ( -6.213 18.542 9.348) 21.675 4.850 ( 13.651 -3.626 -17.389) 22.403 4.980 ( 0.994 -12.275 -7.209) 14.271 5.633 ( 0.786 4.731 -8.983) 10.183 6.317 ( -6.044 9.836 11.910) 16.587 6.500 ( -4.820 10.893 5.881) 13.284 6.611 ( -6.551 -2.062 13.985) 15.580 7.231 ( -5.753 0.544 15.620) 16.655 7.601 ( 2.326 -5.763 -9.545) 11.390 8.755 ( 4.233 2.286 -6.847) 8.368 9.094 ( 1.172 0.282 0.610) 1.351 9.559 ( -6.932 -27.584 10.712) 30.392 9.765 ( 1.667 8.958 -7.005) 11.493 10.586 ( -9.063 -10.051 14.188) 19.607 10.708 ( 11.153 -19.614 -16.689) 28.064 11.767 ( 13.929 -34.923 -28.014) 46.887 12.547 ( 6.700 -5.790 8.826) 12.502 13.133 ( -2.773 10.891 1.310) 11.314 13.830 ( -23.030 22.983 8.091) 33.527 14.964 ( 3.244 32.980 -2.677) 33.247 15.920 ( -1.274 19.701 6.755) 20.866 17.053 ( 6.817 14.041 -19.404) 24.903 19.030 ( -0.456 -8.096 6.369) 10.310 19.169 ( -2.834 -2.534 -0.273) 3.811 19.257 ( -1.034 -15.293 5.142) 16.168 19.539 ( 10.739 -11.656 -5.049) 16.634 ======================= Grid point 512 (256/366) ======================= q-point: ( 0.18 0.18 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.878 ( -0.868 0.000 0.264) 0.908 1.168 ( 5.524 -0.000 3.092) 6.331 1.311 ( -2.312 0.000 7.023) 7.394 1.434 ( -2.064 0.000 -2.190) 3.009 1.637 ( 2.322 -0.000 -0.062) 2.323 1.701 ( 1.898 -0.000 -4.968) 5.318 2.046 ( -10.004 0.000 -7.881) 12.735 2.834 ( 11.559 -0.000 -6.665) 13.342 3.456 ( -7.453 0.000 23.938) 25.072 3.671 ( -11.219 0.000 17.585) 20.859 3.919 ( -4.194 0.000 20.499) 20.923 4.864 ( 6.509 -0.000 -23.723) 24.600 5.322 ( 3.233 -0.000 -1.007) 3.386 5.394 ( -14.632 0.000 13.625) 19.993 5.697 ( -4.416 0.000 -5.575) 7.112 6.368 ( 5.662 -0.000 0.679) 5.703 6.974 ( -2.642 0.000 25.937) 26.071 7.237 ( -7.828 0.000 21.102) 22.507 7.625 ( 3.093 -0.000 -13.962) 14.300 8.559 ( -5.142 0.000 8.024) 9.530 9.142 ( 7.844 -0.000 -19.830) 21.325 9.575 ( 6.312 -0.000 -9.287) 11.229 10.170 ( -7.580 0.000 12.114) 14.290 11.155 ( 8.221 -0.000 -11.182) 13.879 11.234 ( -11.316 0.000 30.681) 32.701 11.789 ( -22.330 0.000 29.391) 36.912 12.837 ( 4.737 -0.000 3.997) 6.198 13.080 ( 10.088 -0.000 -22.987) 25.103 13.408 ( 1.171 -0.000 -20.280) 20.314 14.022 ( 12.569 -0.000 -22.118) 25.440 15.486 ( -5.497 0.000 14.867) 15.851 16.721 ( 8.267 -0.000 -21.218) 22.772 18.958 ( -8.088 0.000 -1.217) 8.179 19.317 ( -4.068 0.000 15.805) 16.320 19.589 ( -3.304 0.000 9.147) 9.726 20.113 ( 18.103 -0.000 -21.828) 28.358 ======================= Grid point 513 (257/366) ======================= q-point: ( 0.27 0.18 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.887 ( -0.315 -1.148 0.759) 1.412 1.063 ( -2.425 12.308 7.958) 14.856 1.304 ( 7.463 0.778 -2.506) 7.911 1.452 ( 1.132 7.190 -3.223) 7.960 1.543 ( -4.216 -3.310 -0.154) 5.362 1.854 ( 2.570 -9.300 -1.451) 9.757 2.037 ( -9.092 -7.823 -8.197) 14.528 2.864 ( 7.546 1.789 -4.595) 9.014 3.420 ( -9.437 5.166 25.338) 27.527 3.631 ( -10.876 1.489 18.180) 21.237 4.025 ( -5.522 -9.410 18.797) 21.734 4.916 ( 8.192 -6.912 -22.092) 24.555 5.205 ( 2.163 9.619 -2.596) 10.195 5.412 ( -6.651 -4.524 1.107) 8.120 5.767 ( -6.847 -11.761 4.584) 14.360 6.474 ( 3.279 -5.789 3.787) 7.656 6.919 ( -3.870 10.437 24.325) 26.751 7.228 ( -7.798 0.026 20.005) 21.472 7.602 ( 4.559 1.665 -13.940) 14.761 8.650 ( -2.511 -9.669 5.907) 11.606 9.130 ( 6.646 0.939 -16.136) 17.476 9.619 ( 4.952 -3.046 -9.479) 11.120 9.994 ( -7.385 19.024 14.097) 24.802 10.773 ( -10.370 24.860 23.348) 35.646 11.102 ( 6.981 8.603 -13.460) 17.433 12.347 ( -14.137 -33.119 20.783) 41.577 12.567 ( 8.257 22.995 -13.610) 27.968 12.936 ( 2.893 5.617 3.118) 7.046 13.282 ( 2.769 7.021 -17.709) 19.251 14.455 ( 6.995 -32.612 -13.144) 35.850 15.630 ( -3.785 -15.043 11.344) 19.217 16.810 ( 8.000 -9.427 -21.087) 24.444 18.910 ( -6.079 -0.443 -0.667) 6.131 19.260 ( -5.145 7.516 15.183) 17.705 19.504 ( -3.146 9.381 7.871) 12.644 20.090 ( 15.253 8.256 -22.446) 28.367 ======================= Grid point 514 (258/366) ======================= q-point: ( 0.36 0.18 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.824 ( -3.134 13.040 7.623) 15.426 0.913 ( -0.395 -0.689 2.225) 2.363 1.256 ( 2.806 12.331 -6.881) 14.397 1.318 ( 6.591 2.370 -5.995) 9.220 1.624 ( -4.574 -6.585 3.468) 8.736 2.024 ( 1.484 -7.857 0.090) 7.996 2.134 ( -7.264 -11.054 -9.709) 16.408 2.869 ( 2.236 -0.099 0.543) 2.303 3.275 ( -11.954 9.808 26.076) 30.316 3.586 ( -9.945 0.022 18.201) 20.741 4.276 ( -5.644 -17.264 15.040) 23.582 4.951 ( 4.532 11.497 -7.307) 14.357 5.115 ( 10.700 -5.347 -19.541) 22.912 5.564 ( 1.284 -14.365 -4.238) 15.032 5.962 ( -11.767 -13.399 9.510) 20.210 6.557 ( -1.119 0.698 10.139) 10.224 6.745 ( -5.068 9.840 21.939) 24.573 7.285 ( -4.637 -6.284 15.506) 17.361 7.544 ( 4.644 4.274 -12.807) 14.278 8.791 ( 3.824 -2.360 -10.474) 11.398 9.163 ( -0.435 -5.230 3.583) 6.355 9.496 ( -4.009 26.430 10.877) 28.860 9.722 ( 2.578 -4.027 -8.070) 9.381 10.489 ( -6.318 9.007 15.280) 18.829 10.832 ( 8.500 23.772 -20.996) 32.836 11.855 ( 11.064 32.629 -27.909) 44.339 12.873 ( 0.319 4.192 4.324) 6.031 13.041 ( 3.233 1.929 -9.493) 10.212 13.295 ( -14.856 -39.032 32.006) 52.617 15.043 ( 0.020 -31.395 1.399) 31.427 15.987 ( -1.014 -22.244 4.996) 22.821 17.020 ( 7.173 -13.087 -19.430) 24.500 18.891 ( -3.221 -0.804 0.283) 3.331 19.063 ( -4.670 14.192 10.951) 18.524 19.266 ( -1.893 16.433 4.024) 17.024 19.920 ( 10.173 13.464 -18.506) 25.045 ======================= Grid point 515 (259/366) ======================= q-point: ( 0.45 0.18 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.601 ( -2.545 10.909 5.223) 12.359 0.925 ( -0.650 -0.281 2.380) 2.483 1.027 ( 3.612 13.003 -8.911) 16.172 1.270 ( 2.900 4.485 -6.635) 8.518 1.732 ( -2.791 -6.828 5.976) 9.494 2.146 ( -1.822 -5.794 0.597) 6.103 2.260 ( -2.786 -8.373 -9.008) 12.610 2.911 ( -3.547 -3.436 7.855) 9.278 3.106 ( -9.987 4.847 18.630) 21.687 3.623 ( -6.420 -5.523 17.225) 19.194 4.560 ( 5.228 -3.782 -9.173) 11.215 4.785 ( -4.042 -2.393 14.792) 15.520 5.177 ( 7.527 3.957 -14.365) 16.693 5.851 ( 4.001 -15.062 -7.891) 17.469 6.145 ( -7.326 -12.812 8.748) 17.156 6.561 ( -3.649 -2.412 11.366) 12.179 6.620 ( -5.876 6.977 19.085) 21.153 7.423 ( -4.015 -1.400 5.049) 6.601 7.478 ( 4.396 -3.213 -3.887) 6.690 8.713 ( 6.228 9.148 -18.529) 21.582 8.969 ( -2.797 21.144 5.602) 22.051 9.428 ( -2.324 -12.173 11.552) 16.942 9.808 ( 2.180 -4.297 -6.098) 7.772 10.253 ( 12.282 36.505 -30.929) 49.397 10.383 ( -3.724 4.454 9.521) 11.152 11.412 ( 6.318 17.588 -18.227) 26.105 12.814 ( -0.642 3.083 0.409) 3.176 12.860 ( 5.915 11.575 -13.155) 18.494 14.112 ( -15.081 -46.050 40.336) 63.048 15.596 ( -5.289 -30.127 13.389) 33.390 16.368 ( -1.061 -17.903 3.621) 18.296 17.234 ( 5.055 -9.748 -13.451) 17.364 18.747 ( -0.855 18.137 1.983) 18.265 18.914 ( -0.965 -1.169 1.244) 1.961 18.940 ( 0.956 18.525 -3.259) 18.833 19.674 ( 4.682 14.170 -12.764) 19.638 ======================= Grid point 516 (260/366) ======================= q-point: (-0.45 -0.82 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.451 ( -1.234 4.202 -0.932) 4.478 0.792 ( 4.411 12.954 -10.208) 17.073 0.937 ( -0.283 -0.718 1.517) 1.702 1.177 ( 0.755 5.022 -5.376) 7.396 1.856 ( -2.578 -6.625 7.352) 10.227 2.218 ( -2.690 -3.942 1.065) 4.890 2.320 ( 0.740 -0.666 -0.831) 1.297 2.987 ( -5.666 -7.518 7.740) 12.188 3.125 ( -5.444 -8.126 5.394) 11.170 3.784 ( -3.064 -10.646 15.222) 18.826 4.378 ( 10.534 16.584 -17.739) 26.470 4.982 ( -1.900 13.425 -6.986) 15.252 5.103 ( -5.134 -19.269 23.977) 31.185 6.077 ( 1.720 -9.463 -3.538) 10.248 6.347 ( 2.875 -7.875 -2.305) 8.694 6.429 ( -5.822 12.226 14.075) 19.531 6.752 ( -4.650 -15.408 11.680) 19.886 7.359 ( -0.134 1.491 -4.610) 4.847 7.642 ( -1.441 -8.735 5.549) 10.448 8.443 ( 3.155 19.475 -12.631) 23.426 8.722 ( 4.549 5.380 -9.601) 11.909 9.554 ( 10.131 25.250 -27.122) 38.417 9.689 ( -1.223 -3.753 7.249) 8.254 9.862 ( 0.675 1.497 0.444) 1.701 10.377 ( -0.530 -3.602 2.651) 4.503 11.146 ( 3.464 12.412 -13.758) 18.850 12.653 ( 6.971 11.508 -10.550) 17.098 12.782 ( -2.311 -0.120 -2.590) 3.473 14.917 ( -13.147 -41.773 40.221) 59.460 16.107 ( -10.060 -25.169 24.673) 36.653 16.588 ( -3.746 -6.938 6.911) 10.485 17.318 ( -0.027 1.960 0.368) 1.994 18.437 ( 6.100 14.502 -13.753) 20.897 18.635 ( 5.759 13.767 -16.025) 21.898 18.949 ( 1.488 -1.586 1.502) 2.643 19.436 ( 0.436 10.623 -7.526) 13.026 ======================= Grid point 517 (261/366) ======================= q-point: (-0.36 0.18 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.452 ( 1.004 -5.642 -8.198) 10.002 0.573 ( 4.958 11.455 -10.655) 16.411 0.961 ( 0.424 -1.399 0.366) 1.507 1.087 ( 0.393 3.735 -3.581) 5.189 1.957 ( -2.682 -4.211 7.621) 9.110 2.250 ( -2.928 -0.098 2.267) 3.704 2.339 ( 5.941 -0.315 4.936) 7.730 3.105 ( -8.692 -6.697 4.025) 11.688 3.339 ( 0.741 -18.054 -5.712) 18.951 4.000 ( 1.284 -4.545 5.147) 6.985 4.100 ( 5.196 10.182 -9.993) 15.184 4.663 ( -3.958 16.900 1.218) 17.400 5.484 ( -3.422 -18.532 21.249) 28.401 6.116 ( -9.334 13.371 19.026) 25.058 6.223 ( 1.507 0.615 -6.447) 6.649 6.450 ( 5.938 -1.490 -8.217) 10.247 7.019 ( -4.218 -11.001 12.150) 16.924 7.403 ( 0.596 -7.585 -4.239) 8.710 7.788 ( -0.294 -7.958 -0.981) 8.024 8.047 ( 0.179 20.935 -6.325) 21.870 8.768 ( 9.458 -9.408 -21.825) 25.579 9.081 ( 11.314 21.041 -30.360) 38.633 9.746 ( 1.128 7.126 9.957) 12.296 9.905 ( -7.905 -9.159 13.013) 17.768 10.511 ( 3.520 -9.670 -4.403) 11.193 10.913 ( 1.624 12.072 -11.993) 17.094 12.492 ( 7.575 8.989 -6.162) 13.272 12.784 ( -3.079 -3.518 -6.323) 7.864 15.620 ( -11.506 -33.218 38.843) 52.389 16.262 ( -16.140 11.551 34.853) 40.108 16.791 ( -5.099 -20.883 10.336) 23.852 17.127 ( -4.861 18.896 13.572) 23.767 18.295 ( 12.902 2.121 -28.413) 31.277 18.467 ( 10.185 4.179 -29.016) 31.034 18.993 ( 3.066 -1.176 1.454) 3.591 19.274 ( -2.112 4.927 -3.911) 6.635 ======================= Grid point 518 (262/366) ======================= q-point: (-0.27 0.18 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.408 ( 4.680 6.371 -8.308) 11.468 0.602 ( 2.459 -11.252 -10.624) 15.669 0.971 ( -0.089 1.147 0.061) 1.152 1.050 ( 1.515 -0.251 -1.923) 2.461 2.009 ( -2.246 -1.076 6.768) 7.211 2.199 ( -2.536 3.617 2.444) 5.049 2.429 ( 9.494 -1.128 6.594) 11.614 3.116 ( -11.831 -1.590 4.912) 12.909 3.651 ( 3.531 1.636 -9.157) 9.949 3.793 ( 2.971 -6.464 -19.223) 20.497 4.281 ( 3.196 -11.214 7.317) 13.766 4.362 ( -7.289 12.997 6.483) 16.251 5.725 ( -5.894 15.125 19.122) 25.083 5.857 ( -2.472 -6.837 17.247) 18.717 6.227 ( -2.473 -0.534 0.224) 2.540 6.442 ( 5.478 3.285 -11.496) 13.151 7.144 ( -2.364 -2.928 10.765) 11.404 7.505 ( -5.288 -2.694 0.980) 6.015 7.624 ( 2.825 18.205 -5.735) 19.295 8.077 ( 1.224 -19.616 -6.518) 20.706 8.790 ( 7.358 8.982 -22.004) 24.880 9.070 ( 12.665 -21.653 -30.637) 39.596 9.611 ( 0.836 10.935 13.423) 17.333 10.047 ( -9.006 -8.454 11.562) 16.919 10.666 ( -0.302 12.038 -9.766) 15.504 10.728 ( 7.080 -11.412 -7.749) 15.505 12.410 ( 8.321 4.763 -1.107) 9.651 12.836 ( -3.295 -6.940 -9.863) 12.502 15.817 ( -18.174 30.265 34.620) 49.445 16.118 ( -10.908 -15.644 36.220) 40.934 16.713 ( -2.922 25.233 11.145) 27.739 17.162 ( -5.601 -17.535 12.695) 22.361 18.356 ( 12.597 -6.742 -26.804) 30.375 18.464 ( 9.293 -5.380 -31.006) 32.813 19.044 ( 4.962 -1.340 1.307) 5.304 19.206 ( -3.492 -0.041 -2.481) 4.284 ======================= Grid point 519 (263/366) ======================= q-point: (-0.18 0.18 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.401 ( 1.837 -4.761 -0.237) 5.109 0.812 ( 2.964 -12.719 -10.246) 16.599 0.941 ( -0.548 1.615 1.795) 2.476 1.077 ( 2.831 -0.828 -1.678) 3.394 1.987 ( -4.286 2.971 4.332) 6.779 2.119 ( 0.579 4.778 1.452) 5.027 2.523 ( 10.174 0.335 8.257) 13.107 3.060 ( -11.977 0.144 5.445) 13.158 3.330 ( -4.823 17.177 -4.554) 18.413 4.088 ( -8.325 3.879 3.799) 9.939 4.190 ( 4.240 -16.347 -12.320) 20.904 4.531 ( 8.020 -10.508 0.882) 13.248 5.317 ( -8.530 23.793 16.786) 30.342 6.003 ( 3.916 4.721 5.611) 8.313 6.235 ( -3.496 -4.033 5.639) 7.764 6.414 ( 0.503 -2.127 0.656) 2.282 7.108 ( -5.284 9.067 0.958) 10.538 7.348 ( -3.872 8.002 13.940) 16.534 7.507 ( -0.308 0.693 -7.174) 7.214 8.447 ( 5.542 -19.198 -13.104) 23.895 8.747 ( 2.522 -6.125 -9.109) 11.263 9.414 ( 1.930 7.189 9.727) 12.248 9.595 ( 12.326 -27.572 -29.448) 42.182 10.109 ( -7.350 -0.390 2.524) 7.781 10.452 ( -2.553 6.346 -0.392) 6.852 10.985 ( 9.290 -13.730 -11.026) 19.909 12.429 ( 8.780 0.087 3.530) 9.464 12.933 ( -3.036 -9.346 -12.840) 16.169 15.148 ( -20.723 38.243 33.055) 54.632 16.060 ( -8.648 24.546 25.282) 36.283 16.438 ( 1.272 6.600 6.870) 9.611 17.347 ( -1.096 -2.815 1.047) 3.197 18.552 ( 6.179 -13.813 -15.720) 21.820 18.629 ( 4.266 -14.759 -16.907) 22.845 19.112 ( 3.667 -1.635 0.933) 4.122 19.220 ( 0.364 -4.796 -3.265) 5.814 ======================= Grid point 520 (264/366) ======================= q-point: (-0.09 0.18 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.573 ( -1.039 -12.053 5.858) 13.442 0.921 ( -0.881 0.786 3.002) 3.226 1.035 ( 2.916 -12.605 -8.708) 15.595 1.102 ( 4.927 0.332 -1.102) 5.060 1.882 ( -5.316 5.336 1.797) 7.743 2.042 ( 3.173 5.796 0.380) 6.619 2.589 ( 9.643 2.004 5.477) 11.270 2.877 ( -9.014 12.795 -10.877) 19.060 3.146 ( -9.971 -1.667 24.196) 26.223 3.890 ( -13.996 7.068 13.628) 20.774 4.500 ( 5.920 -7.537 -15.562) 18.277 4.746 ( 5.462 -7.295 1.574) 9.248 4.937 ( -0.753 12.039 5.147) 13.115 5.816 ( 4.119 14.209 -7.706) 16.680 6.322 ( -5.633 -4.758 12.408) 14.434 6.517 ( -1.918 -5.326 13.986) 15.088 6.779 ( -12.321 18.268 2.624) 22.190 7.282 ( -1.487 3.949 12.721) 13.403 7.511 ( 1.642 -3.293 -8.041) 8.843 8.704 ( 8.120 -8.897 -18.257) 21.872 9.009 ( -3.319 -21.107 7.498) 22.644 9.266 ( -0.750 8.277 12.046) 14.635 9.949 ( -1.741 10.271 -8.512) 13.453 10.211 ( 13.596 -33.912 -30.337) 47.489 10.444 ( -7.008 -5.502 11.217) 14.325 11.307 ( 11.470 -19.690 -17.513) 28.740 12.534 ( 8.366 -3.511 6.821) 11.351 13.051 ( -1.971 -9.177 -14.216) 17.035 14.364 ( -23.430 41.297 30.351) 56.352 15.549 ( -2.742 30.869 11.314) 32.991 16.270 ( 1.034 15.938 5.353) 16.845 17.269 ( 3.979 9.529 -12.905) 16.528 18.812 ( -1.762 -14.838 -0.618) 14.955 18.933 ( 1.610 -18.691 -3.451) 19.075 19.129 ( -4.932 -1.200 0.331) 5.087 19.397 ( 12.092 -10.695 -5.955) 17.206 ======================= Grid point 524 (265/366) ======================= q-point: ( 0.27 0.27 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.875 ( 0.507 -0.000 0.000) 0.507 1.242 ( 0.835 -0.000 7.252) 7.300 1.316 ( -2.123 0.000 6.427) 6.768 1.393 ( 0.430 -0.000 -7.641) 7.653 1.662 ( 1.257 -0.000 0.066) 1.259 1.698 ( 1.489 -0.000 -5.129) 5.341 1.893 ( -6.497 0.000 -6.285) 9.040 2.910 ( 4.614 -0.000 -6.083) 7.635 3.460 ( -9.692 0.000 21.510) 23.593 3.638 ( -8.230 0.000 19.741) 21.388 3.961 ( -5.806 0.000 20.493) 21.299 4.824 ( 6.648 -0.000 -24.155) 25.054 5.281 ( -12.871 0.000 14.319) 19.253 5.357 ( 2.372 -0.000 -0.237) 2.384 5.631 ( -1.085 0.000 -4.818) 4.939 6.442 ( 4.937 -0.000 -0.475) 4.960 7.053 ( -6.378 0.000 27.420) 28.152 7.246 ( -7.016 0.000 19.488) 20.713 7.614 ( 6.499 -0.000 -14.402) 15.800 8.542 ( -4.008 0.000 9.159) 9.998 9.143 ( 8.009 -0.000 -20.451) 21.963 9.599 ( 4.742 -0.000 -9.860) 10.941 10.144 ( -5.660 0.000 12.154) 13.407 11.180 ( 4.540 -0.000 -12.648) 13.438 11.246 ( -11.001 0.000 30.713) 32.623 11.680 ( -18.144 0.000 33.961) 38.504 12.891 ( 1.034 -0.000 1.382) 1.725 13.107 ( 11.680 -0.000 -22.279) 25.155 13.352 ( 5.910 -0.000 -19.704) 20.571 14.056 ( 9.026 -0.000 -21.034) 22.889 15.490 ( -5.400 0.000 14.632) 15.596 16.720 ( 8.251 -0.000 -21.190) 22.740 18.870 ( -4.135 0.000 0.047) 4.136 19.336 ( -5.748 0.000 17.025) 17.969 19.589 ( -3.860 0.000 9.009) 9.801 20.199 ( 13.602 -0.000 -27.116) 30.336 ======================= Grid point 525 (266/366) ======================= q-point: ( 0.36 0.27 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.893 ( 0.470 -1.070 1.140) 1.633 1.066 ( -3.557 12.930 8.296) 15.769 1.371 ( 4.863 1.172 -8.468) 9.835 1.445 ( -0.175 0.623 0.539) 0.842 1.500 ( -1.374 2.495 0.461) 2.885 1.861 ( -2.561 -9.127 -2.072) 9.703 1.917 ( -1.088 -7.631 -4.215) 8.785 2.894 ( 0.303 1.695 -5.103) 5.386 3.403 ( -11.874 5.531 24.448) 27.736 3.608 ( -7.568 2.526 19.752) 21.302 4.046 ( -6.429 -8.508 19.411) 22.147 4.906 ( 8.057 -9.548 -23.091) 26.254 5.219 ( 1.212 8.478 -0.424) 8.575 5.348 ( -4.338 -6.434 3.239) 8.409 5.719 ( -3.308 -9.290 2.784) 10.247 6.525 ( 2.000 -4.745 1.344) 5.322 6.986 ( -5.050 10.661 24.309) 27.020 7.225 ( -8.337 -0.216 19.762) 21.450 7.609 ( 7.363 2.176 -13.726) 15.728 8.650 ( -2.148 -9.986 6.012) 11.853 9.133 ( 6.483 0.507 -16.192) 17.449 9.627 ( 3.884 -2.710 -9.971) 11.038 9.982 ( -5.670 19.028 14.591) 24.639 10.766 ( -9.039 24.703 23.677) 35.391 11.103 ( 3.901 8.482 -13.889) 16.735 12.283 ( -11.562 -30.445 20.871) 38.681 12.612 ( 8.184 20.164 -11.566) 24.644 12.959 ( -1.430 5.699 1.593) 6.087 13.268 ( 8.474 6.992 -16.589) 19.897 14.464 ( 4.546 -32.526 -13.032) 35.333 15.636 ( -3.940 -15.302 10.952) 19.225 16.808 ( 8.145 -9.254 -20.988) 24.340 18.859 ( -1.459 -0.788 1.118) 1.999 19.268 ( -5.595 7.991 15.786) 18.557 19.500 ( -3.596 9.387 7.677) 12.648 20.130 ( 9.601 8.248 -26.340) 29.223 ======================= Grid point 526 (267/366) ======================= q-point: (-0.55 -0.73 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.818 ( -3.733 13.083 7.658) 15.612 0.920 ( -0.382 -0.425 2.586) 2.648 1.257 ( 2.810 12.357 -6.930) 14.444 1.328 ( 0.262 2.725 -8.764) 9.181 1.617 ( 0.055 -6.793 6.232) 9.219 1.976 ( -5.240 -8.861 -3.599) 10.906 2.087 ( 3.110 -9.227 -1.394) 9.836 2.855 ( -4.387 -0.761 -1.085) 4.583 3.230 ( -14.708 10.098 26.396) 31.860 3.592 ( -4.616 -0.203 20.375) 20.893 4.285 ( -5.067 -16.684 15.430) 23.283 4.984 ( 6.537 10.375 -9.032) 15.230 5.129 ( 6.377 -6.185 -18.909) 20.892 5.566 ( 1.576 -16.378 -2.095) 16.586 5.885 ( -6.624 -11.678 8.675) 15.985 6.582 ( -2.154 0.217 7.270) 7.585 6.795 ( -4.474 11.558 21.756) 25.039 7.289 ( -6.886 -6.943 15.433) 18.270 7.555 ( 6.667 5.057 -12.074) 14.690 8.781 ( 3.037 -1.765 -10.675) 11.238 9.168 ( -1.559 -4.079 3.101) 5.356 9.510 ( -2.656 24.932 11.231) 27.473 9.718 ( 3.209 -4.324 -7.963) 9.612 10.497 ( -4.796 8.996 15.852) 18.847 10.821 ( 6.361 23.136 -21.167) 31.996 11.843 ( 9.134 32.494 -27.997) 43.854 12.859 ( -5.134 3.889 2.716) 6.990 13.049 ( 4.374 0.153 -7.029) 8.281 13.320 ( -6.559 -36.256 32.151) 48.900 15.040 ( -1.424 -31.568 0.999) 31.616 15.992 ( -1.946 -22.248 4.464) 22.774 17.018 ( 7.657 -13.022 -19.207) 24.435 18.882 ( 1.062 -1.184 2.060) 2.603 19.066 ( -3.586 14.569 11.448) 18.873 19.258 ( -2.286 16.399 3.834) 16.996 19.914 ( 4.311 13.287 -21.114) 25.316 ======================= Grid point 527 (268/366) ======================= q-point: (-0.45 -0.73 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.586 ( -3.698 11.258 5.093) 12.898 0.930 ( -0.623 -0.237 2.644) 2.727 1.030 ( 3.676 12.955 -8.759) 16.064 1.241 ( -1.761 3.806 -6.858) 8.038 1.751 ( 0.548 -6.105 6.797) 9.152 2.090 ( -3.684 -7.603 -2.137) 8.715 2.261 ( 4.538 -7.196 -0.245) 8.511 2.871 ( -7.548 -4.704 3.863) 9.697 3.049 ( -12.691 4.563 20.640) 24.655 3.675 ( -1.184 -5.319 20.414) 21.129 4.576 ( 3.542 -6.974 -7.331) 10.720 4.821 ( 0.273 1.788 7.934) 8.137 5.156 ( -0.311 3.093 -11.148) 11.573 5.866 ( 4.278 -14.765 -7.790) 17.233 6.134 ( -0.559 -15.943 7.025) 17.431 6.563 ( -5.025 1.924 10.528) 11.824 6.657 ( -3.307 5.373 19.119) 20.133 7.386 ( -4.656 -0.903 3.811) 6.084 7.507 ( 2.239 -2.646 -2.740) 4.418 8.693 ( 5.230 9.425 -17.996) 20.977 8.966 ( -2.004 19.907 5.356) 20.713 9.444 ( -3.955 -10.795 10.116) 15.314 9.826 ( 4.747 -5.176 -5.139) 8.702 10.249 ( 11.678 36.641 -31.621) 49.787 10.393 ( -2.950 4.169 11.144) 12.258 11.384 ( 4.066 17.615 -18.675) 25.991 12.766 ( -6.394 2.209 -0.394) 6.777 12.898 ( 9.690 12.187 -12.442) 19.931 14.156 ( -10.333 -45.294 41.227) 62.113 15.588 ( -6.044 -30.379 12.740) 33.492 16.360 ( -2.733 -17.570 2.931) 18.021 17.236 ( 5.635 -9.723 -13.107) 17.265 18.758 ( 0.694 18.003 2.281) 18.160 18.923 ( 0.528 13.591 -1.470) 13.681 18.949 ( 3.078 3.777 1.003) 4.975 19.631 ( -0.314 13.595 -14.495) 19.875 ======================= Grid point 528 (269/366) ======================= q-point: (-0.36 -0.73 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.419 ( -2.384 4.503 -1.131) 5.219 0.799 ( 4.534 12.783 -10.108) 16.915 0.944 ( -0.105 -0.882 1.792) 2.000 1.144 ( -1.369 3.783 -4.767) 6.238 1.880 ( 0.210 -5.584 8.147) 9.879 2.180 ( -3.318 -5.057 0.107) 6.049 2.391 ( 7.408 -2.084 5.577) 9.504 2.926 ( -9.640 -6.502 3.402) 12.115 3.064 ( -5.880 -9.584 7.157) 13.329 3.862 ( 0.729 -9.385 18.860) 21.079 4.405 ( 8.639 17.139 -21.585) 28.884 4.872 ( -6.876 8.119 -6.630) 12.536 5.191 ( -2.473 -15.990 23.463) 28.501 6.084 ( 1.480 -8.003 -2.804) 8.608 6.369 ( 1.794 -2.680 -2.489) 4.074 6.426 ( -3.387 6.601 9.004) 11.667 6.785 ( -0.856 -13.704 15.229) 20.506 7.336 ( -0.473 1.047 -2.522) 2.771 7.622 ( -4.556 -8.233 2.750) 9.803 8.416 ( 2.941 19.385 -12.812) 23.422 8.736 ( 5.070 5.221 -9.874) 12.267 9.542 ( 7.837 21.660 -23.630) 32.999 9.696 ( -1.819 -0.103 2.147) 2.816 9.903 ( 4.223 1.624 3.054) 5.458 10.391 ( 0.461 -3.807 2.741) 4.713 11.103 ( 1.243 12.282 -14.135) 18.767 12.700 ( -6.892 -0.614 -4.016) 8.001 12.719 ( 10.263 11.554 -8.928) 17.847 14.977 ( -9.823 -41.037 40.759) 58.667 16.097 ( -10.674 -25.012 24.410) 36.543 16.558 ( -5.502 -6.766 5.722) 10.430 17.322 ( 0.263 2.060 0.689) 2.188 18.463 ( 8.142 14.531 -13.426) 21.394 18.623 ( 5.251 13.670 -16.134) 21.788 19.000 ( 4.297 -1.237 2.497) 5.121 19.375 ( -3.092 9.690 -8.501) 13.256 ======================= Grid point 529 (270/366) ======================= q-point: (-0.27 -0.73 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.419 ( 0.903 -6.328 -8.609) 10.722 0.585 ( 5.092 11.242 -10.462) 16.179 0.970 ( 0.512 -1.186 0.395) 1.351 1.070 ( -0.139 2.385 -3.021) 3.852 1.986 ( 0.147 -3.174 9.233) 9.764 2.212 ( -3.742 -0.769 1.060) 3.965 2.497 ( 10.924 -1.231 10.001) 14.862 2.960 ( -14.495 -5.389 0.139) 15.465 3.339 ( 3.901 -19.881 -4.493) 20.753 4.032 ( 3.900 15.798 -14.104) 21.534 4.120 ( 1.111 -6.670 8.301) 10.706 4.590 ( -6.585 14.446 -0.687) 15.891 5.578 ( -1.178 -18.964 23.156) 29.954 6.075 ( -11.136 12.610 17.486) 24.265 6.222 ( 3.068 2.707 -5.398) 6.773 6.474 ( 4.750 -1.038 -10.484) 11.556 7.064 ( 0.365 -9.738 14.720) 17.653 7.377 ( -1.586 -6.299 -2.904) 7.115 7.757 ( -3.039 -11.395 -1.969) 11.957 8.016 ( 1.567 22.332 -8.410) 23.914 8.783 ( 9.898 -9.101 -21.927) 25.721 9.073 ( 11.243 21.549 -30.272) 38.822 9.830 ( -1.576 -0.880 12.766) 12.893 9.854 ( -5.634 -0.507 11.315) 12.650 10.545 ( 5.180 -10.476 -4.855) 12.655 10.859 ( 0.021 11.803 -12.103) 16.905 12.587 ( 10.142 8.466 -4.632) 14.000 12.682 ( -6.038 -3.929 -7.637) 10.498 15.686 ( -9.600 -32.514 39.395) 51.974 16.217 ( -17.412 13.333 34.062) 40.511 16.771 ( -5.789 -22.192 10.034) 25.033 17.136 ( -4.533 18.516 13.614) 23.425 18.329 ( 14.047 2.430 -28.355) 31.737 18.446 ( 9.646 5.044 -29.013) 30.988 19.057 ( 4.776 -1.176 1.872) 5.262 19.209 ( -4.181 4.216 -4.250) 7.302 ======================= Grid point 530 (271/366) ======================= q-point: (-0.18 0.27 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.429 ( 4.741 5.996 -7.933) 11.017 0.580 ( 2.797 -11.792 -10.872) 16.281 0.970 ( -0.208 1.419 0.069) 1.435 1.063 ( 1.914 -1.533 -2.127) 3.247 2.023 ( -2.156 1.547 7.935) 8.367 2.182 ( -1.098 1.789 1.854) 2.801 2.618 ( 10.738 -0.418 10.698) 15.164 2.936 ( -15.426 -3.688 -0.449) 15.867 3.616 ( -0.875 18.617 -13.368) 22.936 3.763 ( 7.030 -20.877 -13.703) 25.943 4.277 ( -8.633 10.996 4.173) 14.590 4.384 ( 4.425 -9.881 9.554) 14.439 5.713 ( -9.977 21.300 17.288) 29.191 5.948 ( -0.251 -14.283 21.228) 25.587 6.209 ( 0.089 0.685 -0.762) 1.029 6.443 ( 3.930 3.752 -12.298) 13.445 7.187 ( 0.481 0.647 9.030) 9.065 7.412 ( -9.394 -0.570 3.508) 10.043 7.641 ( 4.053 16.346 -5.304) 17.656 8.058 ( 2.036 -22.077 -8.274) 23.664 8.775 ( 7.559 9.357 -21.736) 24.842 9.079 ( 12.696 -21.422 -30.901) 39.686 9.704 ( 1.118 11.488 15.692) 19.479 9.971 ( -10.155 -8.157 9.049) 15.860 10.605 ( -1.189 11.040 -8.735) 14.128 10.792 ( 8.546 -11.723 -8.440) 16.784 12.535 ( 10.256 4.074 -0.308) 11.039 12.722 ( -4.994 -7.307 -10.919) 14.055 15.745 ( -19.465 32.025 34.690) 51.068 16.170 ( -10.209 -14.552 37.009) 41.057 16.737 ( -2.376 23.962 11.300) 26.599 17.151 ( -5.864 -17.904 12.688) 22.714 18.389 ( 13.338 -6.009 -26.922) 30.640 18.416 ( 8.127 -4.614 -31.238) 32.606 19.107 ( -0.436 -0.178 -0.152) 0.495 19.155 ( 1.796 -2.355 -1.407) 3.279 ======================= Grid point 531 (272/366) ======================= q-point: (-0.09 0.27 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.425 ( 1.891 -4.548 -0.274) 4.933 0.799 ( 3.216 -13.039 -10.350) 16.955 0.941 ( -0.654 1.300 1.457) 2.060 1.111 ( 3.834 -2.003 -2.409) 4.951 1.946 ( -5.154 5.182 4.465) 8.564 2.148 ( 2.243 3.473 1.998) 4.592 2.701 ( 6.603 0.933 10.041) 12.054 2.883 ( -11.941 -0.237 -3.899) 12.563 3.241 ( -6.474 14.246 0.085) 15.648 3.982 ( -11.127 9.176 6.904) 15.990 4.204 ( 7.929 -19.249 -13.829) 24.993 4.659 ( 8.894 -11.066 3.671) 14.664 5.281 ( -9.220 22.975 14.815) 28.850 6.069 ( 2.813 9.320 0.585) 9.753 6.239 ( -1.741 -4.195 9.663) 10.678 6.423 ( -0.926 -5.116 3.837) 6.462 7.008 ( -9.593 15.176 0.429) 17.959 7.388 ( -3.198 1.262 17.000) 17.344 7.480 ( 3.807 3.912 -9.963) 11.361 8.452 ( 5.767 -19.820 -13.539) 24.686 8.732 ( 2.478 -6.209 -9.009) 11.219 9.491 ( 4.334 0.755 2.121) 4.884 9.610 ( 9.595 -20.384 -20.587) 30.519 10.015 ( -7.302 -0.629 -0.062) 7.330 10.417 ( -2.656 5.087 0.786) 5.793 11.055 ( 9.734 -13.548 -11.541) 20.285 12.573 ( 9.524 -0.233 3.268) 10.072 12.817 ( -3.372 -9.841 -13.639) 17.153 15.043 ( -21.110 40.150 34.787) 57.164 16.079 ( -8.515 24.873 25.303) 36.489 16.496 ( 1.388 6.897 7.768) 10.480 17.336 ( -1.081 -2.601 0.703) 2.903 18.532 ( 3.558 -12.605 -16.778) 21.285 18.613 ( 6.169 -15.796 -15.296) 22.837 19.078 ( -5.591 -0.239 -1.062) 5.696 19.289 ( 9.078 -7.906 -2.800) 12.360 ======================= Grid point 536 (273/366) ======================= q-point: (-0.64 -0.64 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.890 ( 1.159 -0.000 1.099) 1.597 1.243 ( -6.181 0.000 6.746) 9.149 1.322 ( -2.025 0.000 6.209) 6.531 1.389 ( 4.728 -0.000 -7.464) 8.836 1.661 ( -1.392 0.000 -0.542) 1.494 1.688 ( 1.070 -0.000 -5.009) 5.122 1.827 ( -0.071 0.000 -0.940) 0.943 2.884 ( -3.439 0.000 -7.779) 8.506 3.450 ( -8.423 0.000 23.886) 25.328 3.639 ( -7.785 0.000 19.725) 21.206 3.974 ( -8.507 0.000 20.631) 22.316 4.795 ( 8.099 -0.000 -24.164) 25.485 5.204 ( -10.608 0.000 16.358) 19.496 5.380 ( 1.374 -0.000 -1.101) 1.760 5.620 ( 3.117 -0.000 -4.379) 5.375 6.487 ( 3.634 -0.000 -4.667) 5.915 7.099 ( -8.335 0.000 28.245) 29.449 7.245 ( -7.816 0.000 17.418) 19.091 7.649 ( 9.442 -0.000 -13.298) 16.309 8.548 ( -2.639 0.000 9.828) 10.176 9.142 ( 7.895 -0.000 -20.465) 21.935 9.597 ( 3.021 -0.000 -10.541) 10.965 10.148 ( -3.645 0.000 13.007) 13.508 11.140 ( -0.556 0.000 -12.045) 12.058 11.260 ( -10.947 0.000 30.548) 32.450 11.668 ( -10.615 0.000 34.689) 36.277 12.877 ( -3.793 0.000 0.266) 3.802 13.152 ( 11.967 -0.000 -22.078) 25.113 13.362 ( 10.631 -0.000 -17.805) 20.737 14.041 ( 5.760 -0.000 -22.224) 22.958 15.495 ( -5.347 0.000 14.399) 15.359 16.720 ( 8.269 -0.000 -21.166) 22.724 18.855 ( 1.005 -0.000 2.368) 2.572 19.345 ( -6.113 0.000 17.087) 18.147 19.581 ( -4.282 0.000 8.813) 9.798 20.188 ( 7.198 -0.000 -30.342) 31.184 ======================= Grid point 537 (274/366) ======================= q-point: (-0.55 -0.64 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.909 ( 0.374 -0.582 2.378) 2.476 1.056 ( -4.200 12.482 7.953) 15.385 1.323 ( -3.871 0.843 -7.256) 8.267 1.460 ( 1.635 7.529 -3.160) 8.327 1.523 ( 2.746 -4.062 3.577) 6.070 1.797 ( -3.017 -6.722 -1.776) 7.579 1.941 ( 3.546 -9.221 1.335) 9.969 2.813 ( -7.161 1.074 -7.452) 10.391 3.380 ( -11.703 8.392 27.474) 31.020 3.623 ( -5.803 0.892 19.834) 20.685 4.055 ( -7.492 -9.383 19.548) 22.942 4.891 ( 7.880 -9.904 -23.151) 26.385 5.229 ( -1.180 3.040 3.675) 4.913 5.338 ( 0.812 -4.382 2.430) 5.076 5.705 ( -0.166 -6.812 0.624) 6.842 6.539 ( 0.938 -3.876 -3.437) 5.265 7.040 ( -5.559 9.915 23.085) 25.732 7.209 ( -9.466 -0.662 19.740) 21.903 7.654 ( 9.257 3.227 -12.161) 15.621 8.655 ( -1.766 -8.868 5.684) 10.680 9.134 ( 6.066 0.327 -15.784) 16.913 9.619 ( 2.900 -3.396 -10.475) 11.387 9.996 ( -4.098 19.445 15.679) 25.312 10.778 ( -7.522 23.486 22.825) 33.603 11.064 ( 0.928 8.447 -12.665) 15.252 12.256 ( -6.553 -21.286 15.010) 26.858 12.660 ( 5.226 10.646 -5.041) 12.886 12.915 ( -5.296 8.116 -0.387) 9.699 13.334 ( 13.553 6.281 -14.139) 20.568 14.442 ( 2.903 -33.236 -14.280) 36.290 15.639 ( -4.195 -15.114 10.691) 18.982 16.809 ( 8.338 -9.329 -20.902) 24.361 18.885 ( 3.295 -0.788 3.508) 4.876 19.277 ( -5.401 7.889 15.393) 18.120 19.489 ( -3.895 9.359 7.491) 12.605 20.070 ( 2.951 7.969 -28.423) 29.666 ======================= Grid point 538 (275/366) ======================= q-point: (-0.45 -0.64 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.805 ( -4.218 13.548 7.793) 16.189 0.929 ( -0.703 -0.131 3.218) 3.297 1.245 ( -5.072 2.285 -6.972) 8.919 1.259 ( 2.202 11.585 -6.764) 13.595 1.675 ( 3.227 -6.138 5.397) 8.787 1.911 ( -2.333 -8.469 -1.886) 8.985 2.146 ( 4.918 -9.324 3.229) 11.025 2.744 ( -9.535 -2.170 -4.252) 10.663 3.176 ( -15.019 10.825 29.816) 35.097 3.660 ( -2.234 -2.119 21.379) 21.599 4.302 ( -4.104 -16.567 14.559) 22.434 5.012 ( 5.672 2.643 -15.878) 17.067 5.103 ( 3.360 2.799 -11.182) 12.006 5.586 ( 2.737 -16.268 -1.558) 16.570 5.876 ( -1.057 -13.234 7.145) 15.077 6.575 ( -2.747 -0.470 2.680) 3.867 6.853 ( -3.686 11.699 20.644) 24.013 7.266 ( -8.519 -6.047 15.650) 18.817 7.590 ( 6.952 6.265 -10.402) 13.992 8.762 ( 2.411 -1.103 -10.161) 10.501 9.156 ( -2.111 -2.385 1.943) 3.731 9.540 ( -1.962 24.179 11.811) 26.981 9.724 ( 3.846 -5.929 -7.780) 10.511 10.525 ( -3.571 9.160 16.157) 18.913 10.783 ( 4.337 21.546 -20.284) 29.907 11.809 ( 7.976 32.847 -28.046) 43.922 12.770 ( -9.745 3.981 2.031) 10.721 13.078 ( 3.183 -4.815 -1.909) 6.080 13.453 ( 2.643 -29.960 27.953) 41.061 15.018 ( -2.024 -32.137 -0.304) 32.202 15.982 ( -2.821 -21.624 4.222) 22.213 17.024 ( 8.097 -13.181 -18.967) 24.475 18.936 ( 4.103 -0.144 3.985) 5.722 19.087 ( -2.061 13.192 11.092) 17.358 19.246 ( -2.499 16.434 3.649) 17.019 19.816 ( -1.657 12.445 -22.270) 25.565 ======================= Grid point 539 (276/366) ======================= q-point: (-0.36 -0.64 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.559 ( -4.239 11.921 5.346) 13.735 0.935 ( -0.894 -0.333 2.961) 3.110 1.034 ( 3.617 12.824 -8.475) 15.791 1.164 ( -4.518 1.755 -4.835) 6.846 1.811 ( 3.007 -5.332 6.128) 8.662 2.041 ( -2.540 -7.611 -1.275) 8.124 2.360 ( 8.217 -8.416 5.171) 12.849 2.742 ( -11.635 -5.838 -2.187) 13.200 3.011 ( -11.081 4.245 26.196) 28.758 3.786 ( 0.668 -6.124 21.787) 22.641 4.577 ( 2.659 -6.159 -8.414) 10.761 4.863 ( 2.967 6.117 -2.194) 7.144 5.072 ( -6.035 -0.865 -1.933) 6.395 5.879 ( 3.526 -14.725 -7.518) 16.905 6.190 ( 3.899 -15.734 3.901) 16.673 6.539 ( -5.294 3.476 7.333) 9.689 6.731 ( -0.852 3.663 19.561) 19.919 7.343 ( -6.311 -2.657 8.175) 10.664 7.510 ( 1.617 1.234 -5.761) 6.109 8.668 ( 4.928 9.658 -17.067) 20.220 8.969 ( -1.495 18.419 4.877) 19.113 9.429 ( -5.593 -8.205 8.782) 13.257 9.878 ( 6.670 -7.534 -4.747) 11.126 10.234 ( 10.762 35.262 -31.344) 48.391 10.420 ( -2.309 4.983 12.535) 13.686 11.330 ( 2.903 18.110 -19.016) 26.420 12.649 ( -10.199 1.977 -0.836) 10.422 12.979 ( 11.159 11.406 -10.766) 19.249 14.264 ( -5.785 -43.275 40.270) 59.396 15.569 ( -6.201 -30.795 11.653) 33.505 16.328 ( -3.915 -16.716 2.531) 17.354 17.246 ( 5.965 -9.641 -12.609) 16.957 18.787 ( 1.939 17.029 1.881) 17.242 18.913 ( 0.290 18.359 -3.320) 18.660 19.026 ( 5.631 -0.159 4.007) 6.913 19.518 ( -4.628 12.026 -15.103) 19.853 ======================= Grid point 540 (277/366) ======================= q-point: (-0.27 -0.64 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.382 ( -2.141 4.734 -0.873) 5.269 0.807 ( 4.560 12.531 -9.843) 16.575 0.950 ( -0.395 -1.157 1.884) 2.246 1.098 ( -2.026 1.949 -3.343) 4.368 1.943 ( 2.495 -4.999 7.937) 9.706 2.133 ( -3.392 -4.961 -0.061) 6.010 2.562 ( 10.706 -3.916 11.285) 16.041 2.758 ( -14.245 -5.711 -2.409) 15.535 3.072 ( -0.842 -10.753 11.207) 15.554 3.985 ( 1.651 -8.375 20.263) 21.988 4.379 ( 5.385 18.724 -24.005) 30.917 4.749 ( -5.684 8.821 -7.642) 12.982 5.267 ( -4.363 -19.340 22.737) 30.167 6.079 ( -0.902 -6.246 -1.418) 6.469 6.364 ( -2.180 4.899 2.766) 6.033 6.431 ( 0.889 -0.531 -2.432) 2.643 6.889 ( 3.523 -12.733 16.495) 21.133 7.325 ( -0.640 0.926 2.006) 2.300 7.557 ( -5.686 -7.181 -0.071) 9.160 8.393 ( 3.745 19.229 -12.570) 23.277 8.752 ( 5.231 5.034 -10.210) 12.528 9.514 ( 3.128 13.611 -15.420) 20.805 9.666 ( 0.431 8.512 -8.857) 12.292 9.997 ( 5.399 1.042 6.336) 8.389 10.418 ( 1.400 -4.364 2.484) 5.213 11.037 ( 0.293 12.306 -14.037) 18.669 12.566 ( -9.296 -1.010 -4.347) 10.311 12.825 ( 11.606 10.981 -7.731) 17.749 15.074 ( -7.660 -39.597 40.089) 56.866 16.079 ( -10.972 -24.701 24.326) 36.363 16.505 ( -6.231 -6.566 4.543) 10.128 17.331 ( 0.337 2.319 1.121) 2.597 18.506 ( 8.741 14.590 -14.033) 22.051 18.611 ( 5.762 13.636 -15.878) 21.708 19.080 ( 5.032 -0.489 2.814) 5.787 19.272 ( -5.085 7.803 -8.425) 12.559 ======================= Grid point 541 (278/366) ======================= q-point: (-0.18 -0.64 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.391 ( 1.887 -6.907 -8.772) 11.324 0.600 ( 5.142 10.942 -10.130) 15.773 0.977 ( 0.230 -0.909 0.250) 0.970 1.054 ( -0.074 0.769 -2.419) 2.539 2.042 ( 0.296 -1.515 8.399) 8.540 2.174 ( -2.042 -1.931 1.436) 3.156 2.682 ( -3.231 -1.206 6.298) 7.180 2.773 ( -1.440 -4.993 4.447) 6.839 3.402 ( 8.007 -19.932 -2.182) 21.591 3.961 ( 0.974 22.270 -21.483) 30.959 4.206 ( 0.874 -9.569 15.188) 17.972 4.494 ( -6.343 12.307 -1.699) 13.949 5.672 ( -3.032 -20.474 22.027) 30.225 6.002 ( -12.298 12.592 14.994) 23.122 6.247 ( 4.475 3.255 -4.351) 7.040 6.463 ( 2.095 -0.733 -11.049) 11.269 7.175 ( 4.017 -8.819 13.735) 16.810 7.334 ( -3.416 -1.150 1.052) 3.755 7.699 ( -2.876 -14.629 -3.592) 15.336 8.007 ( 3.640 21.967 -8.286) 23.758 8.801 ( 10.009 -9.045 -22.115) 25.905 9.064 ( 11.269 22.069 -30.321) 39.159 9.756 ( -10.977 -9.678 9.149) 17.259 9.945 ( 1.644 8.939 14.976) 17.519 10.594 ( 5.973 -10.728 -5.612) 13.501 10.796 ( 0.127 10.738 -11.545) 15.768 12.543 ( -7.181 -4.434 -7.740) 11.452 12.715 ( 11.004 7.708 -4.186) 14.072 15.768 ( -9.260 -31.480 39.093) 51.039 16.158 ( -17.531 15.269 33.565) 40.830 16.744 ( -5.961 -23.787 9.946) 26.463 17.148 ( -4.398 18.043 13.510) 22.965 18.358 ( 11.993 3.306 -28.812) 31.383 18.434 ( 11.829 6.017 -28.492) 31.431 19.105 ( -2.806 1.467 -1.647) 3.569 19.153 ( 2.867 0.552 -0.595) 2.980 ======================= Grid point 542 (279/366) ======================= q-point: (-0.09 0.36 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.451 ( 4.562 5.654 -7.523) 10.458 0.565 ( 3.545 -12.028 -10.918) 16.626 0.966 ( -0.397 1.521 0.045) 1.573 1.078 ( 2.165 -2.834 -2.632) 4.433 2.019 ( -3.790 4.295 6.031) 8.318 2.200 ( 1.393 0.027 3.617) 3.876 2.646 ( -15.620 -3.497 -0.542) 16.015 2.888 ( 9.651 0.264 10.183) 14.033 3.511 ( -3.047 20.700 -14.024) 25.188 3.824 ( 10.245 -20.571 -9.247) 24.772 4.176 ( -9.047 12.194 3.373) 15.554 4.497 ( 4.671 -12.722 9.533) 16.570 5.646 ( -12.663 20.290 15.438) 28.468 6.046 ( -2.638 -15.349 22.082) 27.022 6.221 ( 2.736 2.314 -2.439) 4.334 6.421 ( 2.456 3.132 -11.527) 12.195 7.205 ( -4.905 11.299 2.536) 12.576 7.342 ( -2.869 -4.480 7.769) 9.416 7.677 ( 4.453 14.100 -2.470) 14.991 8.050 ( 3.161 -23.445 -8.019) 24.979 8.764 ( 7.854 9.793 -21.679) 25.051 9.086 ( 12.575 -21.136 -31.025) 39.591 9.784 ( -2.794 8.965 14.610) 17.367 9.887 ( -7.563 -5.261 8.650) 12.637 10.549 ( -0.816 10.115 -7.085) 12.377 10.861 ( 8.546 -12.116 -9.314) 17.509 12.589 ( -3.924 -7.475 -10.215) 13.252 12.679 ( 9.228 3.110 -1.445) 9.845 15.668 ( -19.130 33.034 35.317) 52.005 16.226 ( -10.721 -12.695 37.161) 40.707 16.765 ( -2.405 22.368 11.281) 25.166 17.139 ( -5.901 -18.381 12.827) 23.178 18.359 ( 7.872 -3.966 -30.790) 32.027 18.427 ( 13.451 -4.803 -27.410) 30.907 19.045 ( -4.746 0.797 -1.515) 5.045 19.224 ( 5.752 -4.273 -0.541) 7.186 ======================= Grid point 548 (280/366) ======================= q-point: (-0.55 -0.55 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.913 ( 0.585 -0.000 2.815) 2.875 1.171 ( -7.243 0.000 1.600) 7.417 1.325 ( -2.521 0.000 6.262) 6.750 1.413 ( 1.582 -0.000 -1.354) 2.083 1.632 ( -2.032 0.000 -0.611) 2.122 1.678 ( 1.379 -0.000 -4.695) 4.894 1.874 ( 4.677 -0.000 5.449) 7.181 2.742 ( -9.927 0.000 -9.885) 14.009 3.485 ( -7.542 0.000 26.377) 27.434 3.639 ( -6.455 0.000 19.688) 20.719 3.950 ( -11.152 0.000 20.627) 23.449 4.791 ( 9.962 -0.000 -23.570) 25.588 5.172 ( -8.102 0.000 19.823) 21.414 5.380 ( 0.378 -0.000 -3.487) 3.508 5.664 ( 6.738 -0.000 -4.635) 8.178 6.491 ( 2.761 -0.000 -9.944) 10.320 7.132 ( -8.680 0.000 28.275) 29.578 7.214 ( -9.575 0.000 15.096) 17.876 7.722 ( 10.720 -0.000 -11.421) 15.664 8.572 ( -1.543 0.000 9.822) 9.943 9.140 ( 7.624 -0.000 -19.837) 21.251 9.571 ( 1.578 -0.000 -11.141) 11.252 10.181 ( -2.189 0.000 14.312) 14.478 11.052 ( -3.301 0.000 -10.262) 10.780 11.272 ( -11.077 0.000 30.268) 32.232 11.748 ( -4.100 0.000 32.201) 32.461 12.795 ( -8.666 0.000 0.949) 8.718 13.185 ( 10.115 -0.000 -22.275) 24.464 13.457 ( 16.131 -0.000 -14.698) 21.823 13.983 ( 4.543 -0.000 -25.062) 25.470 15.498 ( -5.317 0.000 14.167) 15.132 16.720 ( 8.307 -0.000 -21.158) 22.730 18.918 ( 5.243 -0.000 4.851) 7.143 19.350 ( -6.256 0.000 15.687) 16.888 19.568 ( -4.456 0.000 8.594) 9.681 20.075 ( 0.243 -0.000 -30.942) 30.943 ======================= Grid point 549 (281/366) ======================= q-point: (-0.45 -0.55 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.925 ( -0.449 0.042 3.771) 3.798 1.038 ( -4.259 10.482 6.856) 13.229 1.215 ( -7.648 3.499 -3.832) 9.243 1.457 ( 0.962 8.958 -3.876) 9.808 1.581 ( 2.351 -7.517 4.065) 8.863 1.767 ( -0.824 -6.059 -1.012) 6.198 2.022 ( 5.601 -8.818 6.851) 12.493 2.642 ( -11.003 -0.047 -8.950) 14.184 3.364 ( -12.984 11.423 28.396) 33.247 3.664 ( -4.241 -0.980 21.272) 21.713 4.054 ( -7.561 -11.860 18.900) 23.559 4.875 ( 7.476 -7.337 -22.083) 24.442 5.230 ( -1.581 -0.177 3.927) 4.237 5.387 ( 3.669 -5.650 3.968) 7.818 5.720 ( 2.867 -4.053 -1.642) 5.229 6.518 ( 0.707 -3.363 -8.283) 8.967 7.075 ( -6.064 9.117 18.586) 21.571 7.182 ( -10.532 -1.859 22.144) 24.591 7.721 ( 9.277 4.722 -10.565) 14.832 8.662 ( -1.318 -6.821 5.062) 8.596 9.131 ( 5.580 0.507 -14.975) 15.989 9.597 ( 2.301 -5.027 -10.771) 12.107 10.034 ( -3.199 20.157 16.892) 26.492 10.799 ( -5.887 20.301 18.791) 28.283 11.004 ( -1.403 9.950 -7.990) 12.838 12.260 ( -1.409 -8.586 5.959) 10.546 12.684 ( -2.809 -5.226 5.268) 7.934 12.832 ( -3.501 14.944 -4.998) 16.142 13.482 ( 17.847 4.888 -10.336) 21.196 14.399 ( 2.858 -34.344 -16.143) 38.056 15.637 ( -4.407 -14.559 10.566) 18.521 16.812 ( 8.494 -9.627 -20.861) 24.495 18.975 ( 6.231 -0.380 5.550) 8.352 19.281 ( -5.484 7.095 13.192) 15.951 19.475 ( -3.930 9.317 7.349) 12.500 19.917 ( -3.392 7.438 -27.286) 28.484 ======================= Grid point 550 (282/366) ======================= q-point: (-0.36 -0.55 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.790 ( -4.163 14.313 8.149) 16.988 0.934 ( -1.364 0.202 3.868) 4.107 1.123 ( -7.912 -0.110 -3.870) 8.808 1.259 ( 2.506 11.933 -6.497) 13.816 1.748 ( 3.360 -6.500 4.738) 8.717 1.883 ( -0.985 -7.738 -1.297) 7.907 2.257 ( 7.218 -10.098 8.199) 14.876 2.572 ( -11.457 -3.060 -5.857) 13.227 3.142 ( -14.278 10.268 32.130) 36.628 3.744 ( -2.397 -4.557 21.903) 22.500 4.327 ( -2.802 -16.583 12.482) 20.944 4.950 ( 0.231 -2.421 -18.863) 19.019 5.122 ( 5.140 10.509 -7.262) 13.769 5.620 ( 4.066 -13.135 -3.006) 14.075 5.927 ( 2.812 -16.606 7.080) 18.270 6.542 ( -2.300 -0.895 -1.684) 2.988 6.906 ( -3.852 9.653 18.131) 20.898 7.233 ( -9.207 -4.743 17.667) 20.479 7.624 ( 5.904 8.093 -9.700) 13.944 8.741 ( 2.159 -0.491 -9.184) 9.447 9.134 ( -2.006 -0.865 0.535) 2.249 9.577 ( -2.143 24.925 12.518) 27.974 9.739 ( 4.303 -8.594 -7.610) 12.259 10.566 ( -2.780 9.456 15.053) 17.993 10.729 ( 2.777 19.503 -17.631) 26.437 11.768 ( 7.985 33.709 -28.171) 44.651 12.632 ( -11.921 4.350 2.289) 12.895 13.111 ( 1.563 -8.947 2.035) 9.307 13.672 ( 9.273 -24.377 23.087) 34.832 14.986 ( -1.607 -32.780 -1.913) 32.875 15.963 ( -3.324 -20.586 4.303) 21.292 17.035 ( 8.315 -13.503 -18.785) 24.583 19.016 ( 3.300 4.105 5.704) 7.764 19.127 ( 0.150 7.968 8.431) 11.602 19.232 ( -2.375 16.559 3.791) 17.153 19.647 ( -6.140 11.163 -20.433) 24.079 ======================= Grid point 551 (283/366) ======================= q-point: (-0.27 -0.55 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.534 ( -3.794 12.481 5.927) 14.328 0.934 ( -1.744 -0.473 3.113) 3.599 1.037 ( 3.215 12.297 -7.746) 14.884 1.084 ( -3.941 -0.306 -2.487) 4.670 1.889 ( 3.668 -5.353 5.488) 8.498 2.005 ( -1.959 -6.871 -0.740) 7.183 2.525 ( 8.135 -9.927 7.856) 15.048 2.563 ( -10.037 -5.778 -2.055) 11.762 3.019 ( -9.094 2.173 27.637) 29.176 3.909 ( 0.097 -7.629 21.827) 23.122 4.559 ( 2.655 -1.574 -11.745) 12.144 4.850 ( 1.846 8.771 -16.444) 18.728 5.011 ( -6.495 -5.760 12.808) 15.472 5.878 ( 2.027 -13.849 -7.290) 15.781 6.260 ( 3.595 -12.310 2.078) 12.992 6.503 ( -4.034 3.569 3.224) 6.277 6.835 ( 1.174 -0.003 18.593) 18.630 7.305 ( -7.833 -4.616 13.530) 16.301 7.498 ( 2.438 5.034 -8.259) 9.975 8.649 ( 5.233 9.532 -15.990) 19.337 8.975 ( -1.448 16.752 4.444) 17.392 9.389 ( -6.566 -4.550 7.633) 11.049 9.946 ( 7.099 -10.186 -5.055) 13.405 10.211 ( 10.115 33.235 -30.447) 46.194 10.458 ( -2.380 5.954 13.605) 15.041 11.269 ( 3.161 18.994 -19.182) 27.179 12.499 ( -11.066 1.959 -0.120) 11.239 13.073 ( 10.269 9.624 -9.084) 16.751 14.414 ( -2.674 -39.879 37.195) 54.598 15.547 ( -5.762 -31.182 10.497) 33.402 16.286 ( -4.254 -15.560 2.585) 16.337 17.261 ( 5.930 -9.533 -12.131) 16.529 18.826 ( 2.590 16.067 1.073) 16.310 18.900 ( 0.592 18.271 -3.730) 18.657 19.122 ( 4.303 0.576 3.843) 5.798 19.365 ( -5.804 9.669 -13.201) 17.362 ======================= Grid point 552 (284/366) ======================= q-point: (-0.18 -0.55 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.357 ( -0.950 4.829 -0.473) 4.944 0.817 ( 4.503 12.213 -9.502) 16.116 0.951 ( -1.008 -1.597 1.848) 2.643 1.061 ( -1.261 