----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 04:41:49]------------------------- 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 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) Number of symmetry operations in supercell: 24 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.036887735203868 -2.025460795000000 0.000000000000000 b 7.036887735203868 2.025460795000000 0.000000000000000 c -5.294578348431755 0.000000000000000 15.287417357954082 Atomic positions (fractional): *1 K 0.03300834841372 0.03300834841372 0.27058704213729 39.098 2 K 0.96699165158628 0.96699165158628 0.72941295786271 39.098 *3 Dy 0.23092777757635 0.23092777757635 0.10253054838822 162.500 *4 Dy 0.34515267478957 0.34515267478957 0.44362286267910 162.500 5 Dy 0.65484732521043 0.65484732521043 0.55637713732090 162.500 6 Dy 0.76907222242365 0.76907222242365 0.89746945161178 162.500 *7 Cu 0.42293975628293 0.42293975628293 0.02769778953578 63.546 *8 Cu 0.75850477624950 0.75850477624950 0.26933979072310 63.546 9 Cu 0.24149522375050 0.24149522375050 0.73066020927690 63.546 10 Cu 0.57706024371707 0.57706024371707 0.97230221046422 63.546 *11 Se 0.86562839795326 0.86562839795326 0.07891319583450 78.960 *12 Se 0.60503945847814 0.60503945847814 0.13034897134519 78.960 *13 Se 0.35572687099426 0.35572687099425 0.27636718085851 78.960 *14 Se 0.69860336804104 0.69860336804104 0.39502288066101 78.960 *15 Se 0.00000000000000 0.00000000000000 0.50000000000000 78.960 16 Se 0.30139663195896 0.30139663195896 0.60497711933899 78.960 17 Se 0.64427312900575 0.64427312900574 0.72363281914149 78.960 18 Se 0.39496054152186 0.39496054152186 0.86965102865481 78.960 19 Se 0.13437160204674 0.13437160204674 0.92108680416550 78.960 -------------------------------- unit cell --------------------------------- Lattice vectors: a 14.073775470407735 0.000000000000000 0.000000000000000 b 0.000000000000000 4.050921590000000 0.000000000000000 c -5.294578348431755 0.000000000000000 15.287417357954082 Atomic positions (fractional): *1 K 0.03300834841372 0.00000000000000 0.27058704213729 39.098 > 1 2 K 0.96699165158628 0.00000000000000 0.72941295786271 39.098 > 2 3 K 0.53300834841372 0.50000000000000 0.27058704213729 39.098 > 1 4 K 0.46699165158628 0.50000000000000 0.72941295786271 39.098 > 2 *5 Dy 0.73092777757635 0.50000000000000 0.10253054838822 162.500 > 3 *6 Dy 0.84515267478957 0.50000000000000 0.44362286267910 162.500 > 4 7 Dy 0.15484732521043 0.50000000000000 0.55637713732090 162.500 > 5 8 Dy 0.26907222242365 0.50000000000000 0.89746945161178 162.500 > 6 9 Dy 0.23092777757635 0.00000000000000 0.10253054838822 162.500 > 3 10 Dy 0.34515267478957 0.00000000000000 0.44362286267910 162.500 > 4 11 Dy 0.65484732521043 0.00000000000000 0.55637713732090 162.500 > 5 12 Dy 0.76907222242365 0.00000000000000 0.89746945161178 162.500 > 6 *13 Cu 0.92293975628293 0.50000000000000 0.02769778953578 63.546 > 7 *14 Cu 0.75850477624950 0.00000000000000 0.26933979072310 63.546 > 8 15 Cu 0.24149522375050 0.00000000000000 0.73066020927690 63.546 > 9 16 Cu 0.07706024371707 0.50000000000000 0.97230221046422 63.546 > 10 17 Cu 0.42293975628293 0.00000000000000 0.02769778953578 63.546 > 7 18 Cu 0.25850477624950 0.50000000000000 0.26933979072310 63.546 > 8 19 Cu 0.74149522375050 0.50000000000000 0.73066020927690 63.546 > 9 20 Cu 0.57706024371707 0.00000000000000 0.97230221046422 63.546 > 10 *21 Se 0.86562839795326 0.00000000000000 0.07891319583450 78.960 > 11 *22 Se 0.60503945847814 0.00000000000000 0.13034897134519 78.960 > 12 *23 Se 0.85572687099426 0.50000000000000 0.27636718085851 78.960 > 13 *24 Se 0.69860336804104 0.00000000000000 0.39502288066101 78.960 > 14 *25 Se 0.00000000000000 0.00000000000000 0.50000000000000 78.960 > 15 26 Se 0.30139663195896 0.00000000000000 0.60497711933899 78.960 > 16 27 Se 0.14427312900574 0.50000000000000 0.72363281914149 78.960 > 17 28 Se 0.39496054152186 0.00000000000000 0.86965102865481 78.960 > 18 29 Se 0.13437160204674 0.00000000000000 0.92108680416550 78.960 > 19 30 Se 0.36562839795326 0.50000000000000 0.07891319583450 78.960 > 11 31 Se 0.10503945847814 0.50000000000000 0.13034897134519 78.960 > 12 32 Se 0.35572687099425 0.00000000000000 0.27636718085851 78.960 > 13 33 Se 0.19860336804104 0.50000000000000 0.39502288066101 78.960 > 14 34 Se 0.50000000000000 0.50000000000000 0.50000000000000 78.960 > 15 35 Se 0.80139663195896 0.50000000000000 0.60497711933899 78.960 > 16 36 Se 0.64427312900574 0.00000000000000 0.72363281914149 78.960 > 17 37 Se 0.89496054152186 0.50000000000000 0.86965102865481 78.960 > 18 38 Se 0.63437160204674 0.50000000000000 0.92108680416550 78.960 > 19 -------------------------------- super cell -------------------------------- Lattice vectors: a 14.073775470407735 0.000000000000000 0.000000000000000 b 0.000000000000000 12.152764769999999 0.000000000000000 c -5.294578348431755 0.000000000000000 15.287417357954082 Atomic positions (fractional): *1 K 0.03300834841372 0.00000000000000 0.27058704213729 39.098 > 1 2 K 0.03300834841372 0.33333333333333 0.27058704213729 39.098 > 1 3 K 0.03300834841372 0.66666666666667 0.27058704213729 39.098 > 1 4 K 0.96699165158628 0.00000000000000 0.72941295786271 39.098 > 2 5 K 0.96699165158628 0.33333333333333 0.72941295786271 39.098 > 2 6 K 0.96699165158628 0.66666666666667 0.72941295786271 39.098 > 2 7 K 0.53300834841372 0.16666666666667 0.27058704213729 39.098 > 1 8 K 0.53300834841372 0.50000000000000 0.27058704213729 39.098 > 1 9 K 0.53300834841372 0.83333333333333 0.27058704213729 39.098 > 1 10 K 0.46699165158628 0.16666666666667 0.72941295786271 39.098 > 2 11 K 0.46699165158628 