0.579 -1.928) 2.376 2.013 ( 1.548 -4.272 5.662) 7.260 2.102 ( -0.801 -5.099 1.497) 5.374 2.541 ( -14.175 -3.616 -3.864) 15.131 2.782 ( 9.593 -5.225 16.328) 19.646 3.147 ( 3.466 -13.502 10.366) 17.372 4.106 ( 0.280 -7.521 19.769) 21.153 4.308 ( 3.023 20.237 -22.891) 30.703 4.641 ( -3.322 9.932 -10.535) 14.855 5.313 ( -6.048 -21.650 21.509) 31.112 6.039 ( -4.468 -3.762 0.219) 5.844 6.352 ( -1.409 4.224 2.369) 5.044 6.416 ( 0.393 -0.447 -6.192) 6.221 7.027 ( 4.297 -11.265 12.589) 17.432 7.349 ( -0.312 -0.111 10.390) 10.395 7.482 ( -3.586 -5.749 -3.664) 7.703 8.386 ( 4.760 18.833 -11.820) 22.739 8.767 ( 5.003 4.775 -10.606) 12.662 9.462 ( -3.154 3.061 -4.154) 6.048 9.626 ( 5.943 19.659 -21.865) 29.998 10.099 ( 3.721 0.785 8.083) 8.933 10.452 ( 1.976 -5.313 1.732) 5.927 10.971 ( 0.768 12.415 -13.449) 18.319 12.421 ( -8.726 -1.314 -3.500) 9.493 12.938 ( 10.606 10.124 -7.318) 16.387 15.181 ( -7.439 -37.611 38.176) 54.105 16.060 ( -10.895 -24.281 24.476) 36.157 16.445 ( -5.654 -6.373 3.754) 9.310 17.342 ( 0.193 2.607 1.485) 3.006 18.537 ( 6.984 15.282 -15.291) 22.719 18.620 ( 7.914 13.173 -15.362) 21.729 19.110 ( -4.136 2.255 -3.006) 5.588 19.206 ( 2.986 3.326 -1.650) 4.764 ======================= Grid point 553 (285/366) ======================= q-point: (-0.09 -0.55 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.378 ( 3.076 -7.147 -8.809) 11.753 0.615 ( 4.894 10.640 -9.796) 15.268 0.978 ( -0.115 -0.634 0.075) 0.649 1.044 ( 0.323 -0.537 -2.088) 2.180 2.060 ( -2.122 0.551 4.190) 4.728 2.190 ( 1.506 -3.189 4.784) 5.944 2.479 ( -14.970 -2.177 -3.898) 15.622 2.965 ( 9.188 -3.548 15.717) 18.548 3.521 ( 10.613 -18.927 -1.647) 21.762 3.859 ( 1.038 23.298 -20.147) 30.818 4.272 ( -2.669 -3.132 11.316) 12.041 4.418 ( -3.461 5.837 0.620) 6.814 5.719 ( -6.278 -19.703 19.137) 28.175 5.913 ( -11.394 10.740 13.278) 20.530 6.289 ( 4.355 2.911 -3.313) 6.198 6.422 ( 0.531 -0.929 -10.175) 10.231 7.227 ( -4.833 -5.066 4.944) 8.572 7.369 ( 5.052 2.671 9.815) 11.357 7.653 ( -0.674 -17.059 -4.480) 17.650 8.025 ( 4.586 20.180 -6.301) 21.633 8.816 ( 9.567 -9.161 -22.417) 26.038 9.058 ( 11.493 22.431 -30.267) 39.387 9.655 ( -10.300 -9.295 7.662) 15.849 10.032 ( -0.879 8.948 15.699) 18.091 10.638 ( 4.991 -7.613 -6.407) 11.132 10.750 ( 1.932 6.515 -10.629) 12.616 12.416 ( -5.370 -5.078 -6.926) 10.129 12.830 ( 9.140 7.172 -4.628) 12.506 15.838 ( -10.712 -30.046 37.904) 49.541 16.106 ( -16.242 16.406 33.618) 40.781 16.719 ( -5.601 -25.106 10.108) 27.638 17.159 ( -4.486 17.632 13.304) 22.539 18.349 ( 9.755 5.453 -28.406) 30.525 18.460 ( 13.753 5.750 -28.792) 32.422 19.032 ( -4.238 1.454 -2.243) 5.010 19.214 ( 4.092 -0.499 0.301) 4.134 ======================= Grid point 560 (286/366) ======================= q-point: (-0.45 -0.45 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.933 ( -0.473 0.000 4.306) 4.332 1.067 ( -8.727 0.000 -1.025) 8.787 1.319 ( -3.427 0.000 6.670) 7.499 1.412 ( -2.276 0.000 3.617) 4.273 1.604 ( -1.478 0.000 -0.952) 1.758 1.678 ( 2.187 -0.000 -4.209) 4.743 1.998 ( 6.854 -0.000 11.336) 13.246 2.540 ( -11.313 0.000 -10.570) 15.482 3.478 ( -12.581 0.000 22.873) 26.104 3.708 ( -0.745 0.000 23.165) 23.177 3.897 ( -12.564 0.000 20.605) 24.133 4.812 ( 11.180 -0.000 -22.742) 25.342 5.199 ( -5.139 0.000 24.441) 24.975 5.354 ( -0.153 0.000 -6.858) 6.859 5.743 ( 8.492 -0.000 -5.354) 10.039 6.461 ( 2.356 -0.000 -14.040) 14.236 7.146 ( -11.342 0.000 12.521) 16.894 7.164 ( -8.391 0.000 27.645) 28.890 7.806 ( 9.870 -0.000 -9.918) 13.992 8.606 ( -0.918 0.000 9.007) 9.054 9.139 ( 7.255 -0.000 -18.599) 19.964 9.526 ( 0.786 -0.000 -11.465) 11.492 10.235 ( -1.826 0.000 15.571) 15.678 10.956 ( -2.932 0.000 -9.502) 9.944 11.280 ( -11.328 0.000 29.960) 32.030 11.883 ( -0.081 0.000 28.363) 28.363 12.665 ( -11.813 0.000 3.045) 12.199 13.192 ( 8.578 -0.000 -22.143) 23.747 13.632 ( 19.915 -0.000 -11.812) 23.154 13.910 ( 5.731 -0.000 -28.236) 28.812 15.501 ( -5.318 0.000 13.945) 14.925 16.720 ( 8.332 -0.000 -21.168) 22.749 19.034 ( 7.102 -0.000 6.599) 9.694 19.332 ( -7.454 0.000 10.587) 12.948 19.553 ( -4.325 0.000 8.359) 9.412 19.885 ( -5.315 0.000 -25.616) 26.162 ======================= Grid point 561 (287/366) ======================= q-point: (-0.36 -0.45 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.934 ( -1.849 0.751 4.634) 5.046 1.002 ( -5.834 1.899 2.194) 6.516 1.098 ( -7.887 11.812 3.939) 14.739 1.448 ( 0.759 8.461 -3.692) 9.262 1.621 ( 0.048 -9.934 4.905) 11.079 1.758 ( 0.463 -5.604 -1.671) 5.866 2.159 ( 6.936 -8.112 12.085) 16.123 2.447 ( -10.213 -0.877 -9.273) 13.823 3.331 ( -13.797 11.060 27.926) 33.054 3.721 ( -5.211 -0.553 23.005) 23.594 4.057 ( -5.981 -14.497 17.206) 23.281 4.860 ( 7.250 -2.924 -20.945) 22.356 5.224 ( -0.687 0.957 -0.975) 1.529 5.476 ( 4.360 -11.109 9.625) 15.332 5.762 ( 5.154 -1.424 -3.382) 6.327 6.476 ( 0.889 -3.345 -11.198) 11.721 7.053 ( -9.168 5.504 11.698) 15.849 7.177 ( -8.996 -0.661 26.060) 27.577 7.782 ( 7.539 6.440 -9.703) 13.873 8.672 ( -0.879 -4.612 4.212) 6.308 9.127 ( 5.134 0.997 -13.905) 14.856 9.570 ( 2.215 -7.286 -10.712) 13.143 10.082 ( -3.312 20.955 17.785) 27.684 10.808 ( -3.141 13.562 7.205) 15.675 10.956 ( -3.860 15.199 4.108) 16.210 12.273 ( 1.928 4.698 -3.051) 5.924 12.625 ( -10.731 -10.054 10.594) 18.124 12.800 ( 2.050 11.214 -5.587) 12.696 13.695 ( 20.215 2.821 -7.188) 21.639 14.355 ( 4.064 -35.274 -17.806) 39.722 15.632 ( -4.548 -13.852 10.553) 17.998 16.817 ( 8.549 -10.049 -20.872) 24.692 19.096 ( 6.406 0.569 6.658) 9.257 19.251 ( -7.376 5.007 5.745) 10.606 19.462 ( -3.675 9.214 7.288) 12.310 19.720 ( -6.476 7.114 -18.287) 20.662 ======================= Grid point 562 (288/366) ======================= q-point: (-0.27 -0.45 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.781 ( -3.728 15.208 8.600) 17.865 0.923 ( -3.887 0.169 3.465) 5.210 1.014 ( -5.638 -2.691 0.355) 6.257 1.258 ( 2.367 11.563 -6.260) 13.360 1.809 ( 1.534 -8.030 5.061) 9.615 1.868 ( 0.057 -6.855 -1.395) 6.995 2.394 ( -9.080 -3.007 -5.582) 11.075 2.418 ( 7.760 -11.314 11.157) 17.684 3.130 ( -13.173 8.729 33.047) 36.631 3.819 ( -3.844 -6.961 22.010) 23.402 4.356 ( -1.671 -16.650 9.843) 19.414 4.849 ( -0.362 1.264 -17.816) 17.864 5.138 ( 3.283 9.132 -8.880) 13.154 5.659 ( 4.694 -8.041 -5.302) 10.715 6.019 ( 4.482 -18.302 8.802) 20.797 6.502 ( -1.254 -1.289 -3.892) 4.287 6.931 ( -5.521 5.020 14.342) 16.167 7.210 ( -8.821 -2.941 19.994) 22.051 7.644 ( 4.533 9.567 -9.534) 14.247 8.725 ( 2.228 -0.050 -8.005) 8.309 9.110 ( -1.444 0.432 -0.686) 1.656 9.610 ( -3.161 26.746 13.081) 29.941 9.758 ( 4.367 -11.547 -7.524) 14.457 10.601 ( -1.188 10.624 7.237) 12.910 10.681 ( 0.794 16.852 -8.447) 18.867 11.731 ( 8.795 34.671 -28.212) 45.556 12.490 ( -10.764 4.921 3.371) 12.306 13.139 ( 0.227 -11.447 4.097) 12.160 13.922 ( 11.198 -20.163 17.575) 28.997 14.958 ( -0.566 -33.241 -3.305) 33.409 15.941 ( -3.415 -19.492 4.658) 20.330 17.048 ( 8.248 -13.868 -18.708) 24.705 19.065 ( -1.222 8.665 5.587) 10.382 19.157 ( -0.255 2.963 0.690) 3.053 19.228 ( -1.557 14.874 4.977) 15.762 19.476 ( -4.760 10.316 -11.151) 15.919 ======================= Grid point 563 (289/366) ======================= q-point: (-0.18 -0.45 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.522 ( -2.773 12.738 6.398) 14.521 0.918 ( -2.868 -1.181 3.111) 4.393 1.031 ( -0.762 2.099 -0.999) 2.447 1.048 ( 2.217 8.205 -6.611) 10.768 1.945 ( 0.062 -5.296 3.266) 6.222 1.999 ( 1.923 -7.088 1.975) 7.605 2.381 ( -10.201 -3.668 -3.769) 11.477 2.732 ( 10.451 -12.256 11.837) 19.989 3.052 ( -7.533 -0.516 27.013) 28.048 4.009 ( -2.163 -9.075 20.852) 22.844 4.531 ( 3.958 4.705 -14.859) 16.081 4.764 ( -0.233 5.006 -17.749) 18.443 5.010 ( -5.490 -5.831 14.468) 16.537 5.857 ( 0.700 -11.911 -7.337) 14.007 6.303 ( 0.980 -7.093 2.972) 7.752 6.469 ( -2.381 3.482 0.760) 4.286 6.943 ( 1.430 -4.756 14.321) 15.157 7.274 ( -8.619 -5.674 16.306) 19.297 7.497 ( 3.982 6.132 -7.722) 10.634 8.642 ( 5.878 9.038 -14.999) 18.472 8.977 ( -1.712 15.112 4.513) 15.864 9.336 ( -6.786 -0.506 6.759) 9.591 10.008 ( 6.201 -11.958 -6.044) 14.764 10.189 ( 10.047 31.231 -29.346) 44.017 10.494 ( -3.371 6.451 14.189) 15.947 11.220 ( 4.612 19.985 -19.071) 28.007 12.367 ( -8.711 2.210 1.543) 9.118 13.151 ( 7.780 7.492 -7.911) 13.388 14.565 ( -2.904 -35.922 32.354) 48.432 15.527 ( -4.958 -31.430 9.591) 33.232 16.246 ( -3.751 -14.495 3.095) 15.289 17.276 ( 5.581 -9.439 -11.827) 16.128 18.863 ( 2.222 17.391 -0.754) 17.549 18.894 ( 1.728 15.468 -3.016) 15.853 19.112 ( -5.977 3.260 -4.758) 8.306 19.300 ( 2.971 5.416 -1.992) 6.491 ======================= Grid point 564 (290/366) ======================= q-point: (-0.09 -0.45 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.352 ( 0.307 4.881 -0.228) 4.896 0.827 ( 4.216 11.956 -9.320) 15.735 0.944 ( -1.312 -2.186 1.857) 3.154 1.044 ( -0.137 0.131 -1.101) 1.117 2.029 ( -0.998 -3.461 2.228) 4.236 2.140 ( 2.755 -5.352 4.608) 7.581 2.349 ( -10.901 -1.668 -3.232) 11.491 2.972 ( 4.150 -5.020 19.332) 20.399 3.266 ( 6.983 -16.924 6.725) 19.504 4.182 ( -2.310 -2.829 11.458) 12.026 4.245 ( 3.428 17.488 -13.947) 22.630 4.546 ( -1.850 10.382 -12.587) 16.421 5.334 ( -6.988 -22.504 20.173) 31.019 5.971 ( -5.764 -1.204 1.387) 6.049 6.346 ( -1.968 0.779 1.923) 2.859 6.387 ( 1.043 1.861 -6.318) 6.668 7.112 ( 0.602 -7.061 7.639) 10.420 7.392 ( -5.801 -8.963 12.831) 16.692 7.461 ( 5.685 0.283 -2.815) 6.350 8.396 ( 5.593 18.336 -10.837) 22.021 8.774 ( 4.369 4.600 -10.854) 12.572 9.394 ( -6.184 -3.407 3.215) 7.758 9.599 ( 10.223 26.513 -29.600) 41.032 10.173 ( 0.582 0.915 8.507) 8.576 10.484 ( 1.725 -6.518 0.476) 6.759 10.922 ( 2.360 12.664 -12.510) 17.957 12.310 ( -5.301 -1.314 -1.695) 5.718 13.022 ( 7.658 9.282 -7.848) 14.366 15.263 ( -9.699 -35.766 35.474) 51.300 16.046 ( -10.452 -23.950 24.770) 36.005 16.399 ( -3.984 -6.241 3.674) 8.266 17.351 ( -0.117 2.825 1.650) 3.273 18.540 ( 6.015 15.807 -15.655) 23.046 18.652 ( 8.601 13.249 -16.047) 22.517 19.020 ( -4.467 1.159 -3.241) 5.639 19.259 ( 3.411 2.458 0.265) 4.212 ======================= Grid point 572 (291/366) ======================= q-point: (-0.36 -0.36 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.923 ( -11.696 0.000 -0.664) 11.715 0.946 ( -1.327 0.000 5.391) 5.552 1.305 ( -4.028 0.000 7.526) 8.536 1.403 ( -2.781 0.000 6.643) 7.202 1.581 ( -0.965 0.000 -1.843) 2.081 1.689 ( 2.277 -0.000 -3.573) 4.237 2.162 ( 6.701 -0.000 15.061) 16.485 2.351 ( -8.006 0.000 -10.107) 12.894 3.417 ( -13.213 0.000 21.933) 25.606 3.823 ( -0.831 0.000 22.108) 22.124 3.836 ( -12.443 0.000 20.785) 24.225 4.847 ( 11.453 -0.000 -22.226) 25.003 5.294 ( -1.811 0.000 29.377) 29.433 5.308 ( 0.225 -0.000 -10.160) 10.162 5.826 ( 8.066 -0.000 -6.191) 10.168 6.410 ( 1.977 -0.000 -15.914) 16.036 7.043 ( -12.887 0.000 10.159) 16.410 7.197 ( -7.958 0.000 26.286) 27.464 7.873 ( 7.222 -0.000 -9.163) 11.667 8.639 ( -0.746 0.000 7.466) 7.503 9.139 ( 6.784 -0.000 -16.994) 18.298 9.476 ( 0.932 -0.000 -11.378) 11.416 10.289 ( -2.774 0.000 16.395) 16.628 10.882 ( -0.499 0.000 -9.507) 9.520 11.282 ( -11.698 0.000 29.680) 31.902 12.031 ( 1.446 -0.000 23.265) 23.310 12.527 ( -11.592 0.000 5.862) 12.990 13.184 ( 7.567 -0.000 -22.019) 23.283 13.848 ( 8.267 -0.000 -30.692) 31.786 13.850 ( 20.726 -0.000 -10.781) 23.362 15.502 ( -5.437 0.000 13.780) 14.814 16.721 ( 8.335 -0.000 -21.190) 22.770 19.163 ( 6.309 -0.000 7.195) 9.570 19.234 ( -11.129 0.000 -2.077) 11.321 19.541 ( -3.907 0.000 8.101) 8.994 19.709 ( -5.711 0.000 -8.887) 10.564 ======================= Grid point 573 (292/366) ======================= q-point: (-0.27 -0.36 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.866 ( -9.943 -2.155 1.216) 10.246 0.956 ( -2.210 -0.784 5.210) 5.713 1.065 ( -3.605 15.817 8.843) 18.476 1.440 ( 0.840 8.074 -3.614) 8.886 1.636 ( -1.681 -11.634 5.474) 12.967 1.760 ( 1.055 -5.312 -1.894) 5.737 2.289 ( -5.094 -1.336 -7.472) 9.141 2.322 ( 5.768 -7.602 13.441) 16.484 3.296 ( -12.962 9.050 27.827) 32.004 3.756 ( -7.752 -1.136 23.533) 24.803 4.073 ( -4.536 -15.149 15.052) 21.832 4.851 ( 7.740 1.598 -20.751) 22.205 5.200 ( 0.102 2.301 -6.226) 6.638 5.602 ( 4.542 -12.501 13.980) 19.296 5.818 ( 5.556 -1.516 -3.030) 6.508 6.429 ( 1.027 -4.038 -11.416) 12.152 6.964 ( -12.045 1.811 9.471) 15.429 7.201 ( -7.673 0.751 24.737) 25.911 7.815 ( 4.830 7.814 -9.474) 13.196 8.682 ( -0.634 -2.895 3.279) 4.419 9.123 ( 4.816 1.606 -12.879) 13.844 9.547 ( 2.563 -9.498 -10.347) 14.278 10.126 ( -4.511 21.585 18.140) 28.554 10.795 ( 0.944 7.809 -5.090) 9.369 10.942 ( -6.760 20.055 16.590) 26.891 12.273 ( 2.028 13.481 -6.835) 15.250 12.554 ( -5.760 -4.255 6.699) 9.806 12.801 ( 0.403 1.087 -1.345) 1.776 13.923 ( 18.389 0.877 -7.791) 19.991 14.323 ( 5.633 -35.587 -18.847) 40.662 15.626 ( -4.737 -13.237 10.690) 17.662 16.821 ( 8.497 -10.459 -20.927) 24.890 19.123 ( -10.534 2.167 -5.141) 11.921 19.207 ( 4.225 1.573 6.206) 7.671 19.454 ( -3.203 9.055 7.087) 11.937 19.596 ( -3.812 7.146 -1.334) 8.209 ======================= Grid point 574 (293/366) ======================= q-point: (-0.18 -0.36 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.778 ( -3.512 15.016 8.617) 17.665 0.872 ( -4.612 -2.347 3.388) 6.185 0.983 ( -1.865 -2.257 3.729) 4.741 1.257 ( 2.297 11.210 -6.146) 12.989 1.831 ( -0.899 -8.391 3.045) 8.972 1.877 ( 0.590 -7.881 1.426) 8.031 2.270 ( -3.717 -1.964 -5.306) 6.770 2.587 ( 7.133 -12.740 11.981) 18.887 3.135 ( -11.906 7.121 32.987) 35.786 3.869 ( -5.871 -8.863 21.590) 24.066 4.381 ( -1.733 -17.323 7.777) 19.067 4.765 ( 2.296 5.495 -17.883) 18.848 5.116 ( 0.983 7.587 -10.182) 12.736 5.686 ( 4.147 -3.768 -7.414) 9.293 6.130 ( 3.915 -16.264 10.990) 20.015 6.473 ( -0.234 -1.909 -2.952) 3.523 6.903 ( -8.511 -1.566 10.749) 13.800 7.207 ( -7.515 -0.706 20.446) 21.795 7.647 ( 3.351 9.705 -9.405) 13.924 8.718 ( 2.523 0.055 -6.850) 7.300 9.090 ( -0.648 1.452 -1.404) 2.121 9.627 ( -4.689 28.524 13.148) 31.757 9.774 ( 3.847 -13.620 -7.474) 16.006 10.606 ( 4.031 14.348 -10.941) 18.488 10.667 ( -4.242 12.392 10.502) 16.789 11.710 ( 10.073 35.303 -27.964) 46.149 12.393 ( -6.591 5.667 4.877) 9.968 13.159 ( -0.907 -12.817 4.849) 13.734 14.125 ( 6.709 -17.120 10.895) 21.373 14.938 ( 0.610 -33.491 -4.207) 33.759 15.922 ( -3.251 -18.732 5.246) 19.722 17.058 ( 7.942 -14.160 -18.758) 24.808 19.015 ( -5.794 2.052 -3.212) 6.935 19.156 ( -0.449 9.218 3.482) 9.864 19.228 ( -1.656 14.528 3.418) 15.016 19.433 ( 0.796 8.101 0.867) 8.186 ======================= Grid point 575 (294/366) ======================= q-point: (-0.09 -0.36 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.525 ( -1.820 12.782 6.508) 14.459 0.900 ( -2.190 -2.087 3.572) 4.681 1.024 ( -0.288 -1.270 0.933) 1.602 1.048 ( 3.093 11.215 -7.801) 14.007 1.948 ( -0.371 -5.421 1.524) 5.643 2.042 ( -0.174 -8.332 4.395) 9.422 2.268 ( -2.784 -1.001 -2.631) 3.959 2.916 ( 7.096 -12.665 11.507) 18.524 3.095 ( -6.563 -3.492 24.650) 25.747 4.063 ( -5.654 -9.686 19.127) 22.173 4.520 ( 6.896 9.574 -16.318) 20.137 4.669 ( 0.045 3.623 -17.307) 17.682 5.004 ( -6.738 -8.000 14.374) 17.777 5.826 ( 0.668 -9.789 -7.389) 12.282 6.321 ( -1.308 -2.551 5.284) 6.011 6.450 ( -1.350 3.745 1.470) 4.244 7.009 ( -0.925 -8.800 8.397) 12.199 7.246 ( -8.001 -4.628 16.043) 18.515 7.520 ( 4.140 3.793 -5.566) 7.906 8.649 ( 6.775 8.370 -14.568) 18.116 8.978 ( -1.970 14.073 5.712) 15.315 9.283 ( -6.174 2.562 6.298) 9.184 10.045 ( 4.336 -12.951 -7.054) 15.371 10.174 ( 10.635 30.273 -28.819) 43.129 10.513 ( -5.032 6.460 14.099) 16.305 11.196 ( 6.793 20.728 -18.648) 28.698 12.294 ( -3.829 2.705 3.677) 5.958 13.194 ( 4.671 6.057 -7.879) 10.981 14.655 ( -7.714 -33.274 27.376) 43.773 15.516 ( -4.021 -31.538 9.150) 33.084 16.221 ( -2.688 -13.946 3.918) 14.734 17.286 ( 5.066 -9.390 -11.788) 15.900 18.867 ( 0.698 18.948 -3.489) 19.279 18.925 ( 4.070 12.127 -1.195) 12.848 19.006 ( -4.433 3.967 -3.997) 7.167 19.342 ( 2.317 4.429 0.368) 5.011 ======================= Grid point 584 (295/366) ======================= q-point: (-0.27 -0.27 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.771 ( -10.399 0.000 2.835) 10.778 0.954 ( -2.046 0.000 5.916) 6.260 1.292 ( -4.098 0.000 8.486) 9.423 1.413 ( -1.163 0.000 7.107) 7.202 1.560 ( -0.235 0.000 -2.554) 2.565 1.699 ( 1.748 -0.000 -3.193) 3.640 2.234 ( -1.912 0.000 -8.450) 8.663 2.320 ( 4.339 -0.000 15.436) 16.034 3.365 ( -11.601 0.000 22.276) 25.116 3.788 ( -11.060 0.000 21.116) 23.837 3.902 ( -3.910 0.000 19.345) 19.736 4.881 ( 10.931 -0.000 -22.311) 24.845 5.260 ( 1.563 -0.000 -12.031) 12.132 5.451 ( 0.251 -0.000 32.829) 32.830 5.887 ( 6.124 -0.000 -6.995) 9.297 6.350 ( 1.569 -0.000 -15.562) 15.641 6.912 ( -13.752 0.000 8.552) 16.195 7.225 ( -7.798 0.000 24.576) 25.784 7.899 ( 3.658 -0.000 -8.995) 9.710 8.662 ( -1.026 0.000 5.718) 5.809 9.142 ( 6.277 -0.000 -15.598) 16.813 9.437 ( 2.104 -0.000 -10.875) 11.077 10.326 ( -4.771 0.000 16.629) 17.300 10.847 ( 3.034 -0.000 -9.760) 10.220 11.277 ( -12.207 0.000 29.483) 31.910 12.153 ( 0.248 -0.000 18.112) 18.114 12.431 ( -7.846 0.000 8.611) 11.649 13.165 ( 6.903 -0.000 -22.145) 23.196 13.812 ( 11.061 -0.000 -31.951) 33.811 14.042 ( 15.993 -0.000 -13.648) 21.024 15.499 ( -5.844 0.000 13.854) 15.036 16.721 ( 8.328 -0.000 -21.212) 22.788 19.045 ( -10.620 0.000 -7.447) 12.971 19.267 ( 3.369 -0.000 6.633) 7.440 19.534 ( -3.263 0.000 7.894) 8.542 19.645 ( -3.243 0.000 4.788) 5.783 ======================= Grid point 585 (296/366) ======================= q-point: (-0.18 -0.27 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.768 ( -5.264 -4.270 4.286) 8.020 0.957 ( -2.299 -0.344 5.726) 6.180 1.072 ( -2.509 15.227 8.940) 17.835 1.434 ( 1.112 7.983 -3.692) 8.865 1.640 ( -1.796 -11.907 5.549) 13.259 1.762 ( 0.786 -5.267 -1.938) 5.667 2.222 ( 1.519 -1.084 -6.527) 6.789 2.461 ( 3.250 -8.282 13.171) 15.894 3.279 ( -11.194 7.140 27.765) 30.777 3.766 ( -8.865 -2.656 23.163) 24.943 4.083 ( -5.380 -14.620 13.592) 20.675 4.851 ( 8.824 4.557 -21.367) 23.562 5.168 ( 1.276 3.471 -8.849) 9.591 5.716 ( 2.539 -3.564 7.663) 8.824 5.889 ( 4.738 -9.531 5.847) 12.144 6.387 ( 0.977 -5.513 -9.316) 10.869 6.838 ( -13.238 0.119 8.439) 15.700 7.225 ( -7.469 1.009 22.752) 23.968 7.812 ( 2.197 8.230 -9.544) 12.792 8.688 ( -0.749 -2.056 2.605) 3.402 9.121 ( 4.717 2.088 -12.308) 13.345 9.532 ( 3.200 -10.780 -9.894) 14.978 10.148 ( -6.425 21.859 17.980) 29.024 10.794 ( 4.967 6.409 -9.655) 12.608 10.937 ( -9.079 21.321 21.072) 31.322 12.269 ( 2.674 15.676 -5.142) 16.713 12.542 ( 1.006 3.314 0.054) 3.464 12.791 ( -2.272 -6.024 1.987) 6.738 14.070 ( 10.140 -0.110 -12.354) 15.983 14.306 ( 6.736 -35.499 -19.450) 41.035 15.617 ( -5.076 -12.923 11.150) 17.808 16.824 ( 8.364 -10.725 -21.013) 25.031 18.970 ( -5.879 -0.122 -4.635) 7.487 19.275 ( 0.855 3.023 5.789) 6.587 19.452 ( -2.522 9.036 6.895) 11.643 19.580 ( -1.426 6.517 5.866) 8.883 ======================= Grid point 586 (297/366) ======================= q-point: (-0.09 -0.27 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.779 ( -2.565 12.127 7.892) 14.695 0.858 ( -0.919 -0.491 5.034) 5.141 0.983 ( -1.206 -2.154 3.749) 4.488 1.255 ( 2.300 11.011 -6.134) 12.812 1.835 ( -0.680 -8.342 2.740) 8.807 1.879 ( -1.438 -8.395 1.531) 8.654 2.252 ( 4.324 -1.134 -3.213) 5.505 2.716 ( 3.309 -14.147 8.811) 16.992 3.156 ( -10.605 6.082 32.283) 34.520 3.887 ( -8.009 -9.478 20.581) 24.033 4.385 ( -3.593 -18.286 6.938) 19.886 4.733 ( 7.304 8.199 -18.109) 21.178 5.066 ( -0.087 7.686 -10.166) 12.745 5.689 ( 2.723 -1.925 -8.807) 9.418 6.230 ( 1.698 -11.602 12.132) 16.873 6.468 ( 0.284 -2.852 1.167) 3.094 6.819 ( -11.266 -7.223 8.364) 15.782 7.217 ( -6.603 0.427 18.985) 20.105 7.637 ( 2.571 8.606 -9.338) 12.957 8.721 ( 3.033 -0.373 -6.062) 6.789 9.079 ( 0.178 1.908 -1.419) 2.385 9.621 ( -6.158 29.153 12.532) 32.324 9.781 ( 2.926 -13.770 -7.296) 15.856 10.612 ( 7.997 16.566 -16.614) 24.787 10.660 ( -7.550 10.411 16.175) 20.665 11.710 ( 11.717 35.574 -27.741) 46.609 12.371 ( -1.107 6.195 6.560) 9.090 13.165 ( -1.887 -13.303 4.647) 14.217 14.189 ( -4.110 -16.139 5.108) 17.420 14.931 ( 1.799 -33.618 -4.488) 33.964 15.910 ( -2.916 -18.561 6.016) 19.729 17.063 ( 7.515 -14.301 -18.930) 24.886 18.949 ( -0.743 -0.474 -1.539) 1.774 19.173 ( -0.571 10.741 4.839) 11.795 19.227 ( -0.984 15.344 3.159) 15.697 19.456 ( 0.628 7.159 2.281) 7.539 ======================= Grid point 596 (298/366) ======================= q-point: (-0.18 -0.18 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.715 ( -0.561 0.000 5.920) 5.946 0.952 ( -2.750 0.000 5.654) 6.287 1.286 ( -3.728 0.000 9.132) 9.864 1.440 ( -0.257 0.000 6.133) 6.138 1.550 ( 0.762 -0.000 -2.658) 2.765 1.701 ( 1.185 -0.000 -3.168) 3.382 2.218 ( 5.419 -0.000 -6.268) 8.286 2.427 ( 0.284 -0.000 12.316) 12.319 3.343 ( -9.269 0.000 22.606) 24.432 3.765 ( -8.889 0.000 21.426) 23.196 3.920 ( -7.601 0.000 17.565) 19.139 4.903 ( 9.995 -0.000 -22.884) 24.971 5.230 ( 3.340 -0.000 -11.543) 12.016 5.619 ( -2.040 0.000 32.419) 32.483 5.917 ( 4.129 -0.000 -7.310) 8.395 6.294 ( 1.489 -0.000 -13.346) 13.429 6.777 ( -12.529 0.000 8.986) 15.419 7.244 ( -8.112 0.000 23.009) 24.397 7.877 ( 0.433 -0.000 -9.235) 9.245 8.670 ( -1.887 0.000 4.564) 4.939 9.143 ( 5.957 -0.000 -15.104) 16.236 9.422 ( 4.015 -0.000 -10.129) 10.896 10.334 ( -7.015 0.000 16.289) 17.736 10.861 ( 6.647 -0.000 -9.987) 11.997 11.265 ( -12.719 0.000 29.460) 32.089 12.218 ( -3.746 0.000 14.945) 15.407 12.414 ( -2.189 0.000 10.468) 10.695 13.139 ( 6.723 -0.000 -22.574) 23.554 13.809 ( 13.471 -0.000 -31.880) 34.609 14.100 ( 4.579 -0.000 -18.980) 19.525 15.491 ( -6.351 0.000 14.425) 15.762 16.721 ( 8.321 -0.000 -21.230) 22.803 18.935 ( -0.798 0.000 -1.823) 1.990 19.315 ( -0.891 0.000 4.940) 5.020 19.537 ( -2.506 0.000 8.047) 8.429 19.652 ( -1.022 0.000 7.727) 7.794 ======================= Grid point 597 (299/366) ======================= q-point: (-0.09 -0.18 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.783 ( 3.257 -3.590 5.108) 7.042 0.952 ( -2.647 -0.575 5.056) 5.736 1.088 ( -2.148 14.666 8.714) 17.195 1.431 ( 1.454 8.091 -3.655) 8.997 1.647 ( -1.546 -11.272 5.257) 12.534 1.762 ( 1.022 -5.278 -2.243) 5.825 2.262 ( 8.554 -1.138 -4.551) 9.756 2.533 ( -1.308 -8.895 8.629) 12.462 3.287 ( -9.286 5.871 27.403) 29.524 3.767 ( -8.711 -2.924 22.466) 24.272 4.068 ( -7.311 -14.510 13.308) 21.002 4.863 ( 9.762 4.864 -21.850) 24.421 5.147 ( 2.732 5.149 -8.830) 10.580 5.738 ( -0.728 4.155 -2.073) 4.700 5.995 ( 1.165 -15.889 14.978) 21.867 6.358 ( 0.679 -7.370 -6.035) 9.550 6.716 ( -11.180 0.597 9.785) 14.869 7.238 ( -7.839 0.956 21.185) 22.609 7.778 ( 0.487 7.408 -9.766) 12.267 8.688 ( -1.274 -2.278 2.545) 3.645 9.120 ( 4.876 2.277 -12.476) 13.587 9.529 ( 4.080 -10.518 -9.534) 14.771 10.142 ( -8.196 21.696 17.413) 29.002 10.829 ( 8.284 6.457 -11.240) 15.383 10.917 ( -10.739 21.897 22.441) 33.142 12.301 ( 6.340 17.486 -5.760) 19.472 12.572 ( 3.792 5.646 -1.567) 6.980 12.759 ( -4.958 -10.330 4.568) 12.335 14.040 ( -3.355 0.467 -16.685) 17.026 14.305 ( 8.604 -36.007 -19.533) 41.858 15.608 ( -5.156 -12.962 11.893) 18.331 16.825 ( 8.201 -10.764 -21.104) 25.070 18.951 ( 4.348 -0.246 1.029) 4.475 19.288 ( -2.818 3.109 3.918) 5.741 19.460 ( -1.838 9.103 7.242) 11.777 19.606 ( 0.741 6.657 5.590) 8.724 ======================= Grid point 608 (300/366) ======================= q-point: (-0.09 -0.09 0.36) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.802 ( 7.884 -0.000 4.841) 9.252 0.939 ( -3.186 0.000 4.610) 5.604 1.288 ( -3.191 0.000 9.190) 9.729 1.464 ( -0.634 0.000 4.899) 4.940 1.554 ( 1.764 -0.000 -2.100) 2.742 1.700 ( 1.174 -0.000 -3.343) 3.543 2.310 ( 12.385 -0.000 -4.954) 13.339 2.448 ( -4.527 0.000 6.435) 7.868 3.352 ( -7.241 0.000 22.701) 23.828 3.774 ( -6.594 0.000 21.524) 22.511 3.887 ( -10.686 0.000 17.181) 20.233 4.910 ( 9.224 -0.000 -23.220) 24.985 5.229 ( 4.512 -0.000 -9.195) 10.242 5.697 ( -9.154 0.000 24.164) 25.840 5.927 ( 1.675 -0.000 -4.514) 4.814 6.256 ( 2.132 -0.000 -9.712) 9.943 6.697 ( -7.122 0.000 13.398) 15.173 7.249 ( -8.729 0.000 22.095) 23.756 7.819 ( -1.377 0.000 -9.874) 9.970 8.659 ( -3.286 0.000 4.493) 5.566 9.143 ( 6.082 -0.000 -15.762) 16.895 9.438 ( 5.963 -0.000 -9.425) 11.153 10.311 ( -8.642 0.000 15.427) 17.683 10.917 ( 9.363 -0.000 -10.088) 13.764 11.248 ( -12.880 0.000 29.668) 32.343 12.205 ( -10.139 0.000 15.118) 18.203 12.478 ( 3.015 -0.000 10.859) 11.270 13.111 ( 7.116 -0.000 -23.169) 24.237 13.838 ( 15.107 -0.000 -30.501) 34.037 13.972 ( -6.518 0.000 -21.703) 22.661 15.483 ( -6.315 0.000 15.082) 16.351 16.721 ( 8.318 -0.000 -21.243) 22.813 19.003 ( 8.931 -0.000 3.456) 9.576 19.294 ( -5.150 0.000 2.522) 5.734 19.551 ( -2.129 0.000 8.578) 8.839 19.698 ( 3.191 -0.000 4.989) 5.922 ======================= Grid point 609 (301/366) ======================= q-point: ( 0.00 0.00 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.959 ( -5.218 0.000 1.199) 5.354 0.966 ( 7.598 -0.000 0.396) 7.609 1.444 ( -2.668 0.000 6.466) 6.995 1.509 ( -0.976 0.000 -0.070) 0.978 1.563 ( 2.952 -0.000 0.409) 2.980 1.613 ( 0.430 -0.000 -4.610) 4.630 2.351 ( -14.396 0.000 -0.716) 14.414 2.382 ( 16.331 -0.000 -4.053) 16.827 3.814 ( -5.755 0.000 20.175) 20.979 4.033 ( 1.947 -0.000 0.079) 1.948 4.129 ( -10.326 0.000 15.401) 18.542 4.474 ( 8.505 -0.000 -21.308) 22.942 5.263 ( 3.127 -0.000 8.240) 8.814 5.515 ( -1.812 0.000 -15.385) 15.491 6.045 ( -12.615 0.000 9.090) 15.549 6.167 ( 8.626 -0.000 -4.526) 9.742 7.142 ( 2.526 -0.000 20.463) 20.618 7.490 ( -2.095 0.000 -15.642) 15.781 7.779 ( -13.185 0.000 32.074) 34.678 8.382 ( 11.043 -0.000 -27.972) 30.072 9.090 ( -6.674 0.000 8.833) 11.071 9.290 ( 7.924 -0.000 -10.624) 13.254 10.535 ( -10.614 0.000 13.544) 17.207 10.783 ( 10.993 -0.000 -12.248) 16.458 11.850 ( -13.299 0.000 33.359) 35.912 12.391 ( 0.861 -0.000 -5.959) 6.021 12.632 ( -0.608 0.000 -7.565) 7.589 12.728 ( 4.915 -0.000 1.305) 5.085 13.415 ( -12.175 0.000 -11.397) 16.677 13.436 ( 17.728 -0.000 -15.838) 23.772 15.849 ( -8.645 0.000 22.077) 23.709 16.291 ( 9.108 -0.000 -23.271) 24.990 19.227 ( -11.855 0.000 1.255) 11.921 19.237 ( 13.760 -0.000 0.959) 13.794 19.698 ( -0.269 0.000 4.587) 4.595 19.755 ( 1.041 -0.000 -1.936) 2.198 ======================= Grid point 610 (302/366) ======================= q-point: ( 0.09 0.00 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.939 ( -4.006 -1.150 0.606) 4.211 1.021 ( 6.592 -0.112 -0.283) 6.599 1.255 ( -2.158 13.017 5.700) 14.373 1.363 ( 2.344 12.271 -4.891) 13.416 1.673 ( -4.009 -7.837 1.897) 9.005 1.751 ( 3.522 -8.357 -2.077) 9.304 2.315 ( -14.058 -6.795 -2.512) 15.815 2.509 ( 14.772 -3.215 -1.986) 15.248 3.834 ( -6.556 -0.016 22.045) 22.999 4.087 ( -4.413 -2.241 10.053) 11.205 4.140 ( -4.394 -5.629 1.798) 7.364 4.499 ( 9.575 -2.460 -19.546) 21.904 5.192 ( 0.271 9.554 8.980) 13.115 5.380 ( 0.215 5.626 -14.883) 15.912 6.149 ( -11.965 -15.327 7.669) 20.902 6.345 ( 7.563 -11.903 -1.745) 14.210 7.139 ( 0.665 7.662 19.299) 20.774 7.376 ( 0.126 6.079 -15.150) 16.325 7.780 ( -12.742 -0.259 30.477) 33.034 8.382 ( 11.602 0.445 -28.392) 30.674 9.131 ( -5.536 -6.863 10.254) 13.524 9.371 ( 6.452 -6.043 -11.098) 14.188 10.371 ( -10.720 15.962 15.396) 24.632 10.727 ( 11.006 11.873 -14.271) 21.582 11.319 ( -13.195 34.179 27.256) 45.664 11.903 ( 13.696 39.805 -29.881) 51.623 12.883 ( 4.274 0.724 8.405) 9.457 12.913 ( -3.881 -15.361 2.547) 16.047 13.449 ( -19.403 -25.167 11.195) 33.693 13.974 ( 16.435 -40.215 -22.381) 48.870 15.952 ( -8.137 -10.947 21.664) 25.601 16.388 ( 8.840 -10.309 -23.335) 26.999 19.140 ( -11.019 1.068 0.027) 11.071 19.295 ( 10.397 3.867 1.628) 11.212 19.612 ( -1.129 10.375 4.136) 11.226 19.676 ( 3.445 8.701 -4.278) 10.290 ======================= Grid point 611 (303/366) ======================= q-point: ( 0.18 0.00 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.945 ( -2.391 -0.347 0.993) 2.612 0.966 ( -1.499 11.210 7.002) 13.302 1.105 ( 5.200 2.247 -2.350) 6.133 1.124 ( 2.358 13.934 -7.006) 15.773 1.775 ( -4.720 -6.619 2.325) 8.455 1.916 ( 4.384 -7.779 -1.993) 9.149 2.370 ( -13.116 -9.717 -5.229) 17.141 2.680 ( 11.328 -5.970 2.489) 13.045 3.797 ( -9.954 6.305 26.184) 28.713 4.073 ( -13.439 -0.205 17.161) 21.797 4.235 ( 6.592 -2.178 -17.057) 18.416 4.583 ( 12.768 -3.918 -18.555) 22.861 5.073 ( -5.714 1.488 15.042) 16.159 5.368 ( 5.354 -7.445 -14.389) 17.063 6.376 ( -11.642 -14.967 4.408) 19.467 6.596 ( 4.133 -8.838 3.963) 10.530 7.010 ( -2.581 9.409 16.959) 19.565 7.233 ( 4.351 5.729 -14.382) 16.081 7.773 ( -11.626 0.384 28.083) 30.397 8.357 ( 11.743 3.019 -28.688) 31.145 9.316 ( -3.061 -12.888 12.481) 18.200 9.507 ( 3.311 -7.432 -10.571) 13.340 9.876 ( -9.921 33.042 18.392) 39.095 10.356 ( 11.659 33.235 -22.052) 41.555 10.862 ( -10.267 15.236 17.749) 25.546 11.333 ( 11.741 23.083 -21.627) 33.740 12.863 ( 2.961 5.975 6.236) 9.129 12.879 ( -0.473 7.096 -9.980) 12.255 14.094 ( -19.516 -45.848 30.653) 58.503 14.773 ( 13.165 -42.281 -19.702) 48.468 16.220 ( -6.923 -17.384 20.508) 27.761 16.625 ( 8.107 -15.616 -23.055) 29.002 19.047 ( -7.918 2.378 -0.446) 8.279 19.198 ( 1.241 13.247 3.412) 13.735 19.339 ( -2.547 18.926 2.187) 19.221 19.521 ( 9.689 10.197 -6.464) 15.480 ======================= Grid point 612 (304/366) ======================= q-point: ( 0.27 0.00 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.723 ( -2.274 13.681 7.953) 15.987 0.857 ( 3.100 14.309 -9.001) 17.187 0.967 ( -1.480 -0.508 1.866) 2.436 1.104 ( 4.611 1.790 -4.169) 6.468 1.874 ( -4.438 -7.179 3.588) 9.171 2.078 ( 4.590 -7.239 -1.456) 8.694 2.429 ( -12.722 -7.695 -7.876) 16.825 2.887 ( 8.458 -8.180 7.120) 13.753 3.612 ( -11.936 12.376 24.970) 30.318 4.029 ( -11.743 -0.380 11.276) 16.285 4.158 ( 8.725 9.084 -19.038) 22.827 4.702 ( 15.060 -2.589 -16.077) 22.181 5.201 ( -9.529 -14.854 20.214) 26.834 5.607 ( 7.013 -16.821 -14.192) 23.098 6.464 ( -9.883 -0.023 4.476) 10.850 6.699 ( 0.298 -1.239 1.424) 1.911 6.900 ( -5.467 2.967 12.967) 14.382 7.230 ( 7.337 -4.110 -7.697) 11.400 7.763 ( -9.225 0.354 24.059) 25.769 8.280 ( 10.663 5.811 -25.776) 28.493 9.201 ( -7.361 32.421 15.374) 36.629 9.550 ( 1.236 -0.903 0.569) 1.633 9.678 ( 4.082 8.170 -14.626) 17.243 9.733 ( 5.140 9.060 -9.088) 13.824 10.643 ( -7.742 8.499 13.023) 17.371 11.061 ( 9.205 12.436 -14.911) 21.487 12.674 ( -1.674 8.987 -13.017) 15.907 12.810 ( 4.092 5.740 8.200) 10.813 14.874 ( -17.015 -44.695 31.823) 57.444 15.546 ( 9.515 -40.262 -14.511) 43.843 16.551 ( -5.934 -17.185 19.561) 26.705 16.904 ( 7.201 -15.611 -21.779) 27.747 18.812 ( -2.200 23.814 1.856) 23.987 18.899 ( 1.319 24.310 -1.152) 24.373 19.034 ( -7.499 3.048 -0.092) 8.095 19.411 ( 8.653 7.959 -4.877) 12.728 ======================= Grid point 613 (305/366) ======================= q-point: ( 0.36 0.00 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.506 ( -1.191 10.591 5.939) 12.201 0.598 ( 3.320 13.791 -9.541) 17.095 0.969 ( -1.052 -0.074 1.793) 2.080 1.075 ( 2.805 2.815 -4.032) 5.661 1.985 ( -3.286 -6.535 3.721) 8.207 2.218 ( 3.367 -5.141 0.025) 6.145 2.422 ( -11.466 -3.052 -8.509) 14.601 3.117 ( 5.992 -8.953 10.778) 15.239 3.385 ( -9.423 9.137 16.450) 21.045 3.913 ( 9.146 11.923 -16.215) 22.107 4.092 ( -8.334 -4.735 8.691) 12.939 4.744 ( 11.488 4.552 -9.515) 15.596 5.506 ( -10.096 -19.187 15.950) 26.916 5.921 ( 4.694 -15.796 -11.125) 19.882 6.364 ( -3.781 4.712 2.304) 6.466 6.592 ( 1.305 10.807 -0.331) 10.890 6.996 ( -6.844 -12.405 9.813) 17.234 7.335 ( 2.089 -3.472 -1.401) 4.287 7.763 ( -3.670 0.966 13.763) 14.277 8.154 ( 8.235 9.244 -16.640) 20.740 8.704 ( -3.382 20.447 7.121) 21.914 9.018 ( 8.869 29.860 -21.810) 38.025 9.769 ( -2.395 -7.622 -6.229) 10.131 9.939 ( -0.507 -12.669 10.614) 16.535 10.505 ( -4.864 5.118 8.855) 11.325 10.880 ( 7.493 10.461 -12.576) 17.993 12.482 ( -1.254 7.565 -10.057) 12.647 12.769 ( 3.607 3.424 4.748) 6.875 15.616 ( -14.872 -39.982 30.980) 52.721 16.266 ( 6.557 -37.141 -10.301) 39.097 16.821 ( -7.177 -10.834 22.408) 25.903 17.151 ( 6.053 -12.480 -18.326) 22.983 18.299 ( -0.685 30.431 -2.898) 30.576 18.416 ( 3.045 28.161 -5.839) 28.921 18.987 ( -3.969 -0.465 -0.388) 4.014 19.319 ( 4.683 5.986 -2.682) 8.060 ======================= Grid point 614 (306/366) ======================= q-point: ( 0.45 0.00 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.372 ( 2.859 10.111 -7.696) 13.024 0.393 ( 1.068 1.919 -0.578) 2.271 0.971 ( -0.718 -0.586 1.123) 1.456 1.031 ( 1.298 2.366 -2.814) 3.899 2.067 ( -1.733 -3.267 2.283) 4.346 2.298 ( 1.100 -1.725 1.463) 2.515 2.356 ( -7.416 0.916 -3.892) 8.425 3.283 ( -3.778 -3.609 5.619) 7.673 3.335 ( 3.374 -5.083 7.560) 9.715 3.723 ( 8.598 10.927 -12.207) 18.502 4.180 ( -5.211 -6.588 5.572) 10.080 4.662 ( 3.884 7.356 -1.505) 8.453 5.788 ( -8.669 -14.500 10.545) 19.915 6.122 ( 1.277 -4.002 -6.725) 7.929 6.254 ( 1.546 5.506 -2.940) 6.430 6.440 ( -0.445 6.143 6.918) 9.263 7.239 ( -4.307 -14.997 7.175) 17.174 7.370 ( -1.232 -1.191 0.924) 1.947 7.695 ( 2.714 8.910 -6.535) 11.378 8.007 ( 3.277 6.145 1.075) 7.047 8.496 ( 1.601 2.513 -4.726) 5.587 8.637 ( 6.067 12.461 -14.911) 20.358 9.809 ( -3.417 0.123 -1.111) 3.595 10.170 ( -2.551 -10.209 12.590) 16.408 10.460 ( -0.900 -1.375 0.838) 1.845 10.711 ( 5.546 9.809 -10.685) 15.529 12.344 ( -0.774 4.489 -5.534) 7.167 12.765 ( 2.680 0.080 0.619) 2.751 16.230 ( -11.694 -28.073 26.393) 40.267 16.773 ( 0.757 -4.147 2.201) 4.755 17.027 ( -9.345 -21.753 24.807) 34.291 17.299 ( -0.203 0.454 -0.192) 0.533 17.780 ( 5.928 19.280 -18.767) 27.551 17.968 ( 8.708 19.077 -20.175) 29.100 18.978 ( -1.606 -0.485 -0.167) 1.686 19.256 ( 1.814 2.698 -1.038) 3.413 ======================= Grid point 615 (307/366) ======================= q-point: (-0.45 0.00 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.285 ( 0.465 -2.134 -0.074) 2.186 0.461 ( 2.510 -8.363 -6.802) 11.069 0.988 ( -0.732 -1.110 1.389) 1.923 1.002 ( 0.755 0.576 -1.861) 2.090 2.084 ( -0.710 0.902 0.503) 1.253 2.291 ( -3.072 2.124 1.174) 3.915 2.305 ( 1.683 1.801 1.997) 3.172 3.381 ( -1.708 -3.314 5.976) 7.043 3.473 ( 3.802 -10.850 -7.927) 13.965 3.572 ( 3.730 8.015 -4.989) 10.151 4.255 ( -0.358 -2.990 -1.844) 3.532 4.573 ( -3.291 3.134 7.219) 8.530 5.891 ( -1.177 6.517 1.976) 6.911 6.021 ( -2.516 5.662 4.625) 7.731 6.243 ( 2.398 -0.632 -3.905) 4.626 6.403 ( -3.952 -1.662 8.135) 9.195 7.341 ( -3.857 0.601 7.684) 8.619 7.396 ( 3.887 8.646 -8.649) 12.833 7.606 ( 0.368 -8.408 -0.409) 8.426 8.029 ( 1.550 -5.387 -0.431) 5.622 8.536 ( 1.999 -2.863 -6.183) 7.101 8.608 ( 5.990 -13.028 -14.614) 20.474 9.724 ( -3.385 6.904 6.913) 10.340 10.297 ( -1.375 -0.447 3.589) 3.869 10.540 ( 2.480 -7.064 -6.142) 9.683 10.577 ( 0.528 2.996 -1.570) 3.424 12.289 ( -0.107 0.398 0.131) 0.432 12.806 ( 1.491 -3.528 -3.646) 5.288 16.460 ( -7.157 16.722 16.651) 24.660 16.549 ( -4.539 12.626 11.779) 17.853 16.956 ( -8.756 25.081 22.690) 34.937 17.340 ( -0.633 -2.199 1.702) 2.852 17.853 ( 7.878 -20.625 -19.517) 29.468 17.948 ( 8.678 -19.651 -21.930) 30.699 18.978 ( 0.227 0.071 -0.082) 0.252 19.245 ( -0.064 -0.998 0.047) 1.002 ======================= Grid point 616 (308/366) ======================= q-point: (-0.36 0.00 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.434 ( -1.965 -12.093 6.944) 14.083 0.653 ( 2.821 -12.508 -8.798) 15.551 0.984 ( -0.698 0.605 1.876) 2.091 1.023 ( -0.019 -1.560 -0.244) 1.580 2.034 ( 0.740 4.373 -1.245) 4.607 2.202 ( -4.579 5.476 1.137) 7.229 2.312 ( 7.857 1.934 3.691) 8.893 3.279 ( -1.087 12.021 -3.887) 12.681 3.539 ( -7.182 -3.772 19.120) 20.770 3.763 ( 8.563 -18.829 -22.261) 30.387 4.285 ( 5.241 -0.871 -9.089) 10.528 4.515 ( -9.144 2.985 13.245) 16.369 5.637 ( -4.118 17.876 10.849) 21.312 5.832 ( 3.374 15.012 -9.028) 17.839 6.362 ( 1.695 -9.536 2.526) 10.010 6.453 ( -3.047 -3.551 8.991) 10.136 7.192 ( 1.974 10.094 -6.779) 12.318 7.325 ( -1.657 1.550 0.326) 2.292 7.744 ( -5.578 -3.552 14.428) 15.871 8.149 ( 5.806 -6.476 -15.468) 17.745 8.743 ( -2.710 -21.226 6.777) 22.445 8.993 ( 9.019 -28.642 -22.540) 37.547 9.580 ( -2.460 8.912 10.877) 14.275 10.153 ( 1.321 12.803 -9.339) 15.902 10.638 ( -5.806 -7.565 11.824) 15.190 10.696 ( 5.201 -9.546 -10.297) 14.973 12.330 ( 0.878 -3.701 5.648) 6.810 12.889 ( 0.306 -6.466 -7.644) 10.017 15.871 ( -12.670 37.881 26.358) 47.857 16.100 ( 6.922 36.685 -15.927) 40.588 16.700 ( -9.202 10.273 26.060) 29.485 17.220 ( 5.817 11.657 -15.719) 20.415 18.333 ( 2.923 -29.077 -5.852) 29.803 18.424 ( 2.357 -28.722 -7.186) 29.701 18.981 ( 2.649 0.367 0.242) 2.685 19.285 ( -2.040 -3.848 0.865) 4.440 ======================= Grid point 617 (309/366) ======================= q-point: (-0.27 0.00 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.686 ( -2.554 -14.688 8.524) 17.174 0.885 ( 2.695 -13.428 -8.539) 16.139 0.971 ( 0.169 1.299 2.457) 2.784 1.041 ( -1.341 -0.701 1.308) 2.000 1.939 ( 2.695 6.560 -2.704) 7.590 2.051 ( -5.475 7.403 1.164) 9.281 2.333 ( 10.802 4.173 2.787) 11.911 3.013 ( -4.692 12.974 -4.885) 14.635 3.650 ( -10.196 -7.317 27.658) 30.372 4.086 ( 10.324 -15.196 -24.198) 30.382 4.326 ( 7.137 -0.989 -10.162) 12.457 4.396 ( -9.087 5.807 11.762) 15.958 5.303 ( -8.667 16.973 16.812) 25.413 5.561 ( 6.050 13.256 -16.448) 21.974 6.477 ( 4.159 1.516 3.079) 5.392 6.587 ( -0.301 -8.720 10.886) 13.951 7.020 ( -3.704 8.332 -1.495) 9.240 7.274 ( -0.974 0.417 -8.371) 8.438 7.763 ( -9.926 -0.394 25.429) 27.300 8.257 ( 10.279 -5.339 -24.949) 27.507 9.241 ( -5.477 -28.717 16.774) 33.705 9.416 ( -2.960 -0.101 8.828) 9.311 9.632 ( 10.332 -32.959 -22.644) 41.301 9.875 ( 0.766 14.514 -10.750) 18.078 10.780 ( -8.125 -9.384 14.449) 19.049 10.904 ( 8.076 -12.875 -14.250) 20.834 12.455 ( 2.017 -6.511 9.739) 11.887 12.992 ( -0.728 -7.424 -10.505) 12.884 15.133 ( -14.770 40.989 24.998) 50.231 15.397 ( 9.335 41.556 -19.562) 46.869 16.477 ( -7.045 15.272 20.876) 26.808 16.959 ( 7.388 16.367 -20.859) 27.524 18.832 ( 0.853 -23.264 -0.304) 23.282 18.898 ( -0.760 -22.997 -1.157) 23.039 19.026 ( 6.990 -4.144 0.770) 8.162 19.353 ( -4.488 -5.819 1.321) 7.466 ======================= Grid point 618 (310/366) ======================= q-point: (-0.18 0.00 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.916 ( 0.406 -3.031 4.317) 5.291 0.992 ( -1.354 -9.015 6.270) 11.064 1.032 ( -1.975 -0.868 1.361) 2.551 1.130 ( 2.500 -12.888 -6.229) 14.531 1.829 ( 3.647 7.081 -2.905) 8.478 1.883 ( -4.709 7.801 1.585) 9.249 2.321 ( 12.293 5.766 0.115) 13.578 2.743 ( -8.530 10.733 -3.073) 14.050 3.770 ( -9.666 -4.090 28.392) 30.270 4.204 ( -4.358 5.730 2.530) 7.630 4.267 ( -0.064 -0.615 -2.057) 2.149 4.415 ( 12.365 -2.216 -18.300) 22.197 5.081 ( -5.884 4.418 12.688) 14.667 5.405 ( 4.471 2.099 -16.458) 17.183 6.412 ( 5.347 9.547 0.863) 10.976 6.615 ( -3.539 12.226 2.804) 13.034 6.903 ( -6.052 -3.175 15.303) 16.760 7.323 ( 0.702 -8.624 -12.376) 15.101 7.781 ( -11.130 -1.187 28.718) 30.822 8.338 ( 11.778 -3.050 -28.209) 30.721 9.261 ( -3.320 7.390 12.858) 15.197 9.557 ( 1.907 13.014 -10.683) 16.945 9.948 ( -9.712 -35.374 19.397) 41.496 10.268 ( 11.143 -29.600 -21.042) 37.988 10.960 ( -10.257 -14.488 17.804) 25.141 11.244 ( 11.490 -25.350 -22.489) 35.783 12.626 ( 3.025 -6.896 11.873) 14.059 13.066 ( -1.521 -3.542 -9.795) 10.527 14.350 ( -17.748 40.087 21.412) 48.790 14.643 ( 12.736 44.055 -24.343) 51.919 16.193 ( -7.379 16.057 20.744) 27.251 16.650 ( 8.244 16.602 -22.913) 29.472 19.026 ( 7.509 -2.253 1.793) 8.043 19.220 ( -3.815 -11.369 0.843) 12.021 19.316 ( 1.815 -17.752 3.742) 18.232 19.469 ( -3.267 -11.353 -0.083) 11.814 ======================= Grid point 619 (311/366) ======================= q-point: (-0.09 0.00 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.928 ( 5.516 1.338 1.680) 5.919 0.998 ( -4.565 0.675 2.019) 5.038 1.250 ( -2.083 -13.967 6.734) 15.645 1.355 ( 2.488 -11.556 -4.656) 12.705 1.706 ( -0.302 9.359 0.864) 9.404 1.723 ( 0.169 7.032 -1.308) 7.154 2.318 ( 14.618 3.600 -2.775) 15.309 2.508 ( -12.176 6.707 -1.203) 13.953 3.807 ( -7.252 0.354 23.358) 24.460 4.083 ( -1.160 5.557 3.506) 6.672 4.197 ( -7.270 4.273 9.000) 12.333 4.468 ( 10.623 -0.452 -20.942) 23.487 5.135 ( 1.390 -6.816 7.488) 10.220 5.455 ( 0.912 -8.311 -15.429) 17.549 6.238 ( 0.560 12.145 1.985) 12.318 6.290 ( -4.068 15.445 0.723) 15.988 7.028 ( -0.209 -5.037 19.720) 20.354 7.458 ( -1.078 -8.319 -12.817) 15.318 7.790 ( -12.385 0.167 29.851) 32.318 8.376 ( 11.638 -0.818 -28.644) 30.929 9.151 ( -5.541 4.591 10.638) 12.843 9.346 ( 5.721 8.516 -10.955) 15.008 10.433 ( -10.583 -17.065 16.275) 25.848 10.653 ( 10.792 -10.920 -13.769) 20.623 11.354 ( -13.057 -32.920 26.741) 44.377 11.877 ( 13.573 -40.693 -30.085) 52.395 12.776 ( 3.743 -2.680 10.453) 11.422 12.950 ( -4.705 18.212 5.720) 19.660 13.665 ( -18.024 21.153 4.369) 28.131 13.880 ( 16.359 42.568 -26.442) 52.715 15.948 ( -8.259 10.521 21.672) 25.467 16.392 ( 8.856 10.713 -23.337) 27.163 19.129 ( 12.236 -1.437 1.540) 12.416 19.278 ( -10.099 -2.458 2.194) 10.623 19.593 ( 0.346 -10.190 4.429) 11.116 19.667 ( 0.248 -9.271 -0.958) 9.323 ======================= Grid point 621 (312/366) ======================= q-point: ( 0.09 0.09 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.897 ( -3.885 0.000 -1.023) 4.017 1.068 ( 7.853 -0.000 -1.322) 7.964 1.441 ( -2.682 0.000 6.154) 6.713 1.482 ( -3.224 0.000 0.544) 3.270 1.599 ( 1.600 -0.000 -5.928) 6.140 1.603 ( 2.605 -0.000 0.470) 2.647 2.150 ( -14.217 0.000 -0.992) 14.252 2.574 ( 14.859 -0.000 -3.860) 15.352 3.841 ( -5.454 0.000 17.755) 18.574 4.064 ( 3.456 -0.000 -2.306) 4.155 4.072 ( -10.885 0.000 18.204) 21.210 4.469 ( 6.587 -0.000 -19.334) 20.425 5.344 ( 1.698 -0.000 9.757) 9.904 5.404 ( -2.566 0.000 -14.680) 14.903 5.925 ( -12.359 0.000 10.012) 15.906 6.265 ( 8.335 -0.000 -2.740) 8.774 7.284 ( 2.475 -0.000 19.206) 19.365 7.385 ( -0.117 0.000 -17.422) 17.423 7.771 ( -13.161 0.000 32.348) 34.923 8.384 ( 10.798 -0.000 -27.132) 29.202 9.048 ( -6.013 0.000 7.983) 9.994 9.339 ( 7.605 -0.000 -10.878) 13.273 10.465 ( -9.963 0.000 12.874) 16.279 10.862 ( 10.201 -0.000 -12.825) 16.387 11.850 ( -12.805 0.000 33.470) 35.836 12.356 ( -5.198 0.000 3.880) 6.486 12.598 ( 3.938 -0.000 -12.886) 13.474 12.795 ( 5.319 -0.000 -2.468) 5.863 13.212 ( -8.507 0.000 -11.341) 14.177 13.594 ( 15.345 -0.000 -9.969) 18.298 15.850 ( -8.561 0.000 22.046) 23.650 16.291 ( 9.112 -0.000 -23.256) 24.977 19.070 ( -11.135 0.000 -0.648) 11.153 19.408 ( 10.243 -0.000 1.415) 10.341 19.713 ( -0.951 0.000 4.420) 4.521 19.760 ( 3.036 -0.000 -6.530) 7.202 ======================= Grid point 622 (313/366) ======================= q-point: ( 0.18 0.09 