0.50000000000000 0.72941295786271 39.098 > 2 12 K 0.46699165158628 0.83333333333333 0.72941295786271 39.098 > 2 *13 Dy 0.73092777757635 0.16666666666667 0.10253054838822 162.500 > 3 14 Dy 0.73092777757635 0.50000000000000 0.10253054838822 162.500 > 3 15 Dy 0.73092777757635 0.83333333333333 0.10253054838822 162.500 > 3 *16 Dy 0.84515267478957 0.16666666666667 0.44362286267910 162.500 > 4 17 Dy 0.84515267478957 0.50000000000000 0.44362286267910 162.500 > 4 18 Dy 0.84515267478957 0.83333333333333 0.44362286267910 162.500 > 4 19 Dy 0.15484732521043 0.16666666666667 0.55637713732090 162.500 > 5 20 Dy 0.15484732521043 0.50000000000000 0.55637713732090 162.500 > 5 21 Dy 0.15484732521043 0.83333333333333 0.55637713732090 162.500 > 5 22 Dy 0.26907222242365 0.16666666666667 0.89746945161178 162.500 > 6 23 Dy 0.26907222242365 0.50000000000000 0.89746945161178 162.500 > 6 24 Dy 0.26907222242365 0.83333333333333 0.89746945161178 162.500 > 6 25 Dy 0.23092777757635 0.00000000000000 0.10253054838822 162.500 > 3 26 Dy 0.23092777757635 0.33333333333333 0.10253054838822 162.500 > 3 27 Dy 0.23092777757635 0.66666666666667 0.10253054838822 162.500 > 3 28 Dy 0.34515267478957 0.00000000000000 0.44362286267910 162.500 > 4 29 Dy 0.34515267478957 0.33333333333333 0.44362286267910 162.500 > 4 30 Dy 0.34515267478957 0.66666666666667 0.44362286267910 162.500 > 4 31 Dy 0.65484732521043 0.00000000000000 0.55637713732090 162.500 > 5 32 Dy 0.65484732521043 0.33333333333333 0.55637713732090 162.500 > 5 33 Dy 0.65484732521043 0.66666666666667 0.55637713732090 162.500 > 5 34 Dy 0.76907222242365 0.00000000000000 0.89746945161178 162.500 > 6 35 Dy 0.76907222242365 0.33333333333333 0.89746945161178 162.500 > 6 36 Dy 0.76907222242365 0.66666666666667 0.89746945161178 162.500 > 6 *37 Cu 0.92293975628293 0.16666666666667 0.02769778953578 63.546 > 7 38 Cu 0.92293975628293 0.50000000000000 0.02769778953578 63.546 > 7 39 Cu 0.92293975628293 0.83333333333333 0.02769778953578 63.546 > 7 *40 Cu 0.75850477624950 0.00000000000000 0.26933979072310 63.546 > 8 41 Cu 0.75850477624950 0.33333333333333 0.26933979072310 63.546 > 8 42 Cu 0.75850477624950 0.66666666666667 0.26933979072310 63.546 > 8 43 Cu 0.24149522375050 0.00000000000000 0.73066020927690 63.546 > 9 44 Cu 0.24149522375050 0.33333333333333 0.73066020927690 63.546 > 9 45 Cu 0.24149522375050 0.66666666666667 0.73066020927690 63.546 > 9 46 Cu 0.07706024371707 0.16666666666667 0.97230221046422 63.546 > 10 47 Cu 0.07706024371707 0.50000000000000 0.97230221046422 63.546 > 10 48 Cu 0.07706024371707 0.83333333333333 0.97230221046422 63.546 > 10 49 Cu 0.42293975628293 0.00000000000000 0.02769778953578 63.546 > 7 50 Cu 0.42293975628293 0.33333333333333 0.02769778953578 63.546 > 7 51 Cu 0.42293975628293 0.66666666666667 0.02769778953578 63.546 > 7 52 Cu 0.25850477624950 0.16666666666667 0.26933979072310 63.546 > 8 53 Cu 0.25850477624950 0.50000000000000 0.26933979072310 63.546 > 8 54 Cu 0.25850477624950 0.83333333333333 0.26933979072310 63.546 > 8 55 Cu 0.74149522375050 0.16666666666667 0.73066020927690 63.546 > 9 56 Cu 0.74149522375050 0.50000000000000 0.73066020927690 63.546 > 9 57 Cu 0.74149522375050 0.83333333333333 0.73066020927690 63.546 > 9 58 Cu 0.57706024371707 0.00000000000000 0.97230221046422 63.546 > 10 59 Cu 0.57706024371707 0.33333333333333 0.97230221046422 63.546 > 10 60 Cu 0.57706024371707 0.66666666666667 0.97230221046422 63.546 > 10 *61 Se 0.86562839795326 0.00000000000000 0.07891319583450 78.960 > 11 62 Se 0.86562839795326 0.33333333333333 0.07891319583450 78.960 > 11 63 Se 0.86562839795326 0.66666666666667 0.07891319583450 78.960 > 11 *64 Se 0.60503945847814 0.00000000000000 0.13034897134519 78.960 > 12 65 Se 0.60503945847814 0.33333333333333 0.13034897134519 78.960 > 12 66 Se 0.60503945847814 0.66666666666667 0.13034897134519 78.960 > 12 *67 Se 0.85572687099426 0.16666666666667 0.27636718085851 78.960 > 13 68 Se 0.85572687099426 0.50000000000000 0.27636718085851 78.960 > 13 69 Se 0.85572687099426 0.83333333333333 0.27636718085851 78.960 > 13 *70 Se 0.69860336804104 0.00000000000000 0.39502288066101 78.960 > 14 71 Se 0.69860336804104 0.33333333333333 0.39502288066101 78.960 > 14 72 Se 0.69860336804104 0.66666666666667 0.39502288066101 78.960 > 14 *73 Se 0.00000000000000 0.00000000000000 0.50000000000000 78.960 > 15 74 Se 0.00000000000000 0.33333333333333 0.50000000000000 78.960 > 15 75 Se 0.00000000000000 0.66666666666667 0.50000000000000 78.960 > 15 76 Se 0.30139663195896 0.00000000000000 0.60497711933899 78.960 > 16 77 Se 0.30139663195896 0.33333333333333 0.60497711933899 78.960 > 16 78 Se 0.30139663195896 0.66666666666667 0.60497711933899 78.960 > 16 79 Se 0.14427312900574 0.16666666666667 0.72363281914149 78.960 > 17 80 Se 0.14427312900574 0.50000000000000 0.72363281914149 78.960 > 17 81 Se 0.14427312900574 0.83333333333333 0.72363281914149 78.960 > 17 82 Se 0.39496054152186 0.00000000000000 0.86965102865481 78.960 > 18 83 Se 0.39496054152186 0.33333333333333 0.86965102865481 78.960 > 18 84 Se 0.39496054152186 0.66666666666667 0.86965102865481 78.960 > 18 85 Se 0.13437160204674 0.00000000000000 0.92108680416550 78.960 > 19 86 Se 0.13437160204674 0.33333333333333 0.92108680416550 78.960 > 19 87 Se 0.13437160204674 0.66666666666667 0.92108680416550 78.960 > 19 88 Se 0.36562839795326 0.16666666666667 0.07891319583450 78.960 > 11 89 Se 0.36562839795326 0.50000000000000 0.07891319583450 78.960 > 11 90 Se 0.36562839795326 0.83333333333333 0.07891319583450 78.960 > 11 91 Se 0.10503945847814 0.16666666666667 0.13034897134519 78.960 > 12 92 Se 0.10503945847814 0.50000000000000 0.13034897134519 78.960 > 12 93 Se 0.10503945847814 0.83333333333333 0.13034897134519 78.960 > 12 94 Se 0.35572687099425 0.00000000000000 0.27636718085851 78.960 > 13 95 Se 0.35572687099425 0.33333333333333 0.27636718085851 78.960 > 13 96 Se 0.35572687099425 0.66666666666667 0.27636718085851 78.960 > 13 97 Se 0.19860336804104 0.16666666666667 0.39502288066101 78.960 > 14 98 Se 0.19860336804104 0.50000000000000 0.39502288066101 78.960 > 14 99 Se 0.19860336804104 0.83333333333333 0.39502288066101 78.960 > 14 100 Se 0.50000000000000 0.16666666666667 0.50000000000000 78.960 > 15 101 Se 0.50000000000000 0.50000000000000 0.50000000000000 78.960 > 15 102 Se 0.50000000000000 0.83333333333333 0.50000000000000 78.960 > 15 103 Se 0.80139663195896 0.16666666666667 0.60497711933899 78.960 > 16 104 Se 0.80139663195896 0.50000000000000 0.60497711933899 78.960 > 16 105 Se 0.80139663195896 0.83333333333333 0.60497711933899 78.960 > 16 106 Se 0.64427312900574 0.00000000000000 0.72363281914149 78.960 > 17 107 Se 0.64427312900574 0.33333333333333 0.72363281914149 78.960 > 17 108 Se 0.64427312900574 0.66666666666667 0.72363281914149 78.960 > 17 109 Se 0.89496054152186 0.16666666666667 0.86965102865481 78.960 > 18 110 Se 0.89496054152186 0.50000000000000 0.86965102865481 78.960 > 18 111 Se 0.89496054152186 0.83333333333333 0.86965102865481 78.960 > 18 112 Se 0.63437160204674 0.16666666666667 0.92108680416550 78.960 > 19 113 Se 0.63437160204674 0.50000000000000 0.92108680416550 78.960 > 19 114 Se 0.63437160204674 0.83333333333333 0.92108680416550 78.960 > 19 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 7.9520974 0.0000000 0.2873899 0.0000000 10.0186920 0.0000000 0.2873890 0.0000000 8.8641314 -------------------------- Born effective charges -------------------------- 1 K 1.5742598 0.0000000 0.0776153 0.0000000 1.1266697 0.0000000 0.0462826 0.0000000 1.3089465 2 K 1.5742598 0.0000000 0.0776153 0.0000000 1.1266697 0.0000000 0.0462826 0.0000000 1.3089465 3 Dy 2.9794882 0.0000000 -0.8183861 0.0000000 4.5396916 0.0000000 -0.0282536 0.0000000 3.5213870 4 Dy 3.5975661 0.0000000 0.1592840 0.0000000 4.7268795 0.0000000 -0.5062877 0.0000000 4.7149350 5 Dy 3.5975661 0.0000000 0.1592840 0.0000000 4.7268795 0.0000000 -0.5062877 0.0000000 4.7149350 6 Dy 2.9794882 0.0000000 -0.8183861 0.0000000 4.5396916 0.0000000 -0.0282536 0.0000000 3.5213870 7 Cu 0.9102756 0.0000000 0.3604087 0.0000000 0.9742220 0.0000000 0.2334620 0.0000000 0.7490790 8 Cu 0.5050775 0.0000000 0.2264230 0.0000000 0.6893319 0.0000000 0.0310756 0.0000000 0.6825867 9 Cu 0.5050775 0.0000000 0.2264230 0.0000000 0.6893319 0.0000000 0.0310756 0.0000000 0.6825867 10 Cu 0.9102756 0.0000000 0.3604087 0.0000000 0.9742220 0.0000000 0.2334620 0.0000000 0.7490790 11 Se -1.9748104 0.0000000 0.1083907 0.0000000 -3.1506750 0.0000000 0.3691135 0.0000000 -1.7571023 12 Se -2.1979640 0.0000000 -0.0475219 0.0000000 -2.4793909 0.0000000 -0.2508152 0.0000000 -2.0170486 13 Se -1.5298145 0.0000000 0.0937001 0.0000000 -1.6123132 0.0000000 0.0101356 0.0000000 -3.6937889 14 Se -2.2193520 0.0000000 0.3607417 0.0000000 -2.6127614 0.0000000 0.5960337 0.0000000 -2.5700152 15 Se -3.2894528 0.0000000 -1.0413109 0.0000000 -4.4033082 0.0000000 -1.0014927 0.0000000 -1.8779581 16 Se -2.2193520 0.0000000 0.3607417 0.0000000 -2.6127614 0.0000000 0.5960337 0.0000000 -2.5700152 17 Se -1.5298145 0.0000000 0.0937001 0.0000000 -1.6123132 0.0000000 0.0101356 0.0000000 -3.6937889 18 Se -2.1979640 0.0000000 -0.0475219 0.0000000 -2.4793909 0.0000000 -0.2508152 0.0000000 -2.0170486 19 Se -1.9748104 0.0000000 0.1083907 0.0000000 -3.1506750 0.0000000 0.3691135 0.0000000 -1.7571023 ---------------------------------------------------------------------------- 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: 342/342 Permutation basis: 11469/11469 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2644 Number of blocks in projector: 2644 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: 724 Use submatrix version of eigh solver. (1) Block: 500 / 724 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 231 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 724 / 724 (1) 209 eigenvectors found. (1) Complementary block size: 34 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 400 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 400 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 400 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 360 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 360 Use standard eigh solver. Tree of FC basis block matrices: - (2644, 2595), data: False |-- (360, 360), data: True |-- (360, 360), data: True |-- (400, 390), data: True |-- (400, 390), data: True |-- (400, 390), data: True |-- (724, 705), data: False |-- (724, 15), data: (724, 34) @ (34, 15) |-- (224, 209), data: True |-- (500, 481), data: False |-- (500, 19), data: (500, 38) @ (38, 19) |-- (250, 231), data: True |-- (250, 231), data: True ----- Solver_atoms: 1 -- 114 / 114 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 640 - Time: 0.769 Solver_block: 200 / 640 - Time: 0.617 Solver_block: 300 / 640 - Time: 0.623 Solver_block: 400 / 640 - Time: 0.617 Solver_block: 500 / 640 - Time: 0.618 Solver_block: 600 / 640 - Time: 0.619 Solver_block: 640 / 640 - Time: 0.341 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 4.304 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 342/342 Permutation basis: 11469/11469 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2644 Number of blocks in projector: 2644 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: 724 Use submatrix version of eigh solver. (1) Block: 500 / 724 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 231 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 724 / 724 (1) 209 eigenvectors found. (1) Complementary block size: 34 (1) Compute compressed projector. (1) Use standard solver. (1) 15 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 400 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 400 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 400 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 360 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 360 Use standard eigh solver. Tree of FC basis block matrices: - (2644, 2595), data: False |-- (360, 360), data: True |-- (360, 360), data: True |-- (400, 390), data: True |-- (400, 390), data: True |-- (400, 390), data: True |-- (724, 705), data: False |-- (724, 15), data: (724, 34) @ (34, 15) |-- (224, 209), data: True |-- (500, 481), data: False |-- (500, 19), data: (500, 38) @ (38, 19) |-- (250, 231), data: True |-- (250, 231), 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 2026-01-09 04:42:21]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 04:42:21]------------------------- 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 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.036887735203868 -2.025460795000000 0.000000000000000 b 7.036887735203868 2.025460795000000 0.000000000000000 c -5.294578348431755 0.000000000000000 15.287417357954082 Atomic positions (fractional): 1 K 0.03300834841372 0.03300834841372 0.27058704213729 39.098 2 K 0.96699165158628 0.96699165158628 0.72941295786271 39.098 3 Dy 0.23092777757635 0.23092777757635 0.10253054838822 162.500 4 Dy 0.34515267478957 0.34515267478957 0.44362286267910 162.500 5 Dy 0.65484732521043 0.65484732521043 0.55637713732090 162.500 6 Dy 0.76907222242365 0.76907222242365 0.89746945161178 162.500 7 Cu 0.42293975628293 0.42293975628293 0.02769778953578 63.546 8 Cu 0.75850477624950 0.75850477624950 0.26933979072310 63.546 9 Cu 0.24149522375050 0.24149522375050 0.73066020927690 63.546 10 Cu 0.57706024371707 0.57706024371707 0.97230221046422 63.546 11 Se 0.86562839795326 0.86562839795326 0.07891319583450 78.960 12 Se 0.60503945847814 0.60503945847814 0.13034897134519 78.960 13 Se 0.35572687099426 0.35572687099425 0.27636718085851 78.960 14 Se 0.69860336804104 0.69860336804104 0.39502288066101 78.960 15 Se 0.00000000000000 0.00000000000000 0.50000000000000 78.960 16 Se 0.30139663195896 0.30139663195896 0.60497711933899 78.960 17 Se 0.64427312900575 0.64427312900574 0.72363281914149 78.960 18 Se 0.39496054152186 0.39496054152186 0.86965102865481 78.960 19 Se 0.13437160204674 0.13437160204674 0.92108680416550 78.960 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.073775470407735 0.000000000000000 0.000000000000000 b 0.000000000000000 12.152764769999999 0.000000000000000 c -5.294578348431755 0.000000000000000 15.287417357954082 Atomic positions (fractional): 1 K 0.03300834841372 0.00000000000000 0.27058704213729 39.098 > 1 2 K 0.03300834841372 0.33333333333333 0.27058704213729 39.098 > 1 3 K 0.03300834841372 0.66666666666667 0.27058704213729 39.098 > 1 4 K 0.96699165158628 0.00000000000000 0.72941295786271 39.098 > 4 5 K 0.96699165158628 0.33333333333333 0.72941295786271 39.098 > 4 6 K 0.96699165158628 0.66666666666667 0.72941295786271 39.098 > 4 7 K 0.53300834841372 0.16666666666667 0.27058704213729 39.098 > 1 8 K 0.53300834841372 0.50000000000000 0.27058704213729 39.098 > 1 9 K 0.53300834841372 0.83333333333333 0.27058704213729 39.098 > 1 10 K 0.46699165158628 0.16666666666667 0.72941295786271 39.098 > 4 11 K 0.46699165158628 0.50000000000000 0.72941295786271 39.098 > 4 12 K 0.46699165158628 0.83333333333333 0.72941295786271 39.098 > 4 13 Dy 0.73092777757635 0.16666666666667 0.10253054838822 162.500 > 13 14 Dy 0.73092777757635 0.50000000000000 0.10253054838822 162.500 > 13 15 Dy 0.73092777757635 0.83333333333333 0.10253054838822 162.500 > 13 16 Dy 0.84515267478957 0.16666666666667 0.44362286267910 162.500 > 16 17 Dy 0.84515267478957 0.50000000000000 0.44362286267910 162.500 > 16 18 Dy 0.84515267478957 0.83333333333333 0.44362286267910 162.500 > 16 19 Dy 0.15484732521043 0.16666666666667 0.55637713732090 162.500 > 19 20 Dy 0.15484732521043 0.50000000000000 0.55637713732090 162.500 > 19 21 Dy 0.15484732521043 0.83333333333333 0.55637713732090 162.500 > 19 22 Dy 0.26907222242365 0.16666666666667 0.89746945161178 162.500 > 22 23 Dy 0.26907222242365 0.50000000000000 0.89746945161178 162.500 > 22 24 Dy 0.26907222242365 0.83333333333333 0.89746945161178 162.500 > 22 25 Dy 0.23092777757635 0.00000000000000 0.10253054838822 162.500 > 13 26 Dy 0.23092777757635 0.33333333333333 0.10253054838822 162.500 > 13 27 Dy 0.23092777757635 0.66666666666667 0.10253054838822 162.500 > 13 28 Dy 0.34515267478957 0.00000000000000 0.44362286267910 162.500 > 16 29 Dy 0.34515267478957 0.33333333333333 0.44362286267910 162.500 > 16 30 Dy 0.34515267478957 0.66666666666667 0.44362286267910 162.500 > 16 31 Dy 0.65484732521043 0.00000000000000 0.55637713732090 162.500 > 19 32 Dy 0.65484732521043 0.33333333333333 0.55637713732090 162.500 > 19 33 Dy 0.65484732521043 0.66666666666667 0.55637713732090 162.500 > 19 34 Dy 0.76907222242365 0.00000000000000 0.89746945161178 162.500 > 22 35 Dy 0.76907222242365 0.33333333333333 0.89746945161178 162.500 > 22 36 Dy 0.76907222242365 0.66666666666667 0.89746945161178 162.500 > 22 37 Cu 0.92293975628293 0.16666666666667 0.02769778953578 63.546 > 37 38 Cu 0.92293975628293 0.50000000000000 0.02769778953578 63.546 > 37 39 Cu 0.92293975628293 0.83333333333333 0.02769778953578 63.546 > 37 40 Cu 0.75850477624950 