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.894 ( -2.207 -2.224 -1.219) 3.362 1.106 ( 6.436 1.593 -0.900) 6.690 1.251 ( -2.290 11.539 3.856) 12.379 1.367 ( 2.188 12.796 -5.276) 14.013 1.628 ( -4.221 -7.221 2.642) 8.772 1.788 ( 3.434 -9.186 -1.830) 9.976 2.120 ( -12.715 -6.643 -1.551) 14.430 2.679 ( 11.647 -2.634 -2.235) 12.149 3.856 ( -6.996 0.136 19.829) 21.027 4.043 ( -11.722 0.753 18.694) 22.078 4.137 ( 4.478 -5.730 -6.057) 9.464 4.515 ( 7.590 -5.318 -18.408) 20.610 5.222 ( -1.881 11.592 4.632) 12.624 5.322 ( 1.240 2.257 -8.708) 9.081 6.038 ( -10.976 -14.628 9.402) 20.563 6.433 ( 6.005 -11.541 -0.986) 13.047 7.228 ( -0.741 10.071 12.027) 15.704 7.322 ( 3.277 4.191 -10.809) 12.047 7.770 ( -12.865 -0.082 31.195) 33.744 8.388 ( 11.448 0.247 -28.199) 30.435 9.114 ( -4.759 -8.988 9.780) 14.109 9.398 ( 6.162 -4.277 -11.188) 13.470 10.314 ( -9.526 15.041 14.899) 23.216 10.791 ( 9.610 12.587 -15.036) 21.837 11.290 ( -12.737 35.270 27.987) 46.792 11.927 ( 13.177 38.819 -29.619) 50.575 12.876 ( -1.663 -10.644 -1.960) 10.950 12.969 ( 2.771 -1.854 5.915) 6.790 13.281 ( -16.951 -29.972 19.066) 39.360 14.075 ( 14.037 -37.701 -18.412) 44.243 15.957 ( -8.089 -11.358 21.536) 25.656 16.384 ( 8.875 -9.922 -23.265) 26.804 18.998 ( -9.057 0.026 -0.957) 9.107 19.411 ( 4.752 6.975 3.699) 9.215 19.609 ( -1.373 11.268 1.999) 11.526 19.710 ( 6.055 6.033 -8.206) 11.849 ======================= Grid point 623 (314/366) ======================= q-point: ( 0.27 0.09 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.927 ( -0.734 -1.587 0.298) 1.774 0.978 ( -2.334 12.620 7.438) 14.833 1.119 ( 2.533 14.353 -7.375) 16.335 1.157 ( 5.250 1.740 -5.183) 7.580 1.731 ( -3.951 -6.731 3.721) 8.647 1.966 ( 4.359 -8.291 -1.431) 9.476 2.181 ( -11.348 -8.822 -3.243) 14.735 2.817 ( 6.829 -5.997 1.577) 9.224 3.794 ( -10.618 7.746 25.032) 28.272 3.988 ( -12.092 1.182 17.410) 21.230 4.242 ( 7.339 -2.157 -15.849) 17.599 4.642 ( 10.818 -6.869 -19.415) 23.263 5.080 ( -4.986 1.511 14.995) 15.874 5.372 ( 5.684 -9.087 -12.734) 16.645 6.250 ( -11.227 -13.324 6.647) 18.648 6.652 ( 1.002 -7.068 2.707) 7.635 7.047 ( -2.667 10.695 11.484) 15.918 7.246 ( 6.821 2.939 -9.269) 11.877 7.764 ( -11.842 0.123 28.375) 30.747 8.361 ( 11.428 3.085 -28.937) 31.264 9.335 ( -3.072 -14.132 10.509) 17.877 9.503 ( 3.499 -5.790 -9.067) 11.313 9.846 ( -8.781 31.894 18.424) 37.865 10.389 ( 10.609 34.393 -22.692) 42.548 10.826 ( -8.954 15.555 18.172) 25.541 11.369 ( 10.362 22.313 -21.551) 32.706 12.797 ( 1.429 8.146 -14.151) 16.391 12.954 ( 1.302 5.248 8.359) 9.955 14.019 ( -16.929 -47.100 33.953) 60.480 14.837 ( 10.706 -41.319 -17.846) 46.264 16.233 ( -7.083 -17.934 20.058) 27.824 16.615 ( 8.351 -15.166 -22.900) 28.708 18.948 ( -5.696 -0.111 -0.547) 5.723 19.216 ( -1.370 17.109 4.822) 17.829 19.323 ( -1.028 19.589 0.665) 19.627 19.603 ( 7.880 8.346 -9.012) 14.593 ======================= Grid point 624 (315/366) ======================= q-point: ( 0.36 0.09 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.731 ( -2.743 13.364 7.762) 15.696 0.853 ( 3.379 14.576 -9.111) 17.519 0.962 ( -0.569 -0.801 1.551) 1.836 1.136 ( 3.701 2.660 -5.649) 7.258 1.847 ( -2.899 -7.443 4.866) 9.353 2.132 ( 4.219 -6.988 -0.596) 8.184 2.243 ( -9.521 -6.826 -4.850) 12.680 2.994 ( 2.081 -9.217 4.903) 10.646 3.583 ( -11.869 13.174 25.198) 30.812 3.958 ( -8.145 -1.490 14.359) 16.575 4.176 ( 9.633 9.205 -20.991) 24.863 4.786 ( 10.407 -5.119 -18.106) 21.502 5.200 ( -6.613 -12.321 21.549) 25.689 5.625 ( 6.544 -16.626 -13.656) 22.488 6.354 ( -9.310 -3.800 4.448) 10.996 6.698 ( -1.108 0.550 -0.681) 1.412 6.904 ( -3.591 4.792 12.380) 13.752 7.292 ( 5.652 -3.211 -3.376) 7.325 7.764 ( -9.085 -0.735 22.746) 24.505 8.284 ( 9.981 5.355 -25.853) 28.226 9.187 ( -6.949 31.943 15.770) 36.296 9.547 ( 1.297 -0.651 -6.114) 6.284 9.677 ( 6.035 10.673 -12.146) 17.258 9.755 ( 3.207 7.814 -5.090) 9.861 10.618 ( -6.065 8.304 13.159) 16.701 11.092 ( 7.218 12.231 -15.467) 20.998 12.612 ( 2.511 9.357 -12.206) 15.583 12.878 ( 0.036 5.419 6.385) 8.375 14.834 ( -14.479 -45.026 33.703) 58.076 15.584 ( 7.078 -39.833 -13.667) 42.703 16.568 ( -6.544 -17.531 18.636) 26.410 16.890 ( 7.807 -15.380 -21.619) 27.656 18.797 ( -1.491 24.169 2.074) 24.304 18.907 ( 0.535 24.204 -0.683) 24.220 18.958 ( -3.592 2.239 0.481) 4.260 19.472 ( 4.850 8.442 -6.847) 11.903 ======================= Grid point 625 (316/366) ======================= q-point: ( 0.45 0.09 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.513 ( -2.415 10.397 5.643) 12.074 0.595 ( 3.839 13.730 -9.678) 17.232 0.968 ( -0.570 0.082 1.897) 1.982 1.085 ( 2.012 3.298 -4.603) 6.009 1.973 ( -1.959 -6.532 4.710) 8.288 2.252 ( -0.213 -4.316 0.145) 4.323 2.282 ( -2.012 -3.912 -3.711) 5.755 3.185 ( -3.304 -9.783 7.285) 12.637 3.356 ( -8.077 8.821 17.218) 20.964 3.941 ( 7.784 9.453 -16.192) 20.301 4.066 ( -2.389 -2.989 8.926) 9.712 4.807 ( 6.025 4.692 -12.587) 14.723 5.484 ( -6.075 -16.664 18.760) 25.817 5.923 ( 4.027 -14.825 -10.274) 18.481 6.332 ( -1.831 1.789 0.578) 2.624 6.591 ( -0.383 8.537 -2.238) 8.834 6.979 ( -4.608 -10.999 12.745) 17.454 7.348 ( -0.061 -1.002 1.348) 1.680 7.779 ( -3.379 0.274 9.683) 10.259 8.163 ( 5.691 8.073 -16.350) 19.102 8.700 ( -2.885 20.209 7.318) 21.686 9.020 ( 8.571 29.868 -21.930) 38.032 9.737 ( 2.618 -6.231 -5.298) 8.588 9.968 ( -3.726 -12.961 10.747) 17.244 10.495 ( -3.577 4.937 9.046) 10.909 10.898 ( 5.254 10.361 -13.462) 17.782 12.447 ( 3.463 7.823 -8.519) 12.073 12.806 ( -1.174 3.276 2.719) 4.416 15.600 ( -12.158 -39.984 32.289) 52.812 16.286 ( 4.337 -37.085 -10.078) 38.674 16.832 ( -8.316 -10.753 21.230) 25.209 17.141 ( 6.901 -12.576 -18.285) 23.240 18.284 ( 0.418 30.658 -1.930) 30.722 18.420 ( 2.227 27.899 -6.147) 28.655 18.958 ( -0.422 -1.041 0.744) 1.348 19.342 ( 1.361 6.338 -4.104) 7.673 ======================= Grid point 626 (317/366) ======================= q-point: ( 0.55 0.09 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.373 ( 2.612 8.897 -6.533) 11.342 0.392 ( 0.065 2.959 -2.231) 3.706 0.971 ( -0.215 -0.480 1.325) 1.425 1.031 ( 0.993 2.454 -2.783) 3.841 2.062 ( -1.207 -3.082 3.292) 4.668 2.300 ( -1.689 -1.934 0.177) 2.574 2.328 ( 4.100 -0.291 2.595) 4.861 3.259 ( -4.188 -3.136 6.617) 8.436 3.353 ( -5.351 -6.764 2.773) 9.060 3.743 ( 5.643 10.821 -16.394) 20.437 4.184 ( 0.165 -5.714 8.624) 10.347 4.675 ( -0.069 8.137 -3.632) 8.911 5.778 ( -2.398 -13.807 14.326) 20.040 6.108 ( 1.721 -3.027 -5.745) 6.718 6.263 ( 2.237 3.494 -3.534) 5.450 6.445 ( -3.528 6.627 5.174) 9.118 7.231 ( -3.308 -14.477 9.459) 17.607 7.362 ( -0.759 -1.936 1.151) 2.376 7.702 ( 3.816 9.602 -7.401) 12.710 8.012 ( -2.403 4.782 -1.828) 5.656 8.496 ( 2.169 2.694 -4.705) 5.839 8.637 ( 5.593 12.460 -14.930) 20.234 9.808 ( 3.006 0.570 1.945) 3.625 10.173 ( -6.161 -10.036 10.990) 16.107 10.459 ( -0.023 -1.408 1.221) 1.864 10.712 ( 3.285 9.815 -11.602) 15.548 12.344 ( 4.205 4.561 -3.453) 7.100 12.765 ( -2.308 0.011 -1.470) 2.736 16.235 ( -8.683 -27.890 27.520) 40.133 16.775 ( -2.089 -3.353 1.773) 4.330 17.026 ( -9.963 -22.144 24.069) 34.190 17.299 ( 0.284 0.182 -0.231) 0.409 17.774 ( 7.446 19.272 -17.692) 27.200 17.969 ( 7.647 18.835 -20.938) 29.183 18.979 ( 1.457 -0.605 0.862) 1.798 19.253 ( -0.963 2.633 -1.993) 3.440 ======================= Grid point 627 (318/366) ======================= q-point: (-0.36 0.09 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.296 ( 1.277 -2.222 -0.308) 2.581 0.448 ( 1.163 -8.658 -7.284) 11.374 0.987 ( -0.684 -0.589 1.484) 1.737 1.005 ( 1.159 0.185 -1.824) 2.169 2.084 ( 0.300 0.892 2.014) 2.223 2.268 ( -3.084 3.550 1.420) 4.913 2.393 ( 9.152 -0.293 6.317) 11.125 3.331 ( -9.863 -2.627 1.192) 10.276 3.470 ( 4.166 -12.436 -10.778) 16.976 3.558 ( -0.767 7.101 -5.629) 9.093 4.286 ( 4.894 -2.312 0.896) 5.486 4.540 ( -6.356 4.514 5.305) 9.430 5.930 ( 2.919 10.152 5.387) 11.858 6.031 ( 0.278 2.649 6.557) 7.078 6.244 ( 1.162 0.184 -4.980) 5.117 6.379 ( -5.507 -3.395 7.085) 9.594 7.330 ( -3.870 0.992 7.714) 8.687 7.404 ( 4.121 8.442 -8.803) 12.874 7.618 ( 0.850 -7.569 1.953) 7.863 8.004 ( -2.843 -6.576 -4.976) 8.722 8.529 ( 1.605 -3.051 -5.590) 6.567 8.612 ( 6.180 -12.885 -14.920) 20.660 9.763 ( 2.185 7.669 10.241) 12.980 10.265 ( -5.266 -0.135 1.304) 5.427 10.551 ( 4.016 -7.308 -6.572) 10.617 10.565 ( -1.101 2.760 -1.297) 3.242 12.328 ( 4.815 0.301 2.164) 5.287 12.769 ( -3.143 -3.598 -5.658) 7.405 16.450 ( -10.152 23.218 21.881) 33.479 16.554 ( -1.121 7.145 6.467) 9.702 16.963 ( -8.271 24.595 23.439) 34.967 17.337 ( -1.026 -2.197 1.441) 2.821 17.863 ( 8.718 -20.481 -19.326) 29.478 17.938 ( 7.116 -19.923 -22.288) 30.730 19.004 ( 3.287 -0.261 0.840) 3.403 19.224 ( -2.696 -0.998 -0.830) 2.992 ======================= Grid point 628 (319/366) ======================= q-point: (-0.27 0.09 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.448 ( -1.406 -11.929 6.618) 13.714 0.639 ( 2.284 -12.903 -9.161) 15.988 0.986 ( -0.941 0.131 2.602) 2.770 1.023 ( 0.962 -1.014 -1.581) 2.110 2.048 ( 1.789 4.163 0.491) 4.558 2.151 ( -4.108 6.776 1.044) 7.993 2.475 ( 12.016 1.653 7.105) 14.057 3.161 ( -9.948 9.790 -10.647) 17.554 3.528 ( -8.710 -4.736 17.307) 19.946 3.776 ( 9.685 -18.529 -19.461) 28.563 4.350 ( 9.634 -0.458 -6.075) 11.399 4.433 ( -11.620 3.474 10.161) 15.822 5.637 ( -5.932 19.966 13.724) 24.944 5.849 ( 6.777 16.559 -11.025) 21.016 6.406 ( 0.310 -12.444 7.618) 14.593 6.461 ( -1.313 -5.291 6.097) 8.179 7.183 ( -0.445 11.177 -2.066) 11.375 7.295 ( -0.215 3.972 -5.628) 6.892 7.737 ( -7.556 -3.171 17.127) 18.987 8.134 ( 5.661 -8.616 -18.317) 21.019 8.738 ( -3.200 -21.357 6.656) 22.598 8.997 ( 9.228 -28.812 -22.414) 37.652 9.639 ( 1.266 10.346 13.565) 17.107 10.096 ( -1.807 12.181 -10.673) 16.296 10.611 ( -7.024 -7.156 11.024) 14.902 10.725 ( 7.177 -9.907 -10.445) 16.086 12.407 ( 5.255 -3.767 6.977) 9.512 12.820 ( -3.540 -6.617 -9.443) 12.062 15.820 ( -15.522 38.549 27.050) 49.585 16.123 ( 8.639 36.923 -15.182) 40.847 16.722 ( -8.016 10.427 26.037) 29.170 17.210 ( 5.296 11.797 -16.412) 20.894 18.345 ( 3.081 -29.062 -5.024) 29.654 18.410 ( 1.329 -28.897 -7.407) 29.860 19.046 ( 6.131 -0.961 0.908) 6.272 19.239 ( -4.774 -3.395 -0.394) 5.871 ======================= Grid point 629 (320/366) ======================= q-point: (-0.18 0.09 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.698 ( -2.303 -14.454 8.293) 16.823 0.874 ( 2.591 -13.617 -8.731) 16.382 0.986 ( -0.780 -0.032 3.506) 3.592 1.035 ( 1.157 0.063 -1.470) 1.872 1.967 ( 1.125 5.980 -0.279) 6.091 1.992 ( -2.460 7.947 -0.040) 8.319 2.512 ( 12.281 5.217 5.241) 14.336 2.869 ( -10.495 11.351 -9.200) 17.990 3.652 ( -10.852 -8.772 26.556) 29.999 4.101 ( 10.196 -14.678 -22.505) 28.738 4.283 ( -13.972 5.142 14.526) 20.800 4.434 ( 14.084 -1.075 -13.486) 19.529 5.271 ( -9.557 17.478 17.487) 26.507 5.567 ( 7.256 14.815 -15.689) 22.765 6.540 ( -0.270 -0.963 8.937) 8.993 6.640 ( 1.942 -7.896 4.852) 9.469 6.960 ( -6.514 10.884 5.464) 13.811 7.216 ( 1.445 0.383 -12.984) 13.070 7.762 ( -10.122 -1.072 25.464) 27.423 8.264 ( 10.477 -5.922 -25.511) 28.207 9.241 ( -7.134 -32.764 15.729) 37.038 9.448 ( 0.478 4.491 8.944) 10.020 9.656 ( 10.191 -32.223 -20.573) 39.565 9.816 ( -0.493 13.434 -11.702) 17.823 10.737 ( -9.109 -9.139 13.828) 18.913 10.949 ( 9.611 -12.836 -14.258) 21.458 12.560 ( 5.344 -6.398 10.179) 13.157 12.902 ( -3.440 -7.945 -12.151) 14.920 15.048 ( -17.778 42.454 27.001) 53.361 15.433 ( 10.775 41.341 -18.332) 46.489 16.497 ( -6.317 15.874 20.874) 26.974 16.944 ( 6.981 16.189 -21.342) 27.682 18.842 ( -0.190 -23.248 1.312) 23.285 18.883 ( 0.057 -23.867 -1.919) 23.944 19.143 ( 8.565 -4.648 1.325) 9.835 19.278 ( -5.828 -5.816 -1.416) 8.355 ======================= Grid point 630 (321/366) ======================= q-point: (-0.09 0.09 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.944 ( -0.389 -8.408 5.879) 10.267 0.977 ( -3.455 -1.186 2.548) 4.454 1.050 ( 3.345 -3.670 0.404) 4.982 1.128 ( 2.280 -13.410 -6.488) 15.071 1.828 ( -4.732 6.972 1.656) 8.587 1.869 ( 4.262 7.330 -2.384) 8.808 2.496 ( 11.661 6.088 2.254) 13.346 2.579 ( -10.910 10.227 -5.997) 16.112 3.787 ( -9.745 -4.876 27.506) 29.586 4.152 ( -10.029 3.544 13.541) 17.219 4.247 ( 3.643 0.307 -13.415) 13.905 4.499 ( 13.807 0.427 -18.037) 22.719 5.074 ( -5.815 1.010 14.243) 15.418 5.380 ( 4.723 4.721 -15.843) 17.193 6.479 ( -1.648 11.588 5.519) 12.941 6.541 ( -2.956 13.739 -0.910) 14.082 6.945 ( -2.299 -7.662 18.480) 20.138 7.270 ( 1.859 -7.800 -14.061) 16.187 7.780 ( -11.359 -0.808 28.207) 30.419 8.348 ( 11.863 -3.002 -28.421) 30.944 9.288 ( -2.971 10.181 13.198) 16.931 9.527 ( 2.328 10.226 -11.051) 15.235 9.914 ( -10.160 -34.229 18.797) 40.350 10.312 ( 11.892 -31.455 -21.491) 39.909 10.911 ( -10.772 -14.832 17.654) 25.450 11.287 ( 12.104 -24.214 -21.989) 34.876 12.744 ( 4.951 -6.483 11.481) 14.084 12.978 ( -2.668 -5.557 -12.363) 13.815 14.214 ( -20.299 43.343 26.099) 54.514 14.700 ( 13.819 43.309 -22.249) 50.613 16.205 ( -7.056 16.694 20.765) 27.562 16.638 ( 8.069 16.146 -23.062) 29.286 19.124 ( 1.863 -8.524 3.317) 9.335 19.161 ( -2.725 -5.519 -0.837) 6.212 19.355 ( -1.077 -16.082 4.873) 16.838 19.445 ( 3.826 -13.849 -4.715) 15.121 ======================= Grid point 633 (322/366) ======================= q-point: ( 0.18 0.18 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.853 ( -1.055 0.000 -2.447) 2.664 1.159 ( 7.501 -0.000 -3.583) 8.313 1.433 ( -4.636 0.000 1.950) 5.029 1.437 ( -2.566 0.000 5.767) 6.312 1.592 ( 2.133 -0.000 -6.414) 6.759 1.636 ( 2.054 -0.000 0.005) 2.054 1.979 ( -10.756 0.000 1.361) 10.842 2.722 ( 9.996 -0.000 -5.167) 11.253 3.847 ( -6.694 0.000 15.725) 17.091 4.040 ( -9.187 0.000 21.200) 23.105 4.102 ( 4.896 -0.000 -4.602) 6.719 4.446 ( 4.274 -0.000 -17.106) 17.632 5.302 ( -1.302 0.000 -13.135) 13.199 5.406 ( -0.322 0.000 9.969) 9.974 5.827 ( -10.602 0.000 11.984) 16.000 6.343 ( 5.434 -0.000 -4.408) 6.998 7.318 ( 4.291 -0.000 -17.417) 17.937 7.400 ( 0.256 -0.000 17.326) 17.328 7.766 ( -13.057 0.000 32.737) 35.245 8.387 ( 10.639 -0.000 -26.406) 28.469 9.017 ( -4.615 0.000 7.558) 8.856 9.375 ( 6.360 -0.000 -11.404) 13.057 10.410 ( -7.952 0.000 12.707) 14.990 10.914 ( 7.765 -0.000 -13.551) 15.618 11.857 ( -12.418 0.000 33.241) 35.485 12.299 ( -9.178 0.000 12.342) 15.380 12.604 ( 8.318 -0.000 -16.641) 18.604 12.841 ( 4.321 -0.000 -5.005) 6.612 13.079 ( -2.054 0.000 -11.641) 11.820 13.723 ( 9.708 -0.000 -6.611) 11.746 15.851 ( -8.498 0.000 21.968) 23.554 16.291 ( 9.096 -0.000 -23.216) 24.934 18.939 ( -7.284 0.000 -0.817) 7.330 19.519 ( 3.985 -0.000 4.387) 5.927 19.719 ( -1.599 0.000 4.130) 4.429 19.765 ( 5.290 -0.000 -13.467) 14.468 ======================= Grid point 634 (323/366) ======================= q-point: ( 0.27 0.18 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.875 ( 0.708 -2.848 -1.688) 3.386 1.180 ( 5.192 3.554 -1.280) 6.421 1.232 ( -2.724 9.597 1.650) 10.112 1.367 ( 2.133 13.041 -5.659) 14.375 1.594 ( -3.298 -7.009 4.278) 8.850 1.822 ( 3.010 -10.323 -1.932) 10.925 1.974 ( -8.562 -5.534 1.685) 10.333 2.781 ( 5.477 -2.302 -4.458) 7.427 3.851 ( -8.108 -0.070 18.116) 19.848 4.003 ( -9.314 3.077 19.792) 22.089 4.174 ( 5.048 -4.736 -4.922) 8.493 4.511 ( 6.067 -8.039 -17.644) 20.317 5.201 ( -0.097 7.963 -4.107) 8.960 5.318 ( -0.120 3.830 1.604) 4.154 5.956 ( -9.425 -13.393 11.342) 19.921 6.475 ( 1.873 -10.979 -4.656) 12.072 7.252 ( 3.854 7.591 -4.941) 9.843 7.355 ( 1.542 6.762 6.018) 9.182 7.763 ( -12.834 0.223 31.916) 34.401 8.392 ( 11.216 0.344 -28.158) 30.311 9.107 ( -3.837 -10.396 9.567) 14.640 9.415 ( 5.142 -3.423 -11.476) 13.033 10.278 ( -7.329 14.534 15.016) 22.145 10.821 ( 6.896 12.804 -15.799) 21.473 11.275 ( -11.599 35.846 28.650) 47.332 11.942 ( 11.953 37.973 -29.326) 49.445 12.854 ( 1.428 -6.811 -5.277) 8.733 13.015 ( 0.095 -3.636 4.239) 5.586 13.201 ( -12.160 -33.126 24.601) 43.016 14.142 ( 9.264 -36.159 -16.561) 40.836 15.961 ( -8.145 -11.624 21.345) 25.634 16.382 ( 8.957 -9.667 -23.155) 26.642 18.904 ( -4.158 -0.573 -0.018) 4.197 19.467 ( 0.001 9.259 6.167) 11.125 19.599 ( -0.873 11.588 -0.064) 11.621 19.736 ( 5.319 4.013 -12.237) 13.933 ======================= Grid point 635 (324/366) ======================= q-point: ( 0.36 0.18 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.930 ( 0.745 -1.683 0.701) 1.970 0.981 ( -2.991 12.862 7.261) 15.070 1.115 ( 2.825 14.475 -7.723) 16.648 1.185 ( 3.460 1.863 -7.069) 8.088 1.713 ( -2.017 -6.989 5.100) 8.884 2.011 ( 0.236 -8.960 -1.824) 9.147 2.052 ( -3.347 -7.437 1.292) 8.257 2.863 ( -0.320 -6.030 -1.808) 6.303 3.776 ( -11.415 8.417 25.316) 29.018 3.948 ( -7.336 1.068 17.510) 19.015 4.263 ( 7.259 -1.298 -13.721) 15.577 4.670 ( 8.889 -7.831 -19.839) 23.107 5.097 ( -4.059 -0.245 14.424) 14.986 5.384 ( 5.772 -9.918 -11.803) 16.462 6.150 ( -9.621 -11.539 9.161) 17.597 6.640 ( -2.527 -6.671 -3.515) 7.953 7.078 ( -0.820 11.590 10.384) 15.583 7.305 ( 6.982 1.577 -5.464) 9.005 7.755 ( -11.979 0.205 28.978) 31.357 8.359 ( 11.000 3.266 -29.075) 31.257 9.344 ( -3.336 -14.070 9.340) 17.214 9.502 ( 3.165 -5.102 -8.392) 10.318 9.837 ( -7.066 30.794 18.816) 36.773 10.400 ( 8.945 34.376 -23.201) 42.427 10.816 ( -7.046 15.808 18.741) 25.511 11.381 ( 8.340 22.107 -21.760) 32.121 12.772 ( 5.879 8.527 -13.477) 16.997 12.983 ( -3.011 4.965 6.798) 8.940 13.998 ( -13.417 -47.364 35.813) 60.876 14.864 ( 7.151 -40.971 -17.748) 45.220 16.240 ( -7.544 -18.152 19.589) 27.751 16.610 ( 8.769 -14.943 -22.654) 28.520 18.903 ( -0.901 -0.931 1.134) 1.722 19.220 ( -1.818 18.673 5.245) 19.481 19.314 ( -0.733 19.334 0.145) 19.349 19.628 ( 3.712 7.684 -11.408) 14.247 ======================= Grid point 636 (325/366) ======================= q-point: ( 0.45 0.18 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.729 ( -3.650 13.400 7.682) 15.871 0.852 ( 3.699 14.582 -9.207) 17.638 0.968 ( 0.107 -0.617 1.774) 1.882 1.141 ( 1.777 2.842 -6.369) 7.197 1.847 ( -1.245 -7.400 5.568) 9.344 2.115 ( -5.417 -7.169 -2.308) 9.277 2.207 ( 5.468 -6.455 1.819) 8.653 2.981 ( -5.815 -9.431 -0.006) 11.080 3.562 ( -11.548 13.031 27.118) 32.227 3.969 ( -2.046 -2.199 15.162) 15.456 4.195 ( 9.418 9.276 -20.522) 24.411 4.788 ( 4.139 -5.179 -17.841) 19.033 5.246 ( -3.516 -12.025 20.346) 23.894 5.639 ( 6.243 -16.038 -13.451) 21.843 6.276 ( -5.908 -6.159 5.966) 10.413 6.658 ( -2.464 0.582 -5.265) 5.843 6.939 ( -1.859 5.011 14.846) 15.778 7.337 ( 3.395 -1.045 -2.867) 4.565 7.756 ( -9.630 -1.180 22.127) 24.160 8.275 ( 9.142 5.495 -26.144) 28.236 9.181 ( -6.543 31.303 16.238) 35.866 9.537 ( 3.549 2.953 -9.679) 10.724 9.701 ( 5.363 5.887 -8.399) 11.574 9.761 ( 1.864 9.449 -5.501) 11.092 10.619 ( -4.273 8.411 13.723) 16.653 11.090 ( 4.772 12.136 -16.005) 20.645 12.617 ( 7.204 9.543 -10.818) 16.125 12.874 ( -4.884 5.318 4.725) 8.629 14.841 ( -11.335 -44.996 34.804) 58.004 15.588 ( 4.471 -39.901 -14.331) 42.632 16.569 ( -7.601 -17.496 17.981) 26.214 16.888 ( 8.606 -15.309 -21.244) 27.563 18.795 ( -0.503 24.400 2.343) 24.518 18.904 ( -0.429 25.480 -0.771) 25.495 18.950 ( 1.489 0.618 2.350) 2.850 19.467 ( 0.483 8.276 -8.662) 11.990 ======================= Grid point 637 (326/366) ======================= q-point: ( 0.55 0.18 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.500 ( -3.873 10.692 5.597) 12.674 0.599 ( 4.311 13.563 -9.703) 17.224 0.974 ( -0.125 0.221 2.164) 2.179 1.080 ( 0.812 3.058 -4.527) 5.523 1.980 ( -0.654 -6.263 5.325) 8.246 2.205 ( -2.762 -6.212 -1.968) 7.078 2.346 ( 7.875 -3.494 3.630) 9.349 3.104 ( -11.327 -9.836 0.364) 15.006 3.352 ( -7.223 8.755 20.619) 23.536 3.950 ( 8.270 11.558 -21.997) 26.188 4.119 ( 0.981 -4.074 14.507) 15.100 4.773 ( -0.395 3.596 -13.753) 14.220 5.537 ( -2.150 -15.639 20.100) 25.558 5.923 ( 4.090 -14.133 -10.341) 17.983 6.326 ( 0.576 0.056 0.591) 0.827 6.559 ( -2.182 6.695 -3.401) 7.820 7.005 ( -2.088 -9.170 14.419) 17.215 7.348 ( -0.935 0.009 1.044) 1.401 7.771 ( -5.193 -0.564 9.391) 10.746 8.136 ( 4.155 9.052 -18.170) 20.720 8.704 ( -2.357 20.030 7.369) 21.472 9.017 ( 8.359 29.557 -22.262) 37.936 9.783 ( 7.155 -6.609 -2.936) 10.173 9.950 ( -6.551 -12.489 9.091) 16.779 10.504 ( -2.458 5.259 9.815) 11.403 10.880 ( 2.882 10.264 -14.072) 17.654 12.485 ( 7.971 7.876 -6.675) 13.043 12.766 ( -6.037 3.209 1.012) 6.911 15.629 ( -9.323 -39.924 33.070) 52.673 16.275 ( 2.514 -37.236 -11.268) 38.985 16.821 ( -9.888 -10.527 20.913) 25.416 17.145 ( 7.734 -12.507 -17.791) 23.082 18.291 ( 1.863 30.644 -1.507) 30.738 18.411 ( 1.546 27.814 -6.666) 28.643 18.984 ( 3.039 -0.793 2.181) 3.823 19.313 ( -2.007 5.875 -5.258) 8.136 ======================= Grid point 638 (327/366) ======================= q-point: (-0.36 -0.82 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.358 ( -1.893 2.586 -0.976) 3.350 0.390 ( 3.806 9.005 -7.734) 12.465 0.978 ( 0.105 -0.249 1.405) 1.431 1.028 ( 0.550 2.003 -2.502) 3.252 2.080 ( 0.956 -2.969 4.715) 5.653 2.261 ( -3.522 -2.057 -1.087) 4.221 2.472 ( 12.363 -1.500 8.259) 14.943 3.160 ( -15.393 -6.451 0.051) 16.690 3.314 ( -0.309 -3.954 4.864) 6.276 3.709 ( 3.406 12.103 -18.965) 22.755 4.262 ( 3.245 -4.811 10.809) 12.268 4.625 ( -3.776 7.204 -4.886) 9.489 5.858 ( 1.202 -14.730 16.279) 21.987 6.109 ( 2.412 -4.297 -4.639) 6.768 6.277 ( 2.708 4.481 -3.310) 6.195 6.401 ( -6.023 7.722 2.815) 