0.00000000000000 0.26933979072310 63.546 > 40 41 Cu 0.75850477624950 0.33333333333333 0.26933979072310 63.546 > 40 42 Cu 0.75850477624950 0.66666666666667 0.26933979072310 63.546 > 40 43 Cu 0.24149522375050 0.00000000000000 0.73066020927690 63.546 > 43 44 Cu 0.24149522375050 0.33333333333333 0.73066020927690 63.546 > 43 45 Cu 0.24149522375050 0.66666666666667 0.73066020927690 63.546 > 43 46 Cu 0.07706024371707 0.16666666666667 0.97230221046422 63.546 > 46 47 Cu 0.07706024371707 0.50000000000000 0.97230221046422 63.546 > 46 48 Cu 0.07706024371707 0.83333333333333 0.97230221046422 63.546 > 46 49 Cu 0.42293975628293 0.00000000000000 0.02769778953578 63.546 > 37 50 Cu 0.42293975628293 0.33333333333333 0.02769778953578 63.546 > 37 51 Cu 0.42293975628293 0.66666666666667 0.02769778953578 63.546 > 37 52 Cu 0.25850477624950 0.16666666666667 0.26933979072310 63.546 > 40 53 Cu 0.25850477624950 0.50000000000000 0.26933979072310 63.546 > 40 54 Cu 0.25850477624950 0.83333333333333 0.26933979072310 63.546 > 40 55 Cu 0.74149522375050 0.16666666666667 0.73066020927690 63.546 > 43 56 Cu 0.74149522375050 0.50000000000000 0.73066020927690 63.546 > 43 57 Cu 0.74149522375050 0.83333333333333 0.73066020927690 63.546 > 43 58 Cu 0.57706024371707 0.00000000000000 0.97230221046422 63.546 > 46 59 Cu 0.57706024371707 0.33333333333333 0.97230221046422 63.546 > 46 60 Cu 0.57706024371707 0.66666666666667 0.97230221046422 63.546 > 46 61 Se 0.86562839795326 0.00000000000000 0.07891319583450 78.960 > 61 62 Se 0.86562839795326 0.33333333333333 0.07891319583450 78.960 > 61 63 Se 0.86562839795326 0.66666666666667 0.07891319583450 78.960 > 61 64 Se 0.60503945847814 0.00000000000000 0.13034897134519 78.960 > 64 65 Se 0.60503945847814 0.33333333333333 0.13034897134519 78.960 > 64 66 Se 0.60503945847814 0.66666666666667 0.13034897134519 78.960 > 64 67 Se 0.85572687099426 0.16666666666667 0.27636718085851 78.960 > 67 68 Se 0.85572687099426 0.50000000000000 0.27636718085851 78.960 > 67 69 Se 0.85572687099426 0.83333333333333 0.27636718085851 78.960 > 67 70 Se 0.69860336804104 0.00000000000000 0.39502288066101 78.960 > 70 71 Se 0.69860336804104 0.33333333333333 0.39502288066101 78.960 > 70 72 Se 0.69860336804104 0.66666666666667 0.39502288066101 78.960 > 70 73 Se 0.00000000000000 0.00000000000000 0.50000000000000 78.960 > 73 74 Se 0.00000000000000 0.33333333333333 0.50000000000000 78.960 > 73 75 Se 0.00000000000000 0.66666666666667 0.50000000000000 78.960 > 73 76 Se 0.30139663195896 0.00000000000000 0.60497711933899 78.960 > 76 77 Se 0.30139663195896 0.33333333333333 0.60497711933899 78.960 > 76 78 Se 0.30139663195896 0.66666666666667 0.60497711933899 78.960 > 76 79 Se 0.14427312900574 0.16666666666667 0.72363281914149 78.960 > 79 80 Se 0.14427312900574 0.50000000000000 0.72363281914149 78.960 > 79 81 Se 0.14427312900574 0.83333333333333 0.72363281914149 78.960 > 79 82 Se 0.39496054152186 0.00000000000000 0.86965102865481 78.960 > 82 83 Se 0.39496054152186 0.33333333333333 0.86965102865481 78.960 > 82 84 Se 0.39496054152186 0.66666666666667 0.86965102865481 78.960 > 82 85 Se 0.13437160204674 0.00000000000000 0.92108680416550 78.960 > 85 86 Se 0.13437160204674 0.33333333333333 0.92108680416550 78.960 > 85 87 Se 0.13437160204674 0.66666666666667 0.92108680416550 78.960 > 85 88 Se 0.36562839795326 0.16666666666667 0.07891319583450 78.960 > 61 89 Se 0.36562839795326 0.50000000000000 0.07891319583450 78.960 > 61 90 Se 0.36562839795326 0.83333333333333 0.07891319583450 78.960 > 61 91 Se 0.10503945847814 0.16666666666667 0.13034897134519 78.960 > 64 92 Se 0.10503945847814 0.50000000000000 0.13034897134519 78.960 > 64 93 Se 0.10503945847814 0.83333333333333 0.13034897134519 78.960 > 64 94 Se 0.35572687099425 0.00000000000000 0.27636718085851 78.960 > 67 95 Se 0.35572687099425 0.33333333333333 0.27636718085851 78.960 > 67 96 Se 0.35572687099425 0.66666666666667 0.27636718085851 78.960 > 67 97 Se 0.19860336804104 0.16666666666667 0.39502288066101 78.960 > 70 98 Se 0.19860336804104 0.50000000000000 0.39502288066101 78.960 > 70 99 Se 0.19860336804104 0.83333333333333 0.39502288066101 78.960 > 70 100 Se 0.50000000000000 0.16666666666667 0.50000000000000 78.960 > 73 101 Se 0.50000000000000 0.50000000000000 0.50000000000000 78.960 > 73 102 Se 0.50000000000000 0.83333333333333 0.50000000000000 78.960 > 73 103 Se 0.80139663195896 0.16666666666667 0.60497711933899 78.960 > 76 104 Se 0.80139663195896 0.50000000000000 0.60497711933899 78.960 > 76 105 Se 0.80139663195896 0.83333333333333 0.60497711933899 78.960 > 76 106 Se 0.64427312900574 0.00000000000000 0.72363281914149 78.960 > 79 107 Se 0.64427312900574 0.33333333333333 0.72363281914149 78.960 > 79 108 Se 0.64427312900574 0.66666666666667 0.72363281914149 78.960 > 79 109 Se 0.89496054152186 0.16666666666667 0.86965102865481 78.960 > 82 110 Se 0.89496054152186 0.50000000000000 0.86965102865481 78.960 > 82 111 Se 0.89496054152186 0.83333333333333 0.86965102865481 78.960 > 82 112 Se 0.63437160204674 0.16666666666667 0.92108680416550 78.960 > 85 113 Se 0.63437160204674 0.50000000000000 0.92108680416550 78.960 > 85 114 Se 0.63437160204674 0.83333333333333 0.92108680416550 78.960 > 85 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 7.9520974 0.0000000 0.2873899 0.0000000 10.0186920 0.0000000 0.2873890 0.0000000 8.8641314 -------------------------- Born effective charges -------------------------- 1 K 1.5742598 0.0000000 0.0776153 0.0000000 1.1266697 0.0000000 0.0462826 0.0000000 1.3089465 2 K 1.5742598 0.0000000 0.0776153 0.0000000 1.1266697 0.0000000 0.0462826 0.0000000 1.3089465 3 Dy 2.9794882 0.0000000 -0.8183861 0.0000000 4.5396916 0.0000000 -0.0282536 0.0000000 3.5213870 4 Dy 3.5975661 0.0000000 0.1592840 0.0000000 4.7268795 0.0000000 -0.5062877 0.0000000 4.7149350 5 Dy 3.5975661 0.0000000 0.1592840 0.0000000 4.7268795 0.0000000 -0.5062877 0.0000000 4.7149350 6 Dy 2.9794882 0.0000000 -0.8183861 0.0000000 4.5396916 0.0000000 -0.0282536 0.0000000 3.5213870 7 Cu 0.9102756 0.0000000 0.3604087 0.0000000 0.9742220 0.0000000 0.2334620 0.0000000 0.7490790 8 Cu 0.5050775 0.0000000 0.2264230 0.0000000 0.6893319 0.0000000 0.0310756 0.0000000 0.6825867 9 Cu 0.5050775 0.0000000 0.2264230 0.0000000 0.6893319 0.0000000 0.0310756 0.0000000 0.6825867 10 Cu 0.9102756 0.0000000 0.3604087 0.0000000 0.9742220 0.0000000 0.2334620 0.0000000 0.7490790 11 Se -1.9748104 0.0000000 0.1083907 0.0000000 -3.1506750 0.0000000 0.3691135 0.0000000 -1.7571023 12 Se -2.1979640 0.0000000 -0.0475219 0.0000000 -2.4793909 0.0000000 -0.2508152 0.0000000 -2.0170486 13 Se -1.5298145 0.0000000 0.0937001 0.0000000 -1.6123132 0.0000000 0.0101356 0.0000000 -3.6937889 14 Se -2.2193520 0.0000000 0.3607417 0.0000000 -2.6127614 0.0000000 0.5960337 0.0000000 -2.5700152 15 Se -3.2894528 0.0000000 -1.0413109 0.0000000 -4.4033082 0.0000000 -1.0014927 0.0000000 -1.8779581 16 Se -2.2193520 0.0000000 0.3607417 0.0000000 -2.6127614 0.0000000 0.5960337 0.0000000 -2.5700152 17 Se -1.5298145 0.0000000 0.0937001 0.0000000 -1.6123132 0.0000000 0.0101356 0.0000000 -3.6937889 18 Se -2.1979640 0.0000000 -0.0475219 0.0000000 -2.4793909 0.0000000 -0.2508152 0.0000000 -2.0170486 19 Se -1.9748104 0.0000000 0.1083907 0.0000000 -3.1506750 0.0000000 0.3691135 0.0000000 -1.7571023 ---------------------------------------------------------------------------- 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 13, 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 16, 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 37, 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 40, 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 61, 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 64, 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 67, 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 70, 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (xz) -0.00000000 (xz) 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 2026-01-09 04:42:53]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 04:42:53]------------------------- 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 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.036887735203868 -2.025460795000000 0.000000000000000 b 7.036887735203868 2.025460795000000 0.000000000000000 c -5.294578348431755 0.000000000000000 15.287417357954082 Atomic positions (fractional): 1 K 0.03300834841372 0.03300834841372 0.27058704213729 39.098 2 K 0.96699165158628 0.96699165158628 0.72941295786271 39.098 3 Dy 0.23092777757635 0.23092777757635 0.10253054838822 162.500 4 Dy 0.34515267478957 0.34515267478957 0.44362286267910 162.500 5 Dy 0.65484732521043 0.65484732521043 0.55637713732090 162.500 6 Dy 0.76907222242365 0.76907222242365 0.89746945161178 162.500 7 Cu 0.42293975628293 0.42293975628293 0.02769778953578 63.546 8 Cu 0.75850477624950 0.75850477624950 0.26933979072310 63.546 9 Cu 0.24149522375050 0.24149522375050 0.73066020927690 63.546 10 Cu 0.57706024371707 0.57706024371707 0.97230221046422 63.546 11 Se 0.86562839795326 0.86562839795326 0.07891319583450 78.960 12 Se 0.60503945847814 0.60503945847814 0.13034897134519 78.960 13 Se 0.35572687099426 0.35572687099425 0.27636718085851 78.960 14 Se 0.69860336804104 0.69860336804104 0.39502288066101 78.960 15 Se 0.00000000000000 0.00000000000000 0.50000000000000 78.960 16 Se 0.30139663195896 0.30139663195896 0.60497711933899 78.960 17 Se 0.64427312900575 0.64427312900574 0.72363281914149 78.960 18 Se 0.39496054152186 0.39496054152186 0.86965102865481 78.960 19 Se 0.13437160204674 0.13437160204674 0.92108680416550 78.960 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.073775470407735 0.000000000000000 0.000000000000000 b 0.000000000000000 12.152764769999999 0.000000000000000 c -5.294578348431755 0.000000000000000 15.287417357954082 Atomic positions (fractional): 1 K 0.03300834841372 0.00000000000000 0.27058704213729 39.098 > 1 2 K 0.03300834841372 0.33333333333333 0.27058704213729 39.098 > 1 3 K 0.03300834841372 0.66666666666667 0.27058704213729 39.098 > 1 4 K 0.96699165158628 0.00000000000000 0.72941295786271 39.098 > 4 5 K 0.96699165158628 0.33333333333333 0.72941295786271 39.098 > 4 6 K 0.96699165158628 0.66666666666667 0.72941295786271 39.098 > 4 7 K 0.53300834841372 0.16666666666667 0.27058704213729 39.098 > 1 8 K 0.53300834841372 0.50000000000000 0.27058704213729 39.098 > 1 9 K 0.53300834841372 0.83333333333333 0.27058704213729 39.098 > 1 10 K 0.46699165158628 0.16666666666667 0.72941295786271 39.098 > 4 11 K 0.46699165158628 0.50000000000000 0.72941295786271 39.098 > 4 12 K 0.46699165158628 0.83333333333333 0.72941295786271 39.098 > 4 13 Dy 0.73092777757635 0.16666666666667 0.10253054838822 162.500 > 13 14 Dy 0.73092777757635 0.50000000000000 0.10253054838822 162.500 > 13 15 Dy 0.73092777757635 0.83333333333333 0.10253054838822 162.500 > 13 16 Dy 0.84515267478957 0.16666666666667 0.44362286267910 162.500 > 16 17 Dy 0.84515267478957 0.50000000000000 0.44362286267910 162.500 > 16 18 Dy 0.84515267478957 0.83333333333333 0.44362286267910 162.500 > 16 19 Dy 0.15484732521043 0.16666666666667 0.55637713732090 162.500 > 19 20 Dy 0.15484732521043 0.50000000000000 0.55637713732090 162.500 > 19 21 Dy 0.15484732521043 0.83333333333333 0.55637713732090 162.500 > 19 22 Dy 0.26907222242365 