10.190 7.251 ( -1.375 -12.787 10.167) 16.394 7.361 ( -0.310 -2.655 1.087) 2.885 7.719 ( 3.549 7.222 -5.119) 9.538 7.934 ( -5.482 6.279 -5.689) 10.092 8.504 ( 2.676 2.762 -4.673) 6.052 8.631 ( 5.286 12.816 -15.127) 20.519 9.900 ( 7.464 0.564 4.656) 8.816 10.122 ( -9.202 -9.438 8.777) 15.836 10.472 ( 0.878 -1.535 1.488) 2.311 10.680 ( 1.346 9.514 -11.730) 15.163 12.416 ( 8.247 4.443 -1.580) 9.500 12.692 ( -6.498 -0.107 -3.128) 7.212 16.283 ( -6.311 -27.941 28.439) 40.365 16.737 ( -4.700 -2.222 1.536) 5.420 17.014 ( -10.277 -23.123 23.046) 34.226 17.304 ( 0.591 0.312 0.081) 0.673 17.793 ( 8.962 19.238 -17.342) 27.407 17.954 ( 6.886 19.086 -21.554) 29.602 19.023 ( 3.907 -0.472 1.699) 4.287 19.211 ( -3.377 2.235 -2.678) 4.855 ======================= Grid point 639 (328/366) ======================= q-point: (-0.27 0.18 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.316 ( 1.901 -2.226 -0.371) 2.951 0.421 ( 0.858 -9.254 -7.601) 12.007 0.985 ( -0.687 -0.033 1.363) 1.527 1.012 ( 1.322 -0.379 -1.891) 2.338 2.117 ( 1.952 1.321 3.998) 4.641 2.221 ( -3.914 3.207 -0.386) 5.074 2.602 ( 14.267 0.234 11.459) 18.301 3.122 ( -17.246 -1.317 -7.322) 18.782 3.498 ( 7.481 -13.410 -9.093) 17.846 3.506 ( -3.406 5.119 -3.421) 7.036 4.377 ( 6.737 -2.662 2.245) 7.584 4.464 ( -8.046 6.038 3.585) 10.679 5.977 ( -2.083 16.687 8.786) 18.973 6.117 ( 7.281 3.201 4.006) 8.905 6.223 ( -1.032 -3.918 -1.814) 4.439 6.334 ( -4.871 -7.015 3.013) 9.056 7.317 ( -3.520 4.121 6.041) 8.116 7.411 ( 3.105 5.830 -7.496) 9.991 7.650 ( 0.271 -3.308 7.353) 8.068 7.923 ( -2.357 -10.427 -9.650) 14.401 8.521 ( 1.273 -2.793 -4.882) 5.767 8.617 ( 6.427 -13.088 -15.287) 21.126 9.873 ( 4.480 8.801 12.756) 16.132 10.174 ( -8.108 0.237 -1.219) 8.202 10.534 ( -2.101 2.119 -1.035) 3.158 10.583 ( 5.713 -7.912 -6.950) 11.981 12.432 ( 8.070 0.155 3.416) 8.765 12.670 ( -6.230 -3.778 -7.162) 10.217 16.407 ( -14.389 28.187 24.935) 40.290 16.597 ( 3.295 3.327 3.501) 5.847 16.979 ( -8.047 23.868 24.134) 34.884 17.328 ( -1.189 -1.945 0.998) 2.488 17.879 ( 8.448 -18.906 -19.940) 28.747 17.911 ( 6.710 -21.336 -21.427) 30.973 19.068 ( 5.147 -0.950 1.206) 5.371 19.168 ( -4.518 -0.773 -1.460) 4.810 ======================= Grid point 640 (329/366) ======================= q-point: (-0.18 0.18 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.466 ( -0.995 -11.582 6.374) 13.258 0.621 ( 2.386 -13.366 -9.363) 16.493 0.983 ( -1.456 -0.118 2.579) 2.964 1.034 ( 2.305 -1.005 -2.593) 3.612 2.066 ( -2.942 5.680 3.795) 7.438 2.120 ( 1.664 5.775 -1.443) 6.181 2.696 ( 13.375 3.466 10.312) 17.240 2.928 ( -14.243 6.804 -13.220) 20.590 3.489 ( -9.986 -6.306 15.979) 19.870 3.815 ( 10.375 -17.266 -17.284) 26.542 4.310 ( -13.176 5.135 9.699) 17.148 4.477 ( 12.787 -1.857 -6.632) 14.524 5.616 ( -8.539 21.464 14.952) 27.516 5.886 ( 7.427 17.505 -12.471) 22.740 6.424 ( -4.487 -9.205 9.766) 14.150 6.501 ( 3.427 -11.502 2.869) 12.339 7.139 ( -6.929 11.339 3.879) 13.843 7.283 ( 4.843 7.143 -9.961) 13.180 7.729 ( -7.838 -2.765 19.918) 21.582 8.120 ( 7.496 -10.715 -19.783) 23.714 8.728 ( -3.562 -21.097 6.694) 22.419 9.004 ( 9.274 -29.151 -22.221) 37.809 9.740 ( 1.966 11.926 14.950) 19.225 9.999 ( -3.571 10.687 -11.353) 15.995 10.570 ( -7.053 -6.480 10.037) 13.874 10.776 ( 8.542 -10.279 -10.934) 17.267 12.532 ( 7.370 -3.736 7.272) 11.007 12.705 ( -5.325 -6.886 -10.630) 13.740 15.746 ( -16.956 39.340 28.170) 51.270 16.169 ( 9.216 37.185 -13.564) 40.640 16.756 ( -7.143 10.592 25.303) 28.345 17.191 ( 5.163 12.020 -17.233) 21.636 18.354 ( 0.962 -29.264 -3.911) 29.540 18.392 ( 2.478 -28.961 -7.369) 29.987 19.134 ( 1.844 -2.033 1.433) 3.096 19.169 ( -0.546 -3.177 -2.194) 3.899 ======================= Grid point 641 (330/366) ======================= q-point: (-0.09 0.18 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.711 ( -2.192 -14.105 8.125) 16.425 0.864 ( 2.805 -13.938 -8.885) 16.765 0.980 ( -2.153 -0.077 2.814) 3.544 1.062 ( 4.157 -0.560 -2.908) 5.104 1.924 ( -5.198 7.009 2.676) 9.127 2.025 ( 4.651 7.107 -1.912) 8.706 2.649 ( -11.483 9.199 -7.391) 16.466 2.715 ( 10.067 6.886 4.436) 12.979 3.638 ( -11.588 -10.704 25.588) 30.060 4.112 ( 4.279 -11.515 -14.483) 18.992 4.170 ( -8.979 1.998 6.574) 11.307 4.568 ( 16.106 0.253 -14.172) 21.455 5.233 ( -10.080 16.847 18.506) 26.980 5.586 ( 7.409 16.249 -14.884) 23.247 6.545 ( -6.446 -4.192 8.858) 11.729 6.681 ( 2.255 -0.273 -0.590) 2.347 6.914 ( -7.483 5.063 13.810) 16.503 7.193 ( 5.840 2.221 -13.275) 14.672 7.761 ( -9.744 -1.139 25.084) 26.934 8.271 ( 10.753 -6.156 -25.769) 28.593 9.222 ( -7.594 -32.932 15.265) 37.084 9.508 ( 1.922 3.227 6.189) 7.239 9.684 ( 8.373 -28.253 -17.070) 34.055 9.748 ( 0.333 10.418 -12.095) 15.966 10.686 ( -8.900 -8.829 13.290) 18.270 11.007 ( 10.067 -12.668 -14.483) 21.716 12.691 ( 6.026 -6.120 9.632) 12.905 12.784 ( -3.826 -8.507 -13.070) 16.057 14.952 ( -18.338 43.852 29.463) 55.923 15.488 ( 10.854 40.868 -16.347) 45.335 16.524 ( -5.893 16.575 20.400) 26.937 16.924 ( 6.915 15.912 -21.680) 27.768 18.833 ( -2.194 -23.383 1.944) 23.566 18.886 ( 1.642 -24.445 -1.873) 24.571 19.145 ( -8.500 -3.704 0.965) 9.322 19.301 ( 10.417 -7.148 -3.676) 13.158 ======================= Grid point 645 (331/366) ======================= q-point: ( 0.27 0.27 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.852 ( 2.743 -0.000 -1.850) 3.308 1.216 ( 4.277 -0.000 -7.486) 8.621 1.396 ( -2.840 0.000 5.610) 6.288 1.434 ( -2.174 0.000 5.426) 5.846 1.587 ( 2.081 -0.000 -6.440) 6.767 1.654 ( 0.757 -0.000 -0.847) 1.136 1.891 ( -4.544 0.000 5.524) 7.152 2.773 ( 2.437 -0.000 -8.077) 8.437 3.844 ( -5.715 0.000 17.067) 17.998 4.038 ( -8.608 0.000 21.553) 23.208 4.145 ( 5.458 -0.000 -5.646) 7.853 4.406 ( 2.762 -0.000 -15.589) 15.832 5.242 ( 1.939 -0.000 -10.595) 10.771 5.437 ( -2.655 0.000 8.809) 9.201 5.767 ( -8.514 0.000 13.933) 16.328 6.352 ( 1.478 -0.000 -10.135) 10.242 7.326 ( 9.471 -0.000 -14.518) 17.334 7.468 ( -2.930 0.000 15.213) 15.492 7.765 ( -12.996 0.000 33.291) 35.737 8.392 ( 10.633 -0.000 -26.193) 28.269 9.006 ( -3.035 0.000 7.854) 8.420 9.387 ( 4.644 -0.000 -12.064) 12.927 10.389 ( -5.172 0.000 13.079) 14.064 10.924 ( 4.375 -0.000 -14.090) 14.754 11.865 ( -12.205 0.000 32.706) 34.909 12.250 ( -8.757 0.000 15.376) 17.695 12.642 ( 10.451 -0.000 -17.316) 20.226 12.857 ( 2.321 -0.000 -5.976) 6.411 13.039 ( 4.788 -0.000 -10.594) 11.625 13.770 ( 2.214 -0.000 -6.751) 7.104 15.853 ( -8.465 0.000 21.873) 23.454 16.291 ( 9.072 -0.000 -23.171) 24.883 18.881 ( -1.182 0.000 1.250) 1.720 19.567 ( -1.058 0.000 7.181) 7.259 19.714 ( -2.174 0.000 3.802) 4.380 19.750 ( 5.183 -0.000 -19.468) 20.146 ======================= Grid point 646 (332/366) ======================= q-point: ( 0.36 0.27 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.896 ( 3.131 -2.404 -0.413) 3.969 1.193 ( -2.486 5.170 -2.797) 6.382 1.229 ( 1.665 8.113 1.903) 8.498 1.365 ( 2.225 13.175 -5.982) 14.640 1.590 ( -0.967 -7.265 5.421) 9.116 1.823 ( -1.845 -9.869 -2.307) 10.301 1.941 ( 1.340 -5.517 6.205) 8.411 2.769 ( -2.419 -2.151 -7.845) 8.487 3.849 ( -6.467 1.172 19.355) 20.440 3.987 ( -8.198 3.623 18.217) 20.303 4.217 ( 4.206 -4.255 -2.679) 6.556 4.497 ( 5.594 -10.607 -17.073) 20.864 5.197 ( 3.229 5.989 -4.763) 8.306 5.320 ( -1.590 4.040 3.125) 5.349 5.903 ( -8.017 -12.005 12.991) 19.420 6.434 ( -1.300 -10.130 -11.290) 15.224 7.303 ( 5.938 7.826 -1.778) 9.983 7.400 ( 0.936 5.808 4.755) 7.565 7.761 ( -12.776 0.529 32.623) 35.039 8.393 ( 10.976 0.709 -28.259) 30.324 9.111 ( -3.209 -10.629 9.743) 14.772 9.415 ( 3.964 -3.468 -11.914) 13.027 10.277 ( -4.830 14.538 15.657) 21.905 10.808 ( 3.687 12.497 -16.005) 20.638 11.281 ( -9.972 35.707 28.692) 46.880 11.939 ( 10.400 37.434 -28.925) 48.437 12.862 ( 3.582 -6.769 -4.703) 8.987 13.016 ( -3.072 -2.459 3.117) 5.020 13.213 ( -5.736 -33.290 25.973) 42.611 14.142 ( 4.196 -36.445 -17.954) 40.844 15.962 ( -8.286 -11.638 21.160) 25.531 16.381 ( 9.087 -9.628 -23.046) 26.578 18.895 ( 1.865 -0.660 2.856) 3.474 19.483 ( -2.613 9.960 6.494) 12.173 19.585 ( -0.447 11.384 -1.770) 11.530 19.717 ( 1.960 3.441 -13.666) 14.228 ======================= Grid point 647 (333/366) ======================= q-point: ( 0.45 0.27 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.951 ( 0.732 0.521 2.625) 2.775 0.975 ( -2.970 11.448 6.382) 13.439 1.114 ( 3.274 14.360 -7.929) 16.727 1.173 ( 0.395 1.976 -7.078) 7.359 1.730 ( 0.328 -6.858 5.324) 8.688 1.942 ( -4.590 -7.492 -0.936) 8.836 2.122 ( 6.577 -8.298 4.833) 11.639 2.790 ( -7.177 -5.941 -5.596) 10.868 3.758 ( -11.724 8.726 26.785) 30.512 3.971 ( -2.423 -0.940 15.238) 15.458 4.292 ( 6.269 -0.409 -10.159) 11.945 4.672 ( 6.855 -6.584 -19.971) 22.118 5.121 ( -3.407 -1.847 13.677) 14.215 5.401 ( 5.866 -10.344 -11.902) 16.825 6.093 ( -6.738 -10.979 11.479) 17.254 6.559 ( -3.730 -7.290 -9.823) 12.789 7.132 ( -0.718 11.637 12.940) 17.417 7.365 ( 6.412 2.121 -6.386) 9.295 7.748 ( -12.072 0.638 29.796) 32.155 8.351 ( 10.629 3.577 -29.033) 31.123 9.342 ( -4.721 -13.276 10.198) 17.393 9.501 ( 3.941 -5.353 -9.521) 11.612 9.853 ( -5.585 30.273 19.355) 36.363 10.385 ( 7.099 33.079 -23.252) 41.052 10.834 ( -5.042 15.988 19.073) 25.393 11.365 ( 6.422 22.507 -22.129) 32.210 12.811 ( 9.718 8.365 -12.134) 17.654 12.945 ( -7.539 5.207 5.961) 10.930 14.035 ( -9.388 -46.830 36.178) 59.917 14.842 ( 4.263 -41.505 -19.572) 46.086 16.236 ( -8.135 -17.934 19.280) 27.559 16.612 ( 9.251 -15.040 -22.396) 28.519 18.937 ( 3.774 -0.483 3.880) 5.434 19.225 ( -1.500 18.209 4.733) 18.874 19.304 ( -0.845 19.222 0.267) 19.242 19.582 ( -0.866 7.492 -12.822) 14.876 ======================= Grid point 648 (334/366) ======================= q-point: (-0.45 -0.73 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.715 ( -4.460 13.798 7.891) 16.509 0.856 ( 4.028 14.348 -9.143) 17.483 0.982 ( 0.322 -0.070 2.501) 2.523 1.117 ( -0.385 2.232 -5.813) 6.239 1.871 ( 0.593 -7.009 5.574) 8.975 2.048 ( -3.107 -7.810 -2.289) 8.711 2.323 ( 8.877 -6.689 5.905) 12.586 2.851 ( -11.149 -8.672 -4.403) 14.795 3.560 ( -10.983 12.051 29.493) 33.700 4.043 ( 2.867 -2.308 8.212) 8.999 4.217 ( 7.607 9.075 -13.570) 18.010 4.722 ( 0.300 -2.746 -17.661) 17.876 5.303 ( -3.961 -13.744 19.115) 23.874 5.651 ( 6.155 -15.523 -13.830) 21.682 6.262 ( -1.469 -7.587 7.372) 10.680 6.583 ( -3.251 -0.815 -8.139) 8.802 7.006 ( -0.725 4.862 16.458) 17.177 7.351 ( 2.011 1.060 -5.631) 6.073 7.740 ( -10.440 -0.541 23.218) 25.463 8.258 ( 8.895 6.157 -26.308) 28.446 9.181 ( -6.276 30.249 16.560) 35.052 9.538 ( 4.391 8.395 -11.085) 14.582 9.721 ( -0.412 -9.799 0.151) 9.809 9.760 ( 6.619 19.384 -13.105) 24.317 10.647 ( -2.776 8.810 14.558) 17.241 11.054 ( 2.747 12.184 -16.334) 20.562 12.686 ( 10.696 9.447 -9.263) 17.013 12.801 ( -9.149 5.456 3.804) 11.311 14.894 ( -8.241 -44.600 34.838) 57.190 15.556 ( 2.874 -40.442 -16.235) 43.674 16.553 ( -8.690 -17.061 17.842) 26.171 16.898 ( 9.308 -15.441 -20.767) 27.501 18.808 ( 0.470 24.283 2.437) 24.410 18.889 ( -0.887 25.182 -1.319) 25.233 19.016 ( 5.192 1.471 4.743) 7.184 19.397 ( -3.514 7.440 -9.859) 12.841 ======================= Grid point 649 (335/366) ======================= q-point: (-0.36 -0.73 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.473 ( -4.524 11.211 6.093) 13.538 0.609 ( 4.657 13.364 -9.497) 17.044 0.985 ( -0.062 0.353 2.499) 2.524 1.062 ( -0.203 2.239 -3.848) 4.457 2.016 ( 1.464 -6.337 5.827) 8.733 2.155 ( -2.939 -6.316 -2.699) 7.471 2.521 ( 13.366 -5.363 7.728) 16.344 2.907 ( -15.356 -8.245 -4.720) 18.057 3.379 ( -6.130 7.983 23.379) 25.454 3.928 ( 7.324 14.080 -26.143) 30.583 4.232 ( 2.682 -4.371 17.684) 18.412 4.669 ( -3.802 2.587 -13.612) 14.368 5.612 ( -2.760 -16.891 19.151) 25.684 5.924 ( 4.484 -13.598 -11.411) 18.309 6.351 ( 2.005 -0.220 1.955) 2.809 6.498 ( -3.865 5.749 -3.844) 7.923 7.073 ( 0.585 -7.601 14.661) 16.524 7.334 ( -0.513 -0.531 -2.593) 2.696 7.741 ( -7.705 -0.671 12.814) 14.967 8.098 ( 5.475 10.811 -19.606) 23.049 8.713 ( -2.025 19.920 7.267) 21.301 9.011 ( 8.279 29.202 -22.575) 37.828 9.864 ( -2.185 -10.603 5.961) 12.358 9.910 ( 2.733 -9.209 -0.619) 9.626 10.531 ( -1.676 6.009 11.023) 12.666 10.832 ( 1.298 10.130 -14.124) 17.429 12.583 ( 10.757 7.686 -5.140) 14.185 12.663 ( -9.435 3.216 0.184) 9.970 15.693 ( -7.221 -39.710 32.999) 52.133 16.238 ( 1.695 -37.421 -13.436) 39.796 16.789 ( -11.270 -10.242 21.557) 26.393 17.161 ( 8.189 -12.297 -16.980) 22.508 18.315 ( 2.891 30.467 -1.745) 30.653 18.394 ( 1.480 27.815 -7.296) 28.794 19.056 ( 5.109 0.165 3.383) 6.130 19.238 ( -4.580 4.659 -5.804) 8.739 ======================= Grid point 650 (336/366) ======================= q-point: (-0.27 -0.73 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.325 ( -2.289 1.932 -0.257) 3.007 0.406 ( 4.555 9.296 -7.675) 12.886 0.986 ( 0.002 0.118 1.350) 1.355 1.020 ( 0.211 1.200 -2.184) 2.501 2.131 ( 1.946 -2.928 5.614) 6.624 2.203 ( -3.236 -1.993 -2.005) 4.297 2.725 ( 16.224 -2.427 12.212) 20.451 2.906 ( -18.356 -5.887 -6.088) 20.215 3.363 ( 1.940 -3.904 7.976) 9.090 3.641 ( 1.801 13.103 -19.654) 23.690 4.369 ( 3.525 -3.582 11.516) 12.565 4.532 ( -5.613 5.659 -5.472) 9.668 5.950 ( -0.378 -16.573 14.106) 21.767 6.119 ( 2.600 -7.484 -5.458) 9.621 6.289 ( -4.296 9.896 4.008) 11.509 6.334 ( -0.275 6.493 -3.129) 7.213 7.297 ( 0.644 -10.132 8.115) 12.997 7.365 ( 0.190 -2.959 0.744) 3.057 7.728 ( -2.328 -1.200 1.120) 2.849 7.846 ( 0.773 13.587 -9.098) 16.369 8.518 ( 2.943 2.588 -4.758) 6.164 8.621 ( 5.216 13.320 -15.371) 20.998 10.020 ( -8.910 -8.412 6.662) 13.947 10.042 ( 6.058 0.327 5.620) 8.269 10.498 ( 1.640 -1.726 1.554) 2.844 10.632 ( 0.533 8.776 -10.895) 14.000 12.536 ( 9.599 4.128 -0.482) 10.460 12.570 ( -8.117 -0.187 -3.913) 9.013 16.357 ( -5.399 -28.093 28.717) 40.534 16.670 ( -6.164 -1.272 1.398) 6.447 16.994 ( -10.248 -24.169 22.203) 34.382 17.315 ( 0.611 0.799 0.664) 1.205 17.827 ( 9.622 19.122 -17.661) 27.751 17.932 ( 7.020 19.739 -21.902) 30.308 19.094 ( 4.688 -0.125 2.084) 5.132 19.141 ( -4.506 1.563 -2.898) 5.580 ======================= Grid point 651 (337/366) ======================= q-point: (-0.18 0.27 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.343 ( 2.254 -2.117 -0.221) 3.100 0.396 ( 1.415 -9.825 -7.756) 12.597 0.982 ( -0.777 0.344 1.191) 1.463 1.020 ( 1.389 -1.055 -2.171) 2.785 2.137 ( -3.993 3.112 2.956) 5.863 2.201 ( 3.032 1.544 0.662) 3.467 2.818 ( -14.368 -1.274 -4.797) 15.201 2.887 ( 11.343 1.590 9.342) 14.780 3.431 ( -4.841 4.316 -2.943) 7.122 3.568 ( 8.981 -13.278 -7.521) 17.707 4.356 ( -9.374 6.316 3.602) 11.864 4.492 ( 7.489 -3.110 1.472) 8.242 5.964 ( -7.768 18.758 10.170) 22.707 6.160 ( 1.365 8.793 -8.199) 12.100 6.277 ( 4.707 -10.122 10.817) 15.544 6.287 ( -2.253 -9.408 -1.973) 9.873 7.297 ( -3.597 9.060 4.294) 10.652 7.405 ( 0.446 2.872 -4.076) 5.006 7.691 ( -1.390 0.524 8.744) 8.870 7.875 ( 4.204 -14.606 -9.898) 18.138 8.511 ( 1.087 -2.494 -4.615) 5.357 8.624 ( 6.553 -13.104 -15.303) 21.186 9.993 ( 0.678 9.076 12.174) 15.200 10.051 ( -6.424 1.098 -1.224) 6.631 10.501 ( -2.203 1.725 -0.273) 2.811 10.629 ( 6.954 -8.861 -8.096) 13.872 12.538 ( -6.232 -3.815 -6.800) 9.981 12.569 ( 8.121 -0.186 2.622) 8.536 16.336 ( -15.318 28.719 25.125) 41.118 16.667 ( 4.166 3.645 3.271) 6.430 16.999 ( -8.170 22.981 24.695) 34.710 17.316 ( -1.072 -1.503 0.515) 1.917 17.853 ( 5.097 -18.881 -21.450) 29.028 17.921 ( 9.596 -20.845 -19.224) 29.936 19.091 ( -5.069 -0.264 -1.190) 5.213 19.149 ( 5.403 -1.836 0.498) 5.728 ======================= Grid point 652 (338/366) ======================= q-point: (-0.09 0.27 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.487 ( -0.818 -11.088 6.185) 12.723 0.607 ( 2.819 -13.679 -9.451) 16.864 0.976 ( -1.393 0.051 2.032) 2.464 1.055 ( 2.929 -1.861 -3.232) 4.742 2.022 ( -4.796 6.503 3.085) 8.649 2.166 ( 4.275 5.229 -0.173) 6.756 2.657 ( -14.870 4.244 -11.667) 19.372 2.932 ( 11.872 6.350 11.349) 17.608 3.434 ( -10.375 -8.012 15.807) 20.535 3.867 ( 10.321 -15.012 -16.410) 24.518 4.187 ( -12.105 5.585 8.976) 16.071 4.618 ( 13.337 -3.215 -7.332) 15.555 5.566 ( -10.360 21.198 14.926) 27.919 5.911 ( 6.047 16.953 -12.210) 21.750 6.401 ( -4.728 -7.276 5.820) 10.448 6.559 ( 2.874 -12.551 1.881) 13.012 7.057 ( -8.346 12.421 6.353) 16.258 7.308 ( 4.679 6.406 -6.119) 10.018 7.740 ( -5.786 -1.921 18.611) 19.584 8.130 ( 8.883 -10.838 -18.726) 23.388 8.715 ( -3.633 -20.745 6.881) 22.156 9.012 ( 9.134 -29.552 -21.968) 37.939 9.821 ( -2.069 12.074 9.269) 15.362 9.906 ( -0.889 9.642 -5.395) 11.085 10.531 ( -6.148 -5.707 9.227) 12.470 10.834 ( 8.715 -10.471 -11.679) 17.944 12.578 ( -4.508 -7.221 -10.705) 13.677 12.667 ( 6.754 -3.602 6.311) 9.921 15.670 ( -16.651 39.825 29.519) 52.294 16.222 ( 8.398 37.255 -11.681) 39.936 16.792 ( -6.793 10.755 23.962) 27.129 17.169 ( 5.434 12.270 -17.936) 22.400 18.329 ( -0.933 -29.949 -3.837) 30.208 18.401 ( 3.600 -28.534 -6.086) 29.398 19.061 ( -6.235 -0.715 -0.761) 6.322 19.249 ( 7.104 -4.871 -1.364) 8.721 ======================= Grid point 657 (339/366) ======================= q-point: ( 0.36 0.36 -0.55) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.900 ( 4.510 -0.000 0.371) 4.525 1.188 ( -1.722 0.000 -7.382) 7.580 1.423 ( 1.416 -0.000 5.909) 6.076 1.436 ( -1.767 0.000 5.256) 5.545 1.581 ( 2.009 -0.000 -6.091) 6.414 1.644 ( -1.307 0.000 -1.337) 1.870 1.923 ( 3.102 -0.000 9.705) 10.189 2.700 ( -5.450 0.000 -11.025) 12.299 3.884 ( -2.639 0.000 18.916) 19.099 4.025 ( -9.870 0.000 20.519) 22.770 4.183 ( 3.332 -0.000 -3.458) 4.802 4.364 ( 4.011 -0.000 -16.948) 17.416 5.249 ( 6.075 -0.000 -7.043) 9.301 5.425 ( -5.161 0.000 6.321) 8.161 5.745 ( -6.392 0.000 15.292) 16.575 6.288 ( 0.053 -0.000 -16.381) 16.381 7.409 ( 12.234 -0.000 -11.143) 16.548 7.480 ( -6.278 0.000 12.902) 14.349 7.768 ( -12.985 0.000 33.962) 36.360 8.396 ( 10.696 -0.000 -26.628) 28.696 9.018 ( -1.768 0.000 8.853) 9.028 9.373 ( 2.980 -0.000 -12.682) 13.027 10.409 ( -2.497 0.000 13.812) 14.036 10.886 ( 1.174 -0.000 -14.135) 14.184 11.872 ( -12.099 0.000 32.031) 34.239 12.230 ( -5.539 0.000 13.666) 14.746 12.694 ( 10.334 -0.000 -16.719) 19.655 12.840 ( -0.363 0.000 -5.300) 5.312 13.098 ( 11.241 -0.000 -7.673) 13.610 13.712 ( -4.012 0.000 -10.083) 10.851 15.854 ( -8.458 0.000 21.780) 23.364 16.291 ( 9.067 -0.000 -23.140) 24.853 18.922 ( 4.610 -0.000 4.971) 6.780 19.561 ( -4.821 0.000 3.428) 5.916 19.701 ( -2.587 0.000 3.465) 4.324 19.705 ( 3.493 -0.000 -17.747) 18.087 ======================= Grid point 658 (340/366) ======================= q-point: (-0.55 -0.64 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.945 ( 3.258 -1.246 1.666) 3.865 1.137 ( -3.446 2.799 -3.433) 5.612 1.246 ( -1.168 10.773 3.653) 11.436 1.363 ( 2.234 13.035 -6.115) 14.570 1.622 ( 1.278 -7.707 5.138) 9.350 1.779 ( -2.584 -8.075 -1.635) 8.635 2.044 ( 7.126 -6.517 9.378) 13.462 2.643 ( -8.600 -2.404 -10.297) 13.630 3.868 ( -7.895 4.887 21.297) 23.233 3.983 ( -4.194 0.898 14.161) 14.796 4.252 ( 1.424 -4.688 0.939) 4.989 4.484 ( 5.979 -11.908 -17.109) 21.685 5.234 ( 3.484 8.614 -0.880) 9.333 5.311 ( 0.336 0.477 -1.501) 1.610 5.879 ( -6.324 -11.148 14.769) 19.555 6.341 ( -1.061 -9.234 -16.310) 18.773 7.357 ( -2.811 9.719 10.221) 14.381 7.447 ( 7.859 2.805 -6.871) 10.809 7.763 ( -12.699 0.795 33.208) 35.562 8.390 ( 10.806 1.184 -28.434) 30.441 9.123 ( -2.925 -9.554 10.293) 14.345 9.398 ( 3.157 -4.461 -12.301) 13.460 10.311 ( -2.869 15.057 16.554) 22.561 10.757 ( 1.244 11.720 -15.684) 19.619 11.306 ( -8.597 34.991 28.171) 45.737 11.919 ( 9.302 37.470 -28.582) 48.036 12.895 ( 3.227 -10.189 -0.735) 10.713 12.965 ( -7.047 -0.325 3.594) 7.917 13.319 ( 2.300 -29.282 22.757) 37.157 14.074 ( 1.719 -38.468 -21.819) 44.258 15.961 ( -8.438 -11.382 21.032) 25.359 16.383 ( 9.228 -9.828 -22.974) 26.638 18.978 ( 6.280 -0.212 6.528) 9.060 19.452 ( -5.196 8.087 -0.371) 9.619 19.574 ( -0.086 10.953 -0.619) 10.971 19.657 ( -1.056 5.039 -9.458) 10.768 ======================= Grid point 659 (341/366) ======================= q-point: (-0.45 -0.64 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.958 ( -3.626 12.416 7.643) 15.024 0.986 ( 0.850 0.773 2.806) 3.032 1.118 ( 2.145 11.898 -7.047) 13.994 1.125 ( -1.238 3.783 -5.897) 7.115 1.774 ( 2.165 -6.550 4.671) 8.331 1.887 ( -2.766 -7.177 -1.626) 7.862 2.263 ( 9.180 -8.320 8.521) 15.036 2.629 ( -10.797 -5.968 -7.841) 14.618 3.743 ( -11.807 7.935 27.639) 31.085 4.030 ( 0.869 -2.851 10.332) 10.753 4.321 ( 3.826 -0.122 -4.971) 6.274 4.642 ( 4.307 -4.117 -20.026) 20.894 5.146 ( -3.196 -2.396 12.602) 13.220 5.415 ( 6.009 -10.037 -12.840) 17.370 6.095 ( -2.659 -11.907 13.543) 18.228 6.453 ( -2.471 -7.686 -13.222) 15.492 7.182 ( -2.837 9.723 14.183) 17.428 7.407 ( 5.904 4.480 -9.128) 11.758 7.744 ( -12.058 1.211 30.703) 33.008 8.341 ( 10.470 3.883 -28.820) 30.908 9.323 ( -6.417 -11.178 11.266) 17.119 9.512 ( 5.564 -7.559 -10.528) 14.104 9.887 ( -4.909 30.863 19.881) 37.039 10.349 ( 5.718 31.080 -22.903) 39.028 10.877 ( -3.720 15.867 19.144) 25.142 11.325 ( 5.357 23.432 -22.540) 32.952 12.849 ( -10.895 5.778 6.112) 13.764 12.897 ( 11.222 7.454 -10.388) 17.012 14.124 ( -5.277 -45.331 34.766) 57.371 14.781 ( 3.473 -42.555 -22.338) 48.187 16.225 ( -8.596 -17.344 19.221) 27.279 16.622 ( 9.612 -15.430 -22.203) 28.696 19.032 ( 5.739 1.598 6.252) 