0.16666666666667 0.89746945161178 162.500 > 22 23 Dy 0.26907222242365 0.50000000000000 0.89746945161178 162.500 > 22 24 Dy 0.26907222242365 0.83333333333333 0.89746945161178 162.500 > 22 25 Dy 0.23092777757635 0.00000000000000 0.10253054838822 162.500 > 13 26 Dy 0.23092777757635 0.33333333333333 0.10253054838822 162.500 > 13 27 Dy 0.23092777757635 0.66666666666667 0.10253054838822 162.500 > 13 28 Dy 0.34515267478957 0.00000000000000 0.44362286267910 162.500 > 16 29 Dy 0.34515267478957 0.33333333333333 0.44362286267910 162.500 > 16 30 Dy 0.34515267478957 0.66666666666667 0.44362286267910 162.500 > 16 31 Dy 0.65484732521043 0.00000000000000 0.55637713732090 162.500 > 19 32 Dy 0.65484732521043 0.33333333333333 0.55637713732090 162.500 > 19 33 Dy 0.65484732521043 0.66666666666667 0.55637713732090 162.500 > 19 34 Dy 0.76907222242365 0.00000000000000 0.89746945161178 162.500 > 22 35 Dy 0.76907222242365 0.33333333333333 0.89746945161178 162.500 > 22 36 Dy 0.76907222242365 0.66666666666667 0.89746945161178 162.500 > 22 37 Cu 0.92293975628293 0.16666666666667 0.02769778953578 63.546 > 37 38 Cu 0.92293975628293 0.50000000000000 0.02769778953578 63.546 > 37 39 Cu 0.92293975628293 0.83333333333333 0.02769778953578 63.546 > 37 40 Cu 0.75850477624950 0.00000000000000 0.26933979072310 63.546 > 40 41 Cu 0.75850477624950 0.33333333333333 0.26933979072310 63.546 > 40 42 Cu 0.75850477624950 0.66666666666667 0.26933979072310 63.546 > 40 43 Cu 0.24149522375050 0.00000000000000 0.73066020927690 63.546 > 43 44 Cu 0.24149522375050 0.33333333333333 0.73066020927690 63.546 > 43 45 Cu 0.24149522375050 0.66666666666667 0.73066020927690 63.546 > 43 46 Cu 0.07706024371707 0.16666666666667 0.97230221046422 63.546 > 46 47 Cu 0.07706024371707 0.50000000000000 0.97230221046422 63.546 > 46 48 Cu 0.07706024371707 0.83333333333333 0.97230221046422 63.546 > 46 49 Cu 0.42293975628293 0.00000000000000 0.02769778953578 63.546 > 37 50 Cu 0.42293975628293 0.33333333333333 0.02769778953578 63.546 > 37 51 Cu 0.42293975628293 0.66666666666667 0.02769778953578 63.546 > 37 52 Cu 0.25850477624950 0.16666666666667 0.26933979072310 63.546 > 40 53 Cu 0.25850477624950 0.50000000000000 0.26933979072310 63.546 > 40 54 Cu 0.25850477624950 0.83333333333333 0.26933979072310 63.546 > 40 55 Cu 0.74149522375050 0.16666666666667 0.73066020927690 63.546 > 43 56 Cu 0.74149522375050 0.50000000000000 0.73066020927690 63.546 > 43 57 Cu 0.74149522375050 0.83333333333333 0.73066020927690 63.546 > 43 58 Cu 0.57706024371707 0.00000000000000 0.97230221046422 63.546 > 46 59 Cu 0.57706024371707 0.33333333333333 0.97230221046422 63.546 > 46 60 Cu 0.57706024371707 0.66666666666667 0.97230221046422 63.546 > 46 61 Se 0.86562839795326 0.00000000000000 0.07891319583450 78.960 > 61 62 Se 0.86562839795326 0.33333333333333 0.07891319583450 78.960 > 61 63 Se 0.86562839795326 0.66666666666667 0.07891319583450 78.960 > 61 64 Se 0.60503945847814 0.00000000000000 0.13034897134519 78.960 > 64 65 Se 0.60503945847814 0.33333333333333 0.13034897134519 78.960 > 64 66 Se 0.60503945847814 0.66666666666667 0.13034897134519 78.960 > 64 67 Se 0.85572687099426 0.16666666666667 0.27636718085851 78.960 > 67 68 Se 0.85572687099426 0.50000000000000 0.27636718085851 78.960 > 67 69 Se 0.85572687099426 0.83333333333333 0.27636718085851 78.960 > 67 70 Se 0.69860336804104 0.00000000000000 0.39502288066101 78.960 > 70 71 Se 0.69860336804104 0.33333333333333 0.39502288066101 78.960 > 70 72 Se 0.69860336804104 0.66666666666667 0.39502288066101 78.960 > 70 73 Se 0.00000000000000 0.00000000000000 0.50000000000000 78.960 > 73 74 Se 0.00000000000000 0.33333333333333 0.50000000000000 78.960 > 73 75 Se 0.00000000000000 0.66666666666667 0.50000000000000 78.960 > 73 76 Se 0.30139663195896 0.00000000000000 0.60497711933899 78.960 > 76 77 Se 0.30139663195896 0.33333333333333 0.60497711933899 78.960 > 76 78 Se 0.30139663195896 0.66666666666667 0.60497711933899 78.960 > 76 79 Se 0.14427312900574 0.16666666666667 0.72363281914149 78.960 > 79 80 Se 0.14427312900574 0.50000000000000 0.72363281914149 78.960 > 79 81 Se 0.14427312900574 0.83333333333333 0.72363281914149 78.960 > 79 82 Se 0.39496054152186 0.00000000000000 0.86965102865481 78.960 > 82 83 Se 0.39496054152186 0.33333333333333 0.86965102865481 78.960 > 82 84 Se 0.39496054152186 0.66666666666667 0.86965102865481 78.960 > 82 85 Se 0.13437160204674 0.00000000000000 0.92108680416550 78.960 > 85 86 Se 0.13437160204674 0.33333333333333 0.92108680416550 78.960 > 85 87 Se 0.13437160204674 0.66666666666667 0.92108680416550 78.960 > 85 88 Se 0.36562839795326 0.16666666666667 0.07891319583450 78.960 > 61 89 Se 0.36562839795326 0.50000000000000 0.07891319583450 78.960 > 61 90 Se 0.36562839795326 0.83333333333333 0.07891319583450 78.960 > 61 91 Se 0.10503945847814 0.16666666666667 0.13034897134519 78.960 > 64 92 Se 0.10503945847814 0.50000000000000 0.13034897134519 78.960 > 64 93 Se 0.10503945847814 0.83333333333333 0.13034897134519 78.960 > 64 94 Se 0.35572687099425 0.00000000000000 0.27636718085851 78.960 > 67 95 Se 0.35572687099425 0.33333333333333 0.27636718085851 78.960 > 67 96 Se 0.35572687099425 0.66666666666667 0.27636718085851 78.960 > 67 97 Se 0.19860336804104 0.16666666666667 0.39502288066101 78.960 > 70 98 Se 0.19860336804104 0.50000000000000 0.39502288066101 78.960 > 70 99 Se 0.19860336804104 0.83333333333333 0.39502288066101 78.960 > 70 100 Se 0.50000000000000 0.16666666666667 0.50000000000000 78.960 > 73 101 Se 0.50000000000000 0.50000000000000 0.50000000000000 78.960 > 73 102 Se 0.50000000000000 0.83333333333333 0.50000000000000 78.960 > 73 103 Se 0.80139663195896 