8.636 19.220 ( -2.235 14.750 1.158) 14.964 19.302 ( -0.216 19.012 2.658) 19.198 19.480 ( -3.894 8.556 -12.035) 15.271 ======================= Grid point 660 (342/366) ======================= q-point: (-0.36 -0.64 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.696 ( -4.642 14.299 8.365) 17.204 0.864 ( 4.216 14.003 -8.858) 17.098 1.000 ( -0.210 0.569 3.557) 3.609 1.076 ( -1.534 1.032 -4.308) 4.688 1.920 ( 2.395 -6.829 5.110) 8.859 2.000 ( -2.069 -7.686 -3.115) 8.548 2.502 ( 11.735 -8.172 8.737) 16.758 2.657 ( -12.704 -7.365 -6.646) 16.119 3.575 ( -10.594 10.478 30.741) 34.162 4.102 ( 6.950 2.577 -12.563) 14.587 4.270 ( 3.162 3.921 6.624) 8.322 4.618 ( -1.263 0.064 -18.539) 18.582 5.336 ( -5.791 -15.060 18.455) 24.513 5.657 ( 5.752 -15.312 -14.634) 21.948 6.307 ( 1.503 -7.332 8.588) 11.391 6.494 ( -2.748 -1.892 -9.168) 9.757 7.084 ( -0.787 3.123 16.218) 16.535 7.335 ( 1.991 2.839 -9.789) 10.385 7.726 ( -10.615 0.528 25.564) 27.685 8.241 ( 9.291 6.589 -26.032) 28.415 9.185 ( -6.194 28.572 16.657) 33.648 9.533 ( 2.572 11.296 -8.878) 14.596 9.693 ( -0.568 4.499 -6.113) 7.611 9.802 ( 7.823 2.449 -9.715) 12.711 10.694 ( -2.061 9.271 15.349) 18.049 10.998 ( 1.843 12.343 -16.314) 20.540 12.679 ( -11.502 5.675 3.977) 13.428 12.796 ( 11.956 9.052 -8.063) 17.026 14.980 ( -5.943 -43.699 33.597) 55.441 15.502 ( 2.852 -41.078 -18.495) 45.139 16.526 ( -9.372 -16.347 18.222) 26.213 16.917 ( 9.614 -15.723 -20.340) 27.447 18.831 ( 1.116 23.956 2.273) 24.090 18.869 ( -0.893 24.996 -1.739) 25.072 19.125 ( 5.981 2.543 6.346) 9.084 19.279 ( -5.747 6.188 -9.976) 13.071 ======================= Grid point 661 (343/366) ======================= q-point: (-0.27 -0.64 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.447 ( -4.260 11.661 6.792) 14.151 0.624 ( 4.828 13.089 -9.073) 16.642 0.996 ( -0.615 0.459 2.820) 2.923 1.039 ( -0.361 1.379 -2.859) 3.195 2.068 ( 0.704 -6.062 4.453) 7.555 2.108 ( -0.529 -6.190 -1.960) 6.514 2.665 ( -15.210 -5.709 -6.467) 17.486 2.769 ( 15.926 -8.200 9.133) 20.107 3.427 ( -5.506 6.547 24.225) 25.691 3.878 ( 6.349 16.193 -27.091) 32.194 4.363 ( 2.250 -3.807 18.109) 18.641 4.539 ( -4.589 1.877 -13.703) 14.572 5.654 ( -5.034 -18.314 16.750) 25.324 5.919 ( 3.922 -13.301 -12.505) 18.673 6.391 ( 1.212 0.358 4.152) 4.340 6.422 ( -4.221 5.726 -3.428) 7.896 7.164 ( 1.570 -6.635 12.659) 14.378 7.310 ( 1.305 -1.964 -7.723) 8.075 7.712 ( -8.092 0.831 17.390) 19.199 8.084 ( 7.553 10.907 -18.818) 23.025 8.724 ( -1.957 19.912 7.082) 21.225 9.003 ( 8.320 28.950 -22.750) 37.748 9.785 ( -10.706 -10.639 7.468) 16.840 10.011 ( 9.766 -9.896 -4.230) 14.533 10.572 ( -1.541 6.893 12.274) 14.161 10.773 ( 0.979 9.873 -13.510) 16.762 12.528 ( -10.380 3.281 0.455) 10.896 12.707 ( 11.085 7.304 -4.384) 13.980 15.773 ( -6.496 -39.207 31.927) 50.978 16.185 ( 2.067 -37.340 -15.635) 40.534 16.749 ( -11.905 -10.036 22.845) 27.647 17.183 ( 8.069 -12.027 -16.134) 21.681 18.340 ( 2.112 30.095 -3.023) 30.320 18.382 ( 3.113 27.928 -7.387) 29.056 19.127 ( -3.346 2.008 -1.642) 4.234 19.157 ( 2.982 2.344 0.140) 3.796 ======================= Grid point 662 (344/366) ======================= q-point: (-0.18 -0.64 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.299 ( -1.537 1.931 0.078) 2.469 0.429 ( 4.635 8.906 -7.059) 12.273 0.991 ( -0.344 0.546 1.318) 1.467 1.012 ( 0.151 0.372 -2.013) 2.053 2.129 ( -3.387 -1.527 0.077) 3.716 2.214 ( 3.301 -3.195 3.236) 5.620 2.622 ( -17.059 -3.873 -6.759) 18.753 3.024 ( 16.405 -3.113 13.743) 21.626 3.439 ( 3.155 -4.889 7.159) 9.225 3.559 ( 1.255 13.877 -18.680) 23.305 4.408 ( -6.074 4.430 -2.285) 7.857 4.484 ( 2.379 -2.574 7.770) 8.524 5.982 ( -3.766 -16.792 8.193) 19.060 6.102 ( -1.869 -7.347 -5.149) 9.165 6.225 ( -3.415 11.118 2.000) 11.801 6.365 ( 2.222 4.126 2.505) 5.313 7.339 ( -0.030 -6.866 5.148) 8.582 7.376 ( 1.747 -3.354 -1.582) 4.099 7.666 ( -5.520 0.781 0.722) 5.621 7.881 ( 7.168 10.719 -2.781) 13.192 8.531 ( 2.847 2.238 -5.127) 6.277 8.611 ( 5.420 13.795 -15.391) 21.367 9.896 ( -11.473 -7.600 4.643) 14.524 10.172 ( 6.420 0.508 5.880) 8.720 10.530 ( 1.823 -1.582 1.224) 2.707 10.587 ( 0.959 7.341 -9.457) 12.010 12.434 ( -8.085 -0.340 -3.412) 8.782 12.668 ( 9.324 3.856 -0.648) 10.111 16.430 ( -6.303 -27.906 27.866) 39.938 16.596 ( -5.709 -1.006 1.780) 6.064 16.974 ( -9.920 -24.915 21.856) 34.596 17.326 ( 0.340 1.414 1.268) 1.930 17.855 ( 8.226 19.233 -18.572) 27.973 17.922 ( 8.886 20.234 -21.764) 31.017 19.060 ( -4.646 0.748 -2.218) 5.202 19.170 ( 4.427 0.352 1.621) 4.727 ======================= Grid point 663 (345/366) ======================= q-point: (-0.09 0.36 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.372 ( 2.001 -2.219 -0.146) 2.991 0.379 ( 2.313 -9.884 -7.817) 12.812 0.977 ( -0.880 0.558 1.072) 1.495 1.027 ( 1.411 -1.813 -2.548) 3.431 2.091 ( -3.464 3.201 1.493) 4.947 2.258 ( 3.234 1.683 2.142) 4.228 2.546 ( -15.210 -1.629 -8.281) 17.394 3.146 ( 11.690 4.095 15.026) 19.473 3.353 ( -4.737 3.424 -1.402) 6.010 3.652 ( 9.644 -12.302 -8.795) 17.936 4.252 ( -8.610 6.931 3.862) 11.708 4.593 ( 6.451 -5.244 0.466) 8.326 5.879 ( -11.397 16.812 9.082) 22.249 6.140 ( 1.373 5.860 -6.641) 8.963 6.258 ( 0.076 -8.897 -3.299) 9.489 6.383 ( 2.854 -6.574 8.599) 11.194 7.267 ( -4.224 13.422 4.747) 14.850 7.386 ( -1.256 1.224 -0.471) 1.816 7.697 ( 0.178 -4.957 -1.337) 5.137 7.931 ( 6.871 -10.046 -1.008) 12.213 8.502 ( 1.194 -2.405 -4.663) 5.381 8.632 ( 6.439 -12.803 -15.083) 20.806 9.900 ( -8.114 0.660 -2.442) 8.499 10.112 ( 1.005 9.829 13.146) 16.445 10.475 ( -1.681 1.463 0.348) 2.255 10.679 ( 6.978 -9.516 -9.408) 15.091 12.418 ( -4.920 -4.274 -7.073) 9.618 12.691 ( 6.812 -0.073 2.444) 7.238 16.269 ( -14.209 28.436 25.516) 40.763 16.733 ( 3.056 4.200 2.810) 5.905 17.017 ( -8.652 22.140 24.989) 34.489 17.306 ( -0.707 -0.962 0.094) 1.197 17.810 ( 5.009 -19.235 -20.223) 28.356 17.949 ( 9.503 -19.758 -19.515) 29.352 19.021 ( -4.109 0.153 -0.994) 4.230 19.217 ( 4.209 -2.415 -0.072) 4.853 ======================= Grid point 669 (346/366) ======================= q-point: (-0.55 -0.55 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.964 ( 3.438 -0.000 2.654) 4.344 1.112 ( -4.387 0.000 -5.127) 6.748 1.440 ( -1.820 0.000 5.447) 5.743 1.470 ( 1.091 -0.000 4.178) 4.319 1.581 ( 2.644 -0.000 -4.955) 5.616 1.612 ( -2.162 0.000 -1.719) 2.762 2.063 ( 8.330 -0.000 12.963) 15.408 2.528 ( -10.230 0.000 -12.540) 16.183 3.940 ( -7.603 0.000 20.528) 21.891 4.012 ( -4.240 0.000 17.817) 18.315 4.184 ( -2.727 0.000 1.479) 3.102 4.351 ( 9.379 -0.000 -21.118) 23.107 5.328 ( 9.596 -0.000 -3.514) 10.219 5.365 ( -7.219 0.000 2.806) 7.745 5.756 ( -4.305 0.000 16.178) 16.741 6.199 ( 1.312 -0.000 -19.701) 19.745 7.436 ( -9.392 0.000 10.817) 14.326 7.522 ( 12.178 -0.000 -9.453) 15.416 7.774 ( -12.855 0.000 34.302) 36.632 8.398 ( 10.727 -0.000 -27.429) 29.452 9.049 ( -1.108 0.000 10.116) 10.177 9.337 ( 1.814 -0.000 -13.062) 13.187 10.463 ( -0.794 0.000 14.636) 14.658 10.813 ( -0.712 0.000 -13.729) 13.747 11.877 ( -12.046 0.000 31.458) 33.685 12.243 ( -1.561 0.000 8.940) 9.075 12.738 ( 8.689 -0.000 -15.197) 17.506 12.793 ( -3.395 0.000 -2.897) 4.463 13.253 ( 16.314 -0.000 -4.700) 16.978 13.572 ( -6.021 0.000 -15.369) 16.506 15.854 ( -8.465 0.000 21.701) 23.294 16.291 ( 9.077 -0.000 -23.131) 24.849 19.045 ( 7.696 -0.000 8.807) 11.696 19.454 ( -8.172 0.000 -9.899) 12.836 19.682 ( -2.765 0.000 3.099) 4.153 19.682 ( 1.859 -0.000 -4.693) 5.048 ======================= Grid point 670 (347/366) ======================= q-point: (-0.45 -0.55 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.994 ( 1.844 -0.205 3.668) 4.110 1.066 ( -4.438 0.436 -3.335) 5.568 1.240 ( -3.274 13.338 6.065) 15.013 1.361 ( 2.121 12.390 -5.919) 13.894 1.671 ( 1.950 -8.393 4.505) 9.723 1.739 ( -1.716 -7.436 -2.431) 8.010 2.217 ( 9.604 -6.040 12.335) 16.759 2.450 ( -10.947 -3.068 -11.248) 15.992 3.848 ( -11.149 5.901 21.510) 24.936 4.032 ( 0.761 0.033 11.361) 11.386 4.258 ( -2.490 -6.814 3.627) 8.111 4.478 ( 6.615 -9.969 -17.581) 21.266 5.227 ( -4.979 7.251 2.815) 9.236 5.359 ( 10.011 1.691 -8.234) 13.072 5.895 ( -3.603 -11.509 17.326) 21.110 6.250 ( 1.267 -8.506 -17.944) 19.898 7.333 ( -8.542 6.468 11.140) 15.457 7.527 ( 9.402 5.055 -9.264) 14.135 7.769 ( -12.452 1.005 33.325) 35.590 8.385 ( 10.743 1.576 -28.626) 30.616 9.139 ( -2.958 -7.463 10.967) 13.591 9.374 ( 2.987 -6.426 -12.360) 14.247 10.369 ( -2.080 15.976 17.405) 23.717 10.684 ( 0.344 10.715 -15.209) 18.608 11.342 ( -8.019 33.952 27.549) 44.452 11.892 ( 9.137 38.214 -28.602) 48.599 12.869 ( -10.257 1.443 5.619) 11.784 12.936 ( 1.389 -13.902 3.519) 14.408 13.502 ( 8.636 -24.194 17.366) 31.008 13.975 ( 2.858 -41.164 -26.200) 48.878 15.957 ( -8.529 -10.949 20.980) 25.155 16.387 ( 9.316 -10.204 -22.954) 26.792 19.116 ( 7.515 0.738 9.511) 12.144 19.329 ( -8.513 4.042 -9.943) 13.700 19.574 ( -1.447 10.462 3.070) 10.999 19.611 ( -0.283 8.199 -3.150) 8.788 ======================= Grid point 671 (348/366) ======================= q-point: (-0.36 -0.55 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.950 ( -3.501 13.370 7.938) 15.938 1.010 ( -0.543 1.389 3.945) 4.217 1.055 ( -3.537 0.595 -3.043) 4.703 1.128 ( 3.155 13.169 -6.684) 15.101 1.833 ( 3.197 -6.687 3.886) 8.369 1.847 ( -1.545 -7.061 -2.786) 7.746 2.435 ( -9.941 -6.113 -7.255) 13.742 2.448 ( 9.129 -8.480 9.358) 15.582 3.733 ( -11.490 6.389 27.988) 30.922 4.096 ( 3.068 -3.119 4.152) 6.032 4.338 ( 0.408 -1.077 0.440) 1.233 4.577 ( 1.781 -1.573 -20.074) 20.214 5.162 ( -3.896 -3.234 11.070) 12.173 5.427 ( 6.297 -8.157 -14.091) 17.457 6.163 ( 1.210 -12.859 15.054) 19.835 6.367 ( 0.534 -7.378 -13.554) 15.441 7.194 ( -5.937 6.003 12.281) 14.903 7.429 ( 5.142 7.530 -10.460) 13.876 7.747 ( -11.780 1.616 31.256) 33.441 8.331 ( 10.561 4.005 -28.524) 30.679 9.292 ( -6.909 -8.505 11.432) 15.835 9.538 ( 6.335 -10.722 -10.335) 16.184 9.926 ( -5.144 32.379 20.273) 38.547 10.302 ( 5.227 29.111 -22.372) 37.084 10.930 ( -3.564 15.412 19.077) 24.782 11.277 ( 5.491 24.641 -22.923) 34.100 12.724 ( -12.295 6.284 7.176) 15.561 12.996 ( 10.363 5.743 -8.521) 14.594 14.250 ( -2.157 -42.757 31.224) 52.988 14.710 ( 4.707 -43.496 -24.745) 50.263 16.210 ( -8.756 -16.591 19.382) 26.974 16.635 ( 9.707 -15.977 -22.125) 28.966 19.133 ( 1.958 7.407 5.403) 9.375 19.165 ( -3.116 6.533 -3.757) 8.155 19.317 ( -1.912 16.003 4.061) 16.621 19.393 ( 0.282 13.117 -5.069) 14.065 ======================= Grid point 672 (349/366) ======================= q-point: (-0.27 -0.55 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.681 ( -4.259 14.675 8.802) 17.634 0.875 ( 4.176 13.654 -8.456) 16.594 1.003 ( -2.357 0.266 2.729) 3.616 1.046 ( -0.324 0.431 -0.757) 0.929 1.957 ( -1.060 -6.789 -2.637) 7.360 1.989 ( 3.620 -7.243 3.349) 8.762 2.454 ( -11.618 -6.028 -6.816) 14.757 2.717 ( 12.503 -10.281 9.097) 18.568 3.596 ( -10.352 8.755 30.757) 33.613 4.105 ( 8.211 8.575 -23.553) 26.376 4.356 ( -0.486 -2.565 17.082) 17.280 4.500 ( -1.212 2.155 -19.414) 19.571 5.345 ( -6.816 -15.345 17.514) 24.263 5.648 ( 4.532 -14.973 -15.507) 22.027 6.378 ( 1.235 -5.113 8.318) 9.842 6.427 ( 0.110 -1.542 -6.816) 6.989 7.138 ( -2.647 -0.248 10.945) 11.263 7.315 ( 3.316 3.927 -9.875) 11.132 7.726 ( -9.925 0.950 27.174) 28.946 8.235 ( 9.883 6.402 -25.394) 27.992 9.190 ( -6.065 26.302 16.642) 31.710 9.512 ( -1.322 9.510 -2.438) 9.906 9.653 ( 2.976 17.789 -14.538) 23.166 9.856 ( 7.000 -7.270 -8.313) 13.075 10.747 ( -2.500 9.556 15.774) 18.611 10.939 ( 2.303 12.538 -15.928) 20.401 12.547 ( -11.122 5.945 5.032) 13.578 12.911 ( 10.726 8.351 -7.430) 15.491 15.077 ( -5.303 -42.325 30.989) 52.724 15.445 ( 4.115 -41.460 -20.134) 46.274 16.497 ( -9.417 -15.596 18.936) 26.277 16.940 ( 9.425 -16.040 -20.092) 27.382 18.846 ( -0.568 25.514 -1.334) 25.555 18.862 ( 1.425 22.675 1.184) 22.751 19.126 ( -7.009 3.847 -6.059) 10.032 19.255 ( 5.612 4.602 4.246) 8.408 ======================= Grid point 673 (350/366) ======================= q-point: (-0.18 -0.55 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.432 ( -3.519 11.950 7.214) 14.395 0.641 ( 4.611 12.732 -8.632) 16.058 0.995 ( -1.368 -0.012 2.094) 2.502 1.027 ( 0.053 1.360 -1.031) 1.707 2.051 ( -1.344 -4.838 -1.639) 5.282 2.151 ( 3.271 -6.646 3.446) 8.169 2.443 ( -12.306 -3.471 -5.840) 14.056 3.028 ( 14.811 -10.884 8.156) 20.109 3.480 ( -5.441 4.957 23.329) 24.462 3.821 ( 6.332 17.830 -26.210) 32.326 4.409 ( -3.664 1.682 -12.937) 13.551 4.473 ( -0.119 -3.424 16.689) 17.037 5.657 ( -6.007 -18.357 13.403) 23.510 5.894 ( 1.962 -13.228 -12.210) 18.108 6.360 ( -2.286 6.260 -2.204) 7.020 6.425 ( -0.671 1.193 6.622) 6.762 7.217 ( -0.207 -7.115 2.183) 7.445 7.307 ( 3.174 -2.033 -3.792) 5.346 7.712 ( -6.079 2.461 18.568) 19.692 8.102 ( 8.595 9.072 -16.236) 20.489 8.734 ( -2.090 20.130 6.921) 21.389 8.996 ( 8.486 28.774 -22.760) 37.656 9.679 ( -10.289 -9.237 6.881) 15.445 10.105 ( 7.863 -11.580 -5.719) 15.120 10.614 ( -2.362 7.518 12.994) 15.197 10.723 ( 1.822 9.549 -12.424) 15.776 12.403 ( -8.550 3.392 1.737) 9.361 12.821 ( 8.949 6.869 -4.628) 12.194 15.844 ( -7.458 -38.480 29.868) 49.280 16.135 ( 3.417 -36.974 -16.818) 40.763 16.715 ( -11.584 -10.005 24.275) 28.698 17.205 ( 7.460 -11.786 -15.537) 20.880 18.337 ( 1.453 29.244 -5.632) 29.817 18.401 ( 4.291 28.563 -6.197) 29.541 19.036 ( -4.863 0.818 -3.427) 6.005 19.233 ( 3.970 2.865 3.059) 5.773 ======================= Grid point 674 (351/366) ======================= q-point: (-0.09 -0.55 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.285 ( -0.509 2.021 0.123) 2.088 0.452 ( 3.974 8.510 -6.642) 11.504 0.991 ( -0.683 0.998 1.317) 1.788 1.004 ( 0.368 -0.322 -1.948) 2.009 2.094 ( -1.429 -1.121 -0.124) 1.820 2.270 ( 2.171 -3.180 3.067) 4.923 2.396 ( -11.438 -2.200 -4.254) 12.400 3.280 ( 9.287 -2.339 14.042) 16.997 3.489 ( 2.774 14.477 -16.698) 22.274 3.517 ( 4.341 -6.650 2.748) 8.404 4.310 ( -4.900 3.949 -3.948) 7.429 4.552 ( 0.115 -2.638 8.843) 9.229 5.937 ( -5.643 -10.736 1.289) 12.197 6.045 ( -3.688 -4.672 1.629) 6.171 6.226 ( 2.091 3.500 -1.780) 4.449 6.398 ( -1.111 2.180 6.620) 7.058 7.349 ( -2.601 -2.952 6.175) 7.322 7.389 ( 3.241 -6.172 -6.479) 9.517 7.616 ( -1.980 5.825 -0.145) 6.154 7.972 ( 6.009 6.556 1.170) 8.970 8.538 ( 2.445 2.289 -5.853) 6.743 8.606 ( 5.781 13.680 -14.942) 21.067 9.779 ( -8.892 -6.863 4.610) 12.142 10.264 ( 2.796 0.505 5.112) 5.849 10.546 ( 1.065 5.066 -3.793) 6.418 10.570 ( 2.126 -0.484 -3.866) 4.438 12.329 ( -4.966 -0.412 -1.975) 5.360 12.768 ( 6.148 3.619 -1.772) 7.351 16.467 ( -8.121 -22.703 22.039) 32.666 16.551 ( -3.927 -6.148 6.890) 10.034 16.960 ( -9.370 -25.221 22.069) 34.799 17.336 ( -0.126 1.925 1.654) 2.541 17.855 ( 7.250 20.128 -19.499) 28.947 17.937 ( 9.814 19.828 -21.495) 30.846 18.999 ( -2.806 0.126 -1.271) 3.083 19.225 ( 2.560 0.755 0.969) 2.839 ======================= Grid point 681 (352/366) ======================= q-point: (-0.45 -0.45 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.017 ( 1.659 -0.000 4.619) 4.908 1.019 ( -6.399 0.000 -3.029) 7.080 1.444 ( -2.187 0.000 6.020) 6.405 1.489 ( -0.517 0.000 2.120) 2.182 1.570 ( -2.232 0.000 -2.583) 3.413 1.603 ( 3.259 -0.000 -2.653) 4.202 2.262 ( 9.600 -0.000 14.809) 17.648 2.318 ( -10.304 0.000 -12.715) 16.366 3.898 ( -12.851 0.000 21.527) 25.071 4.089 ( 0.572 -0.000 14.913) 14.924 4.135 ( -5.458 0.000 2.253) 5.905 4.384 ( 11.730 -0.000 -21.658) 24.630 5.269 ( -7.567 0.000 -0.512) 7.584 5.458 ( 11.652 -0.000 -2.797) 11.983 5.800 ( -2.353 0.000 18.068) 18.221 6.124 ( 3.125 -0.000 -19.884) 20.128 7.345 ( -11.943 0.000 9.396) 15.196 7.625 ( 10.283 -0.000 -9.255) 13.834 7.782 ( -12.670 0.000 34.052) 36.333 8.396 ( 10.736 -0.000 -28.192) 30.167 9.090 ( -1.203 0.000 11.101) 11.166 9.289 ( 1.462 -0.000 -13.055) 13.137 10.534 ( -0.607 0.000 15.311) 15.323 10.731 ( -0.706 0.000 -13.148) 13.167 11.879 ( -12.108 0.000 31.226) 33.492 12.277 ( 1.849 -0.000 3.028) 3.548 12.723 ( -6.007 0.000 0.951) 6.082 12.766 ( 6.497 -0.000 -12.924) 14.465 13.410 ( -3.191 0.000 -21.208) 21.447 13.469 ( 18.345 -0.000 -3.703) 18.715 15.855 ( -8.481 0.000 21.650) 23.252 16.291 ( 9.081 -0.000 -23.142) 24.860 19.203 ( 7.457 -0.000 11.490) 13.698 19.263 ( -10.545 0.000 -13.048) 16.776 19.660 ( -2.673 0.000 2.611) 3.737 19.693 ( 0.997 -0.000 0.628) 1.178 ======================= Grid point 682 (353/366) ======================= q-point: (-0.36 -0.45 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.976 ( -6.269 -0.965 -1.288) 6.473 1.038 ( 0.586 -0.016 4.816) 4.851 1.228 ( -3.560 14.641 7.382) 16.778 1.357 ( 1.732 11.638 -5.587) 13.026 1.696 ( -1.118 -8.779 -0.721) 8.879 1.729 ( 1.899 -7.861 1.610) 8.245 2.253 ( -9.053 -3.470 -11.050) 14.701 2.414 ( 8.993 -5.430 13.357) 16.993 3.810 ( -11.078 4.129 21.560) 24.589 4.106 ( 1.131 0.698 11.127) 11.207 4.226 ( -4.247 -9.266 2.344) 10.459 4.472 ( 6.135 -5.269 -17.792) 19.543 5.161 ( -5.498 3.295 0.463) 6.426 5.453 ( 10.373 6.310 -10.281) 15.910 5.969 ( 0.052 -12.856 20.002) 23.778 6.192 ( 3.833 -8.555 -16.543) 19.014 7.253 ( -11.227 3.434 9.416) 15.050 7.588 ( 6.750 7.553 -9.198) 13.683 7.778 ( -11.921 1.081 32.542) 34.674 8.378 ( 10.801 1.757 -28.797) 30.806 9.156 ( -3.303 -5.014 11.235) 12.739 9.352 ( 3.301 -8.991 -11.813) 15.208 10.431 ( -2.677 17.024 17.965) 24.894 10.614 ( 1.103 9.900 -14.680) 17.741 11.377 ( -8.335 32.810 27.027) 43.318 11.866 ( 9.757 39.375 -28.987) 49.858 12.759 ( -10.877 3.169 7.760) 13.732 12.968 ( -0.584 -16.899 6.476) 18.107 13.709 ( 10.066 -21.237 10.216) 25.626 13.890 ( 6.502 -42.517 -28.139) 51.398 15.953 ( -8.539 -10.490 21.006) 24.984 16.392 ( 9.308 -10.634 -22.986) 26.983 19.145 ( -9.915 1.458 -10.625) 14.605 19.263 ( 5.758 2.153 11.047) 12.642 19.558 ( -2.529 10.055 2.162) 10.591 19.617 ( 1.177 9.160 1.219) 9.315 ======================= Grid point 683 (354/366) ======================= q-point: (-0.27 -0.45 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.949 ( -2.942 14.052 8.188) 16.527 0.968 ( -5.336 -0.466 0.987) 5.446 1.047 ( 0.260 0.936 3.265) 3.407 1.132 ( 2.443 12.629 -6.228) 14.291 1.816 ( -0.434 -7.066 -3.522) 7.907 1.899 ( 3.502 -7.510 3.564) 9.020 2.257 ( -8.453 -5.881 -8.039) 13.064 2.636 ( 8.971 -9.072 10.288) 16.390 3.729 ( -10.931 4.976 28.102) 30.561 4.155 ( 4.917 -1.504 -1.715) 5.421 4.335 ( -2.949 -3.576 4.865) 6.719 4.486 ( 0.835 0.672 -20.246) 20.275 5.156 ( -5.267 -5.375 9.820) 12.372 5.436 ( 6.472 -4.817 -15.126) 17.143 6.263 ( 2.190 -11.010 8.827) 14.281 6.344 ( 5.085 -8.028 -4.667) 10.587 7.151 ( -8.451 2.354 8.484) 12.204 7.434 ( 3.491 9.075 -9.932) 13.899 7.756 ( -11.338 1.720 31.046) 33.097 8.325 ( 10.831 3.871 -28.259) 30.510 9.263 ( -6.348 -6.357 11.488) 14.583 9.568 ( 5.855 -13.357 -9.917) 17.636 9.958 ( -6.141 34.222 20.449) 40.336 10.259 ( 5.833 27.733 -21.775) 35.740 10.976 ( -4.601 14.860 18.861) 24.448 11.236 ( 6.648 25.724 -23.178) 35.258 12.609 ( -10.567 6.678 8.657) 15.205 13.076 ( 7.475 3.647 -6.909) 10.813 14.377 ( -1.802 -39.848 25.457) 47.320 14.654 ( 6.816 -43.924 -25.516) 51.253 16.195 ( -8.592 -15.930 19.693) 26.747 16.648 ( 9.507 -16.495 -22.186) 29.235 19.036 ( -6.844 1.876 -6.147) 9.389 19.212 ( 1.769 12.148 5.252) 13.353 19.290 ( -2.468 17.294 1.121) 17.505 19.433 ( 3.514 10.693 3.554) 11.804 ======================= Grid point 684 (355/366) ======================= q-point: (-0.18 -0.45 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.675 ( -3.616 14.839 8.947) 17.701 0.885 ( 3.838 13.419 -8.195) 16.186 0.978 ( -2.347 -1.261 1.551) 3.083 1.048 ( -0.556 1.040 2.327) 2.609 1.933 ( 0.116 -6.895 -3.233) 7.616 2.064 ( 4.555 -6.845 3.496) 8.934 2.285 ( -8.366 -4.930 -5.568) 11.193 2.914 ( 9.884 -12.261 6.844) 17.172 3.618 ( -10.161 7.372 29.896) 32.424 4.088 ( 8.781 12.031 -25.338) 29.391 4.386 ( 0.542 2.272 -18.339) 18.487 4.425 ( -4.195 -5.428 17.471) 18.770 5.340 ( -7.202 -15.340 16.609) 23.729 5.617 ( 3.534 -13.983 -16.300) 21.765 6.387 ( 1.864 -2.234 -4.244) 5.145 6.467 ( 1.348 0.425 9.664) 9.767 7.125 ( -3.288 -2.492 0.886) 4.220 7.321 ( 2.495 2.399 -4.674) 5.816 7.742 ( -9.163 0.474 26.946) 28.465 8.239 ( 10.301 5.730 -24.711) 27.379 9.199 ( -5.554 24.177 16.756) 29.935 9.473 ( -4.865 7.231 4.137) 9.647 9.626 ( 6.977 27.462 -21.036) 35.289 9.896 ( 5.325 -12.091 -8.645) 15.789 10.787 ( -4.070 9.622 15.677) 18.839 10.898 ( 3.879 12.703 -15.288) 20.251 12.447 ( -7.970 6.216 6.700) 12.127 12.995 ( 7.519 7.624 -7.656) 13.163 15.151 ( -6.879 -40.981 27.276) 49.707 15.405 ( 5.827 -41.530 -20.337) 46.608 16.475 ( -8.852 -15.072 19.752) 26.376 16.957 ( 8.834 -16.286 -20.104) 27.339 18.832 ( -0.087 24.765 -1.759) 24.827 18.889 ( 1.620 22.453 0.899) 22.529 19.013 ( -4.958 3.190 -4.357) 7.331 19.340 ( 3.013 5.240 4.679) 7.644 ======================= Grid point 685 (356/366) ======================= q-point: (-0.09 -0.45 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.428 ( -2.686 12.092 7.218) 14.336 0.654 ( 3.830 12.454 -8.511) 15.563 0.987 ( -1.075 -0.575 1.528) 1.955 1.024 ( -0.156 1.686 0.113) 1.697 2.035 ( 0.168 -4.686 -1.585) 4.949 2.214 ( 3.748 -5.276 3.003) 7.134 2.287 ( -7.287 -2.715 -2.577) 8.192 3.224 ( 8.776 -12.433 3.730) 15.669 3.521 ( -5.995 3.821 21.213) 22.373 3.779 ( 7.368 18.671 -24.463) 31.644 4.311 ( -0.428 1.267 -12.163) 12.236 4.531 ( -4.436 -2.902 15.687) 16.558 5.643 ( -5.111 -17.475 10.459) 20.997 5.853 ( 1.189 -13.721 -9.966) 17.001 6.341 ( 0.402 7.129 -0.371) 7.150 6.444 ( -2.341 2.334 8.527) 9.145 7.206 ( 1.186 -8.539 -6.422) 10.750 7.330 ( 0.233 -1.179 1.685) 2.069 7.733 ( -4.645 3.389 15.642) 16.665 8.135 ( 7.781 6.768 -14.275) 17.610 8.741 ( -2.330 20.662 6.862) 21.896 8.992 ( 8.742 28.653 -22.661) 37.563 9.596 ( -7.291 -8.454 8.090) 13.787 10.156 ( 4.820 -12.569 -7.573) 15.446 10.639 ( -4.031 7.700 12.737) 15.420 10.695 ( 3.374 9.403 -11.162) 14.979 12.329 ( -4.351 3.553 3.677) 6.714 12.889 ( 4.962 6.545 -5.833) 10.074 15.880 ( -9.725 -37.880 27.352) 47.724 16.105 ( 5.123 -36.670 -16.499) 40.536 16.697 ( -10.519 -10.116 25.430) 29.320 17.218 ( 6.613 -11.649 -15.385) 20.399 18.330 ( 2.205 29.079 -6.165) 29.807 18.421 ( 3.571 28.663 -6.661) 29.642 18.978 ( -1.662 -0.430 -1.430) 2.234 19.283 ( 1.194 3.655 2.132) 4.397 ======================= Grid point 693 (357/366) ======================= q-point: (-0.36 -0.36 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.911 ( -7.949 0.000 -0.659) 7.976 1.056 ( -0.116 0.000 6.235) 6.236 1.445 ( -2.534 0.000 6.659) 7.125 1.489 ( -0.470 0.000 1.094) 1.190 1.528 ( -1.551 0.000 -3.481) 3.811 1.632 ( 2.403 -0.000 -1.358) 2.760 2.141 ( -5.727 0.000 -11.812) 13.128 2.455 ( 7.042 -0.000 14.538) 16.153 3.841 ( -12.537 0.000 22.280) 25.565 4.072 ( -5.007 0.000 1.550) 5.242 4.162 ( -0.681 0.000 12.751) 12.769 4.427 ( 11.281 -0.000 -21.491) 24.272 5.171 ( -5.506 0.000 -1.836) 5.804 5.588 ( 10.848 -0.000 -7.446) 13.157 5.889 ( 0.101 -0.000 22.341) 22.341 6.074 ( 4.323 -0.000 -18.147) 18.655 7.221 ( -13.531 0.000 8.962) 16.229 7.693 ( 7.189 -0.000 -9.866) 12.207 7.790 ( -12.599 0.000 33.425) 35.721 8.391 ( 10.811 -0.000 -28.701) 30.670 9.129 ( -2.058 0.000 11.506) 11.689 9.244 ( 2.074 -0.000 -12.633) 12.802 10.600 ( -2.022 0.000 15.680) 15.810 10.665 ( 1.116 -0.000 -12.605) 12.654 11.880 ( -12.420 0.000 31.429) 33.795 12.320 ( 4.185 -0.000 -2.703) 4.981 12.651 ( -6.734 0.000 4.997) 8.385 12.776 ( 4.064 -0.000 -10.436) 11.200 13.279 ( 2.595 -0.000 -25.997) 26.126 13.681 ( 15.801 -0.000 -5.488) 16.727 15.854 ( -8.521 0.000 21.648) 23.265 16.292 ( 9.076 -0.000 -23.167) 24.881 19.060 ( -9.695 0.000 -9.724) 13.731 19.350 ( 4.505 -0.000 12.712) 13.487 19.639 ( -2.198 0.000 1.846) 2.871 19.711 ( 0.617 -0.000 2.068) 2.158 ======================= Grid point 694 (358/366) ======================= q-point: (-0.27 -0.36 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.885 ( -6.302 -2.730 0.743) 6.908 1.066 ( -1.074 0.324 6.362) 6.460 1.225 ( -2.812 14.851 7.566) 16.902 1.349 ( 1.530 11.062 -5.493) 12.445 1.675 ( -0.000 -8.090 -2.811) 8.564 1.763 ( 0.522 -9.742 3.374) 10.323 2.111 ( -3.065 -3.001 -10.019) 10.899 2.581 ( 5.305 -5.352 11.958) 14.134 3.783 ( -10.046 2.251 22.176) 24.449 4.157 ( -6.934 -6.356 15.530) 18.156 4.192 ( 2.602 -3.667 -3.481) 5.686 4.455 ( 5.802 -0.417 -18.898) 19.773 5.098 ( -3.792 1.423 0.387) 4.069 5.516 ( 8.015 9.036 -12.851) 17.637 6.090 ( 2.535 -12.039 15.172) 19.533 6.186 ( 5.844 -11.208 -8.322) 15.134 7.138 ( -12.797 1.538 8.912) 15.670 7.608 ( 3.407 9.415 -9.014) 13.472 7.790 ( -11.365 0.999 30.966) 33.001 8.373 ( 10.994 1.716 -28.911) 30.978 9.167 ( -3.723 -3.153 10.781) 11.833 9.339 ( 3.579 -11.088 -10.723) 15.835 10.479 ( -4.487 17.850 18.141) 25.842 10.566 ( 3.278 9.551 -14.164) 17.395 11.399 ( -9.412 31.880 26.648) 42.603 11.850 ( 10.787 40.464 -29.488) 51.217 12.673 ( -8.293 4.073 9.570) 13.302 12.987 ( -2.262 -18.638 7.896) 20.367 13.800 ( 8.424 -38.965 -23.207) 46.128 13.910 ( 7.690 -23.705 -2.168) 25.015 15.949 ( -8.500 -10.159 21.116) 24.926 16.395 ( 9.211 -10.976 -23.065) 27.153 18.981 ( -6.896 -0.032 -6.394) 9.404 19.375 ( 1.894 3.751 11.261) 12.020 19.537 ( -1.654 10.182 1.259) 10.392 19.642 ( 0.931 8.336 2.378) 8.719 ======================= Grid point 695 (359/366) ======================= q-point: (-0.18 -0.36 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.914 ( -3.889 -0.956 2.782) 4.876 0.957 ( -2.088 12.949 7.575) 15.146 1.063 ( -1.350 0.865 4.937) 5.191 1.129 ( 2.388 12.728 -6.929) 14.687 1.800 ( 0.988 -7.076 -3.709) 8.050 1.954 ( 0.560 -9.434 4.032) 10.275 2.146 ( -0.936 -4.414 -6.962) 8.296 2.778 ( 4.578 -10.009 7.337) 13.228 3.735 ( -10.261 4.110 28.238) 30.324 4.209 ( 6.571 1.281 -7.313) 9.914 4.308 ( -6.231 -7.350 8.080) 12.576 4.403 ( 2.984 2.893 -19.195) 19.640 5.129 ( -6.147 -7.024 9.804) 13.536 5.439 ( 5.970 -2.008 -15.897) 17.099 6.301 ( 3.921 -7.990 -4.070) 9.786 6.453 ( 5.772 -8.925 10.882) 15.212 7.064 ( -10.044 -0.540 6.297) 11.867 7.416 ( 1.665 9.088 -9.903) 13.544 7.767 ( -11.047 1.617 30.311) 32.302 8.325 ( 11.183 3.556 -28.105) 30.457 9.245 ( -5.314 -5.271 11.788) 13.963 9.586 ( 4.426 -14.820 -9.853) 18.338 9.974 ( -7.557 35.651 20.329) 41.730 10.235 ( 7.470 27.357 -21.210) 35.412 11.000 ( -6.532 14.464 18.514) 24.385 11.215 ( 8.365 26.279 -23.204) 36.041 12.543 ( -6.349 6.941 10.210) 13.882 13.119 ( 4.051 2.196 -6.407) 7.892 14.452 ( -4.646 -38.127 18.611) 42.680 14.626 ( 8.077 -43.807 -23.809) 50.509 16.187 ( -8.215 -15.580 20.085) 26.714 16.656 ( 9.087 -16.819 -22.381) 29.434 18.941 ( -2.819 -0.463 -3.039) 4.171 19.251 ( 0.549 16.049 4.433) 16.658 19.270 ( -1.605 17.148 1.174) 17.263 19.489 ( 1.161 8.603 4.188) 9.638 ======================= Grid point 696 (360/366) ======================= q-point: (-0.09 -0.36 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.677 ( -2.993 14.822 8.796) 17.493 0.890 ( 3.232 13.386 -8.306) 16.081 0.964 ( -1.069 -1.849 2.036) 2.951 1.049 ( -1.298 1.093 2.488) 3.011 1.927 ( 1.415 -6.886 -3.095) 7.681 2.114 ( -3.100 -7.778 2.281) 8.678 2.213 ( 4.297 -3.326 -1.691) 5.691 3.031 ( 3.436 -13.376 1.642) 13.907 3.637 ( -10.022 6.811 28.751) 31.201 4.080 ( 9.837 14.243 -25.196) 30.569 4.317 ( 4.168 2.760 -17.264) 17.973 4.439 ( -8.068 -7.470 17.591) 20.745 5.326 ( -7.751 -15.928 16.386) 24.131 5.580 ( 4.236 -12.958 -16.711) 21.566 6.413 ( 4.216 -1.668 -1.489) 4.772 6.531 ( -0.105 4.901 11.652) 12.641 7.075 ( -2.843 -4.806 -3.076) 6.375 7.316 ( 0.041 0.382 -4.606) 4.622 7.758 ( -9.281 0.019 25.852) 27.468 8.249 ( 10.345 5.168 -24.505) 27.097 9.218 ( -4.860 24.137 17.031) 29.937 9.432 ( -5.450 5.672 7.395) 10.796 9.619 ( 9.343 31.705 -23.131) 40.343 9.904 ( 2.988 -14.201 -9.642) 17.423 10.799 ( -6.216 9.559 15.090) 18.913 10.885 ( 5.990 12.807 -14.579) 20.309 12.412 ( -2.999 6.436 8.455) 11.041 13.026 ( 3.317 7.253 -8.786) 11.866 15.172 ( -10.314 -40.399 24.524) 48.372 15.389 ( 7.368 -41.530 -19.753) 46.575 16.468 ( -7.949 -14.959 20.458) 26.561 16.964 ( 8.066 -16.402 -20.391) 27.384 18.827 ( 0.499 23.663 -1.297) 23.704 18.909 ( 0.475 24.250 -0.663) 24.264 18.966 ( 0.916 1.767 -0.671) 2.100 19.377 ( -0.786 5.732 3.254) 6.637 ======================= Grid point 705 (361/366) ======================= q-point: (-0.27 -0.27 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.817 ( -5.632 0.000 1.937) 5.956 1.076 ( -2.306 0.000 6.871) 7.248 1.446 ( -2.691 0.000 6.889) 7.397 1.493 ( 0.406 -0.000 0.467) 0.619 1.498 ( 0.039 -0.000 -3.457) 3.458 1.648 ( 1.011 -0.000 -1.193) 1.564 2.054 ( 1.473 -0.000 -9.949) 10.057 2.586 ( 1.567 -0.000 11.826) 11.930 3.800 ( -11.100 0.000 22.766) 25.328 4.024 ( -3.130 0.000 1.198) 3.352 4.202 ( -3.041 0.000 11.828) 12.213 4.456 ( 9.956 -0.000 -22.028) 24.173 5.115 ( -1.701 0.000 -0.469) 1.764 5.657 ( 7.130 -0.000 -12.122) 14.064 6.028 ( 1.843 -0.000 23.049) 23.122 6.049 ( 5.119 -0.000 -15.345) 16.177 7.088 ( -13.182 0.000 10.308) 16.734 7.711 ( 3.531 -0.000 -10.844) 11.404 7.794 ( -12.693 0.000 32.724) 35.099 8.385 ( 10.995 -0.000 -28.936) 30.955 9.152 ( -3.486 0.000 11.320) 11.845 9.216 ( 3.553 -0.000 -11.930) 12.448 10.634 ( 4.152 -0.000 -12.192) 12.880 10.639 ( -4.618 0.000 15.665) 16.332 11.876 ( -12.985 0.000 31.928) 34.467 12.358 ( 5.419 -0.000 -7.413) 9.182 12.605 ( -4.666 0.000 7.547) 8.873 12.765 ( 1.573 -0.000 -8.115) 8.266 13.213 ( 8.777 -0.000 -28.121) 29.459 13.808 ( 8.010 -0.000 -9.055) 12.089 15.853 ( -8.612 0.000 21.727) 23.371 16.292 ( 9.070 -0.000 -23.199) 24.909 18.928 ( -3.882 0.000 -4.012) 5.583 19.444 ( -0.864 0.000 12.208) 12.238 19.626 ( -0.638 0.000 1.277) 1.428 19.729 ( 0.328 -0.000 2.227) 2.251 ======================= Grid point 706 (362/366) ======================= q-point: (-0.18 -0.27 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.833 ( -2.242 -3.753 2.609) 5.091 1.071 ( -3.238 0.287 6.248) 7.043 1.231 ( -2.181 14.718 7.350) 16.595 1.343 ( 1.957 10.794 -5.319) 12.191 1.670 ( 1.494 -7.925 -2.890) 8.567 1.771 ( -1.966 -10.158 3.151) 10.815 2.078 ( 5.163 -2.804 -7.786) 9.754 2.666 ( -0.807 -5.794 8.089) 9.982 3.775 ( -8.875 0.773 23.110) 24.768 4.117 ( -5.049 -9.501 5.311) 11.999 4.227 ( -0.899 -1.574 7.060) 7.290 4.437 ( 7.521 2.642 -21.003) 22.465 5.070 ( -1.325 1.862 2.296) 3.239 5.533 ( 5.335 9.880 -14.410) 18.268 6.152 ( 4.535 -9.426 -5.315) 11.733 6.278 ( 3.611 -15.554 12.024) 19.989 7.019 ( -11.806 1.324 11.008) 16.197 7.587 ( 0.746 10.250 -9.384) 13.917 7.797 ( -11.363 0.699 29.781) 31.883 8.370 ( 11.276 1.518 -28.933) 31.090 9.170 ( -4.094 -2.468 10.305) 11.360 9.334 ( 3.732 -11.731 -10.031) 15.879 10.497 ( -7.001 18.205 17.691) 26.333 10.557 ( 6.303 9.640 -13.569) 17.798 11.403 ( -10.910 31.517 26.446) 42.565 11.847 ( 11.939 41.118 -29.893) 52.219 12.645 ( -3.700 4.317 10.788) 12.195 12.990 ( -3.564 -19.462 8.159) 21.402 13.792 ( 11.853 -43.161 -29.294) 53.494 13.953 ( -1.592 -19.087 -0.408) 19.158 15.947 ( -8.458 -10.057 21.312) 25.038 16.396 ( 9.066 -11.118 -23.172) 27.253 18.914 ( 0.458 -0.581 -1.383) 1.568 19.420 ( -3.655 4.519 9.171) 10.858 19.535 ( 0.468 10.376 1.735) 10.530 19.663 ( 0.188 7.771 2.221) 8.084 ======================= Grid point 707 (363/366) ======================= q-point: (-0.09 -0.27 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.897 ( -1.083 -0.568 3.586) 3.788 0.972 ( -1.463 12.287 7.203) 14.317 1.057 ( -3.122 0.534 4.100) 5.181 1.128 ( 2.823 12.843 -6.832) 14.819 1.805 ( 2.470 -7.049 -3.439) 8.223 1.937 ( -4.514 -9.177 2.269) 10.476 2.181 ( 8.915 -4.751 -2.886) 10.506 2.821 ( -2.202 -10.705 2.107) 11.131 3.750 ( -9.745 3.854 28.535) 30.399 4.243 ( 6.443 0.697 -18.297) 19.411 4.267 ( -7.625 -6.265 17.186) 19.818 4.375 ( 7.197 3.044 -17.349) 19.028 5.100 ( -6.188 -6.721 10.975) 14.281 5.428 ( 5.043 -1.041 -16.391) 17.181 6.344 ( 5.183 -8.521 -2.525) 10.288 6.575 ( 3.382 -7.967 9.963) 13.197 6.960 ( -10.323 -1.631 7.959) 13.137 7.376 ( 0.625 8.849 -10.885) 14.042 7.777 ( -11.004 1.439 29.469) 31.489 8.330 ( 11.527 3.235 -28.093) 30.538 9.245 ( -4.196 -5.604 12.284) 14.139 9.582 ( 2.775 -14.726 -10.176) 18.114 9.969 ( -8.835 36.029 19.929) 42.111 10.238 ( 9.506 28.093 -20.886) 36.275 10.994 ( -8.697 14.343 18.121) 24.693 11.218 ( 10.137 26.125 -22.948) 36.220 12.550 ( -1.184 7.036 11.390) 13.440 13.116 ( 0.913 2.159 -7.459) 7.819 14.444 ( -10.980 -37.937 17.807) 43.323 14.619 ( 9.915 -44.141 -24.303) 51.356 16.186 ( -7.785 -15.640 20.476) 26.917 16.657 ( 8.611 -16.854 -22.655) 29.521 18.940 ( 3.620 -0.378 0.223) 3.647 19.253 ( -2.199 14.839 1.467) 15.072 19.280 ( 0.849 18.239 3.583) 18.607 19.501 ( -1.978 8.910 2.662) 9.507 ======================= Grid point 717 (364/366) ======================= q-point: (-0.18 -0.18 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.798 ( 1.017 -0.000 3.219) 3.376 1.063 ( -4.466 0.000 5.774) 7.300 1.445 ( -2.629 0.000 6.611) 7.115 1.496 ( 1.822 -0.000 -1.906) 2.637 1.503 ( 0.897 -0.000 -0.136) 0.908 1.647 ( 0.016 -0.000 -1.808) 1.808 2.077 ( 8.635 -0.000 -7.537) 11.461 2.612 ( -5.267 0.000 7.123) 8.859 3.784 ( -9.191 0.000 22.606) 24.403 4.004 ( -0.931 0.000 1.553) 1.811 4.206 ( -5.688 0.000 12.217) 13.476 4.465 ( 9.181 -0.000 -22.687) 24.474 5.122 ( 1.820 -0.000 2.522) 3.111 5.658 ( 3.507 -0.000 -14.227) 14.653 6.052 ( 6.083 -0.000 -11.831) 13.303 6.144 ( -1.835 0.000 17.641) 17.736 6.999 ( -8.739 0.000 14.567) 16.988 7.675 ( 0.217 -0.000 -12.077) 12.079 7.793 ( -12.891 0.000 32.198) 34.683 8.382 ( 11.181 -0.000 -28.914) 31.001 9.153 ( -5.087 0.000 10.691) 11.839 9.216 ( 5.466 -0.000 -11.211) 12.473 10.638 ( -7.510 0.000 15.236) 16.986 10.649 ( 7.444 -0.000 -11.959) 14.087 11.867 ( -13.511 0.000 32.491) 35.189 12.386 ( 5.603 -0.000 -10.419) 11.830 12.609 ( -0.840 0.000 7.625) 7.672 12.733 ( -0.640 0.000 -6.265) 6.297 13.220 ( 13.827 -0.000 -26.779) 30.138 13.790 ( -2.476 0.000 -11.769) 12.027 15.852 ( -8.704 0.000 21.883) 23.550 16.291 ( 9.074 -0.000 -23.234) 24.943 18.926 ( 5.000 -0.000 0.413) 5.017 19.445 ( -6.752 0.000 8.257) 10.666 19.641 ( 0.985 -0.000 3.081) 3.234 19.743 ( 0.121 -0.000 1.697) 1.701 ======================= Grid point 718 (365/366) ======================= q-point: (-0.09 -0.18 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.855 ( 3.024 -3.061 2.724) 5.093 1.045 ( -4.725 -0.013 4.475) 6.508 1.241 ( -2.024 14.478 7.156) 16.276 1.347 ( 2.439 10.967 -4.840) 12.233 1.684 ( 2.538 -8.091 -2.321) 8.791 1.750 ( -2.887 -8.991 2.022) 9.657 2.159 ( 11.419 -3.511 -4.926) 12.922 2.639 ( -7.456 -6.318 2.938) 10.205 3.785 ( -8.015 -0.156 23.752) 25.068 4.089 ( -2.574 -7.726 3.556) 8.886 4.231 ( -4.865 -3.295 9.332) 11.027 4.441 ( 9.881 2.669 -21.841) 24.120 5.086 ( 0.721 4.087 4.974) 6.478 5.510 ( 2.894 9.592 -15.146) 18.160 6.189 ( 5.486 -10.494 -5.360) 12.998 6.341 ( -3.490 -16.426 8.642) 18.886 6.967 ( -5.879 2.970 16.401) 17.675 7.534 ( -0.758 9.862 -10.706) 14.576 7.797 ( -11.842 0.218 29.515) 31.803 8.371 ( 11.525 1.207 -28.843) 31.083 9.165 ( -4.773 -2.939 10.484) 11.888 9.334 ( 4.453 -10.773 -10.386) 15.613 10.479 ( -9.173 17.932 17.020) 26.370 10.590 ( 9.016 10.103 -13.412) 19.059 11.385 ( -12.274 31.908 26.468) 43.235 11.856 ( 12.945 41.189 -30.104) 52.634 12.685 ( 0.869 3.891 11.194) 11.883 12.977 ( -4.453 -19.411 7.474) 21.272 13.816 ( 13.595 -41.624 -27.377) 51.642 13.861 ( -10.646 -21.038 -1.389) 23.619 15.946 ( -8.386 -10.197 21.536) 25.260 16.395 ( 8.934 -11.015 -23.275) 27.256 18.977 ( 8.356 -0.062 1.338) 8.463 19.379 ( -7.545 3.932 5.106) 9.922 19.562 ( 0.952 10.415 3.730) 11.104 19.670 ( -0.435 8.275 1.140) 8.364 ======================= Grid point 729 (366/366) ======================= q-point: (-0.09 -0.09 0.45) 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 2.00e-05 2.00e-05 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.865 ( 6.017 -0.000 2.229) 6.416 1.020 ( -5.470 0.000 3.557) 6.525 1.445 ( -2.626 0.000 6.585) 7.089 1.512 ( 0.501 -0.000 -0.392) 0.636 1.523 ( 2.832 -0.000 -0.378) 2.857 1.632 ( -0.190 0.000 -2.986) 2.992 2.198 ( 14.048 -0.000 -5.378) 15.042 2.523 ( -11.169 0.000 2.276) 11.398 3.790 ( -7.256 0.000 21.736) 22.915 4.011 ( 0.654 -0.000 1.521) 1.655 4.179 ( -8.263 0.000 13.501) 15.829 4.469 ( 9.188 -0.000 -22.527) 24.329 5.181 ( 3.402 -0.000 5.682) 6.622 5.606 ( 0.429 -0.000 -15.244) 15.250 6.091 ( 7.434 -0.000 -7.977) 10.904 6.145 ( -9.066 0.000 11.218) 14.424 7.023 ( -1.346 0.000 19.396) 19.442 7.595 ( -1.852 0.000 -13.672) 13.797 7.787 ( -13.084 0.000 31.987) 34.560 8.381 ( 11.208 -0.000 -28.601) 30.719 9.129 ( -6.311 0.000 9.804) 11.660 9.244 ( 7.130 -0.000 -10.733) 12.885 10.600 ( -9.723 0.000 14.449) 17.416 10.704 ( 9.973 -0.000 -11.961) 15.573 11.856 ( -13.631 0.000 32.994) 35.699 12.398 ( 4.439 -0.000 -10.621) 11.511 12.657 ( 2.785 -0.000 5.209) 5.907 12.685 ( -1.868 0.000 -5.538) 5.844 13.300 ( 17.010 -0.000 -22.207) 27.973 13.634 ( -10.336 0.000 -12.116) 15.926 15.850 ( -8.712 0.000 22.025) 23.686 16.291 ( 9.090 -0.000 -23.261) 24.974 19.051 ( 11.996 -0.000 1.605) 12.103 19.362 ( -10.134 0.000 4.221) 10.978 19.672 ( 0.490 -0.000 4.387) 4.415 19.750 ( 0.216 -0.000 0.469) 0.517 =================== 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 3/47916 10.0 11.122 19.858 20.578 0.000 0.681 -0.000 3/47916 20.0 4.736 9.132 8.769 0.000 -0.202 -0.000 3/47916 30.0 3.171 6.180 5.942 0.000 -0.277 -0.000 3/47916 40.0 2.514 5.136 5.035 0.000 -0.426 -0.000 3/47916 50.0 2.154 4.673 4.676 0.000 -0.567 -0.000 3/47916 60.0 1.924 4.422 4.502 0.000 -0.680 -0.000 3/47916 70.0 1.765 4.275 4.411 0.000 -0.772 -0.000 3/47916 80.0 1.651 4.191 4.362 0.000 -0.850 -0.000 3/47916 90.0 1.566 4.144 4.334 0.000 -0.915 -0.000 3/47916 100.0 1.501 4.113 4.310 0.000 -0.968 -0.000 3/47916 110.0 1.447 4.088 4.283 0.000 -1.008 -0.000 3/47916 120.0 1.401 4.060 4.248 0.000 -1.037 -0.000 3/47916 130.0 1.360 4.025 4.202 0.000 -1.056 -0.000 3/47916 140.0 1.322 3.983 4.148 0.000 -1.067 -0.000 3/47916 150.0 1.287 3.932 4.085 0.000 -1.070 -0.000 3/47916 160.0 1.253 3.876 4.015 0.000 -1.068 -0.000 3/47916 170.0 1.221 3.813 3.940 0.000 -1.061 -0.000 3/47916 180.0 1.190 3.746 3.862 0.000 -1.050 -0.000 3/47916 190.0 1.160 3.676 3.781 0.000 -1.036 -0.000 3/47916 200.0 1.132 3.604 3.699 0.000 -1.021 -0.000 3/47916 210.0 1.104 3.531 3.617 0.000 -1.004 -0.000 3/47916 220.0 1.077 3.457 3.535 0.000 -0.986 -0.000 3/47916 230.0 1.051 3.383 3.454 0.000 -0.967 -0.000 3/47916 240.0 1.026 3.310 3.374 0.000 -0.948 -0.000 3/47916 250.0 1.001 3.237 3.296 0.000 -0.928 -0.000 3/47916 260.0 0.978 3.166 3.220 0.000 -0.909 -0.000 3/47916 270.0 0.955 3.097 3.145 0.000 -0.890 -0.000 3/47916 280.0 0.933 3.029 3.073 0.000 -0.871 -0.000 3/47916 290.0 0.912 2.963 3.003 0.000 -0.853 -0.000 3/47916 300.0 0.892 2.898 2.935 0.000 -0.834 -0.000 3/47916 310.0 0.872 2.835 2.869 0.000 -0.817 -0.000 3/47916 320.0 0.853 2.775 2.806 0.000 -0.799 -0.000 3/47916 330.0 0.834 2.716 2.744 0.000 -0.783 -0.000 3/47916 340.0 0.817 2.658 2.685 0.000 -0.766 -0.000 3/47916 350.0 0.799 2.603 2.627 0.000 -0.750 -0.000 3/47916 360.0 0.783 2.550 2.572 0.000 -0.735 -0.000 3/47916 370.0 0.767 2.498 2.518 0.000 -0.720 -0.000 3/47916 380.0 0.752 2.448 2.466 0.000 -0.706 -0.000 3/47916 390.0 0.737 2.399 2.416 0.000 -0.692 -0.000 3/47916 400.0 0.722 2.352 2.368 0.000 -0.678 -0.000 3/47916 410.0 0.708 2.307 2.321 0.000 -0.665 -0.000 3/47916 420.0 0.695 2.263 2.276 0.000 -0.652 -0.000 3/47916 430.0 0.682 2.220 2.233 0.000 -0.640 -0.000 3/47916 440.0 0.669 2.179 2.191 0.000 -0.628 -0.000 3/47916 450.0 0.657 2.139 2.150 0.000 -0.617 -0.000 3/47916 460.0 0.645 2.101 2.111 0.000 -0.605 -0.000 3/47916 470.0 0.634 2.063 2.073 0.000 -0.595 -0.000 3/47916 480.0 0.623 2.027 2.036 0.000 -0.584 -0.000 3/47916 490.0 0.612 1.992 2.000 0.000 -0.574 -0.000 3/47916 500.0 0.602 1.958 1.965 0.000 -0.564 -0.000 3/47916 510.0 0.592 1.925 1.932 0.000 -0.555 -0.000 3/47916 520.0 0.582 1.893 1.900 0.000 -0.545 -0.000 3/47916 530.0 0.572 1.862 1.868 0.000 -0.536 -0.000 3/47916 540.0 0.563 1.832 1.838 0.000 -0.528 -0.000 3/47916 550.0 0.554 1.803 1.808 0.000 -0.519 -0.000 3/47916 560.0 0.546 1.775 1.779 0.000 -0.511 -0.000 3/47916 570.0 0.537 1.747 1.751 0.000 -0.503 -0.000 3/47916 580.0 0.529 1.720 1.724 0.000 -0.495 -0.000 3/47916 590.0 0.521 1.694 1.698 0.000 -0.488 -0.000 3/47916 600.0 0.513 1.669 1.672 0.000 -0.480 -0.000 3/47916 610.0 0.506 1.644 1.648 0.000 -0.473 -0.000 3/47916 620.0 0.499 1.621 1.623 0.000 -0.466 -0.000 3/47916 630.0 0.491 1.597 1.600 0.000 -0.460 -0.000 3/47916 640.0 0.485 1.575 1.577 0.000 -0.453 -0.000 3/47916 650.0 0.478 1.553 1.555 0.000 -0.447 -0.000 3/47916 660.0 0.471 1.531 1.533 0.000 -0.441 -0.000 3/47916 670.0 0.465 1.510 1.512 0.000 -0.434 -0.000 3/47916 680.0 0.459 1.490 1.492 0.000 -0.429 -0.000 3/47916 690.0 0.453 1.470 1.472 0.000 -0.423 -0.000 3/47916 700.0 0.447 1.451 1.452 0.000 -0.417 -0.000 3/47916 710.0 0.441 1.432 1.433 0.000 -0.412 -0.000 3/47916 720.0 0.435 1.413 1.415 0.000 -0.407 -0.000 3/47916 730.0 0.430 1.396 1.397 0.000 -0.401 -0.000 3/47916 740.0 0.424 1.378 1.379 0.000 -0.396 -0.000 3/47916 750.0 0.419 1.361 1.362 0.000 -0.391 -0.000 3/47916 760.0 0.414 1.344 1.345 0.000 -0.387 -0.000 3/47916 770.0 0.409 1.328 1.329 0.000 -0.382 -0.000 3/47916 780.0 0.404 1.312 1.313 0.000 -0.377 -0.000 3/47916 790.0 0.399 1.296 1.297 0.000 -0.373 -0.000 3/47916 800.0 0.395 1.281 1.282 0.000 -0.368 -0.000 3/47916 810.0 0.390 1.266 1.267 0.000 -0.364 -0.000 3/47916 820.0 0.386 1.252 1.252 0.000 -0.360 -0.000 3/47916 830.0 0.381 1.238 1.238 0.000 -0.356 -0.000 3/47916 840.0 0.377 1.224 1.224 0.000 -0.352 -0.000 3/47916 850.0 0.373 1.210 1.210 0.000 -0.348 -0.000 3/47916 860.0 0.369 1.197 1.197 0.000 -0.344 -0.000 3/47916 870.0 0.365 1.184 1.184 0.000 -0.340 -0.000 3/47916 880.0 0.361 1.171 1.171 0.000 -0.337 -0.000 3/47916 890.0 0.357 1.158 1.158 0.000 -0.333 -0.000 3/47916 900.0 0.353 1.146 1.146 0.000 -0.329 -0.000 3/47916 910.0 0.350 1.134 1.134 0.000 -0.326 -0.000 3/47916 920.0 0.346 1.122 1.122 0.000 -0.323 -0.000 3/47916 930.0 0.342 1.111 1.111 0.000 -0.319 -0.000 3/47916 940.0 0.339 1.100 1.099 0.000 -0.316 -0.000 3/47916 950.0 0.336 1.089 1.088 0.000 -0.313 -0.000 3/47916 960.0 0.332 1.078 1.077 0.000 -0.310 -0.000 3/47916 970.0 0.329 1.067 1.067 0.000 -0.307 -0.000 3/47916 980.0 0.326 1.057 1.056 0.000 -0.304 -0.000 3/47916 990.0 0.323 1.046 1.046 0.000 -0.301 -0.000 3/47916 1000.0 0.320 1.036 1.036 0.000 -0.298 -0.000 3/47916 Thermal conductivity related properties were written into "kappa-m111111.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 19:48:54]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|