0.16666666666667 0.60497711933899 78.960 > 76 104 Se 0.80139663195896 0.50000000000000 0.60497711933899 78.960 > 76 105 Se 0.80139663195896 0.83333333333333 0.60497711933899 78.960 > 76 106 Se 0.64427312900574 0.00000000000000 0.72363281914149 78.960 > 79 107 Se 0.64427312900574 0.33333333333333 0.72363281914149 78.960 > 79 108 Se 0.64427312900574 0.66666666666667 0.72363281914149 78.960 > 79 109 Se 0.89496054152186 0.16666666666667 0.86965102865481 78.960 > 82 110 Se 0.89496054152186 0.50000000000000 0.86965102865481 78.960 > 82 111 Se 0.89496054152186 0.83333333333333 0.86965102865481 78.960 > 82 112 Se 0.63437160204674 0.16666666666667 0.92108680416550 78.960 > 85 113 Se 0.63437160204674 0.50000000000000 0.92108680416550 78.960 > 85 114 Se 0.63437160204674 0.83333333333333 0.92108680416550 78.960 > 85 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 7.9520974 0.0000000 0.2873899 0.0000000 10.0186920 0.0000000 0.2873890 0.0000000 8.8641314 -------------------------- Born effective charges -------------------------- 1 K 1.5742598 0.0000000 0.0776153 0.0000000 1.1266697 0.0000000 0.0462826 0.0000000 1.3089465 2 K 1.5742598 0.0000000 0.0776153 0.0000000 1.1266697 0.0000000 0.0462826 0.0000000 1.3089465 3 Dy 2.9794882 0.0000000 -0.8183861 0.0000000 4.5396916 0.0000000 -0.0282536 0.0000000 3.5213870 4 Dy 3.5975661 0.0000000 0.1592840 0.0000000 4.7268795 0.0000000 -0.5062877 0.0000000 4.7149350 5 Dy 3.5975661 0.0000000 0.1592840 0.0000000 4.7268795 0.0000000 -0.5062877 0.0000000 4.7149350 6 Dy 2.9794882 0.0000000 -0.8183861 0.0000000 4.5396916 0.0000000 -0.0282536 0.0000000 3.5213870 7 Cu 0.9102756 0.0000000 0.3604087 0.0000000 0.9742220 0.0000000 0.2334620 0.0000000 0.7490790 8 Cu 0.5050775 0.0000000 0.2264230 0.0000000 0.6893319 0.0000000 0.0310756 0.0000000 0.6825867 9 Cu 0.5050775 0.0000000 0.2264230 0.0000000 0.6893319 0.0000000 0.0310756 0.0000000 0.6825867 10 Cu 0.9102756 0.0000000 0.3604087 0.0000000 0.9742220 0.0000000 0.2334620 0.0000000 0.7490790 11 Se -1.9748104 0.0000000 0.1083907 0.0000000 -3.1506750 0.0000000 0.3691135 0.0000000 -1.7571023 12 Se -2.1979640 0.0000000 -0.0475219 0.0000000 -2.4793909 0.0000000 -0.2508152 0.0000000 -2.0170486 13 Se -1.5298145 0.0000000 0.0937001 0.0000000 -1.6123132 0.0000000 0.0101356 0.0000000 -3.6937889 14 Se -2.2193520 0.0000000 0.3607417 0.0000000 -2.6127614 0.0000000 0.5960337 0.0000000 -2.5700152 15 Se -3.2894528 0.0000000 -1.0413109 0.0000000 -4.4033082 0.0000000 -1.0014927 0.0000000 -1.8779581 16 Se -2.2193520 0.0000000 0.3607417 0.0000000 -2.6127614 0.0000000 0.5960337 0.0000000 -2.5700152 17 Se -1.5298145 0.0000000 0.0937001 0.0000000 -1.6123132 0.0000000 0.0101356 0.0000000 -3.6937889 18 Se -2.1979640 0.0000000 -0.0475219 0.0000000 -2.4793909 0.0000000 -0.2508152 0.0000000 -2.0170486 19 Se -1.9748104 0.0000000 0.1083907 0.0000000 -3.1506750 0.0000000 0.3691135 0.0000000 -1.7571023 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (xxx) 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 ... [ 13 13 3 ] 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: 0.55, Number of G-points: 293, Lambda: 0.17 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/140) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 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 0.968 ( 0.000 0.000 0.000) 0.000 0.999 ( 0.000 0.000 0.000) 0.000 1.472 ( 0.000 0.000 0.000) 0.000 1.496 ( 0.000 0.000 0.000) 0.000 1.777 ( 0.000 0.000 0.000) 0.000 1.872 ( 0.000 0.000 0.000) 0.000 1.893 ( 0.000 0.000 0.000) 0.000 1.939 ( 0.000 0.000 0.000) 0.000 2.043 ( 0.000 0.000 0.000) 0.000 2.078 ( 0.000 0.000 0.000) 0.000 2.367 ( 0.000 0.000 0.000) 0.000 2.483 ( 0.000 0.000 0.000) 0.000 2.524 ( 0.000 0.000 0.000) 0.000 2.568 ( 0.000 0.000 0.000) 0.000 2.605 ( 0.000 0.000 0.000) 0.000 2.635 ( 0.000 0.000 0.000) 0.000 2.744 ( 0.000 0.000 0.000) 0.000 2.853 ( 0.000 0.000 0.000) 0.000 3.093 ( 0.000 0.000 0.000) 0.000 3.114 ( 0.000 0.000 0.000) 0.000 3.234 ( 0.000 0.000 0.000) 0.000 3.242 ( 0.000 0.000 0.000) 0.000 3.326 ( 0.000 0.000 0.000) 0.000 3.354 ( 0.000 0.000 0.000) 0.000 3.372 ( 0.000 0.000 0.000) 0.000 3.671 ( 0.000 0.000 0.000) 0.000 3.862 ( 0.000 0.000 0.000) 0.000 4.024 ( 0.000 0.000 0.000) 0.000 4.033 ( 0.000 0.000 0.000) 0.000 4.093 ( 0.000 0.000 0.000) 0.000 4.224 ( 0.000 0.000 0.000) 0.000 4.306 ( 0.000 0.000 0.000) 0.000 4.388 ( 0.000 0.000 0.000) 0.000 4.669 ( 0.000 0.000 0.000) 0.000 4.682 ( 0.000 0.000 0.000) 0.000 4.706 ( 0.000 0.000 0.000) 0.000 4.816 ( 0.000 0.000 0.000) 0.000 5.017 ( 0.000 0.000 0.000) 0.000 5.078 ( 0.000 0.000 0.000) 0.000 5.161 ( 0.000 0.000 0.000) 0.000 5.268 ( 0.000 0.000 0.000) 0.000 5.312 ( 0.000 0.000 0.000) 0.000 5.390 ( 0.000 0.000 0.000) 0.000 5.411 ( 0.000 0.000 0.000) 0.000 5.486 ( 0.000 0.000 0.000) 0.000 5.636 ( 0.000 0.000 0.000) 0.000 5.648 ( 0.000 0.000 0.000) 0.000 5.650 ( 0.000 0.000 0.000) 0.000 5.723 ( 0.000 0.000 0.000) 0.000 5.861 ( 0.000 0.000 0.000) 0.000 5.895 ( 0.000 0.000 0.000) 0.000 5.928 ( 0.000 0.000 0.000) 0.000 6.048 ( 0.000 0.000 0.000) 0.000 6.237 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/140) ======================= q-point: ( 0.08 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.385 ( 3.568 -18.977 1.353) 19.356 0.424 ( -1.606 -22.642 -0.247) 22.700 0.779 ( 12.790 -35.967 3.206) 38.308 1.037 ( 2.045 -6.313 -0.081) 6.637 1.163 ( 2.818 -14.590 -1.498) 14.935 1.482 ( 0.139 -0.009 0.965) 0.975 1.511 ( -0.848 -4.334 -1.803) 4.770 1.824 ( -2.320 -2.484 0.878) 3.511 1.922 ( -2.449 -5.533 -3.886) 7.192 1.960 ( 2.137 -5.993 2.877) 6.982 2.007 ( -0.000 -6.807 1.032) 6.885 2.092 ( 0.344 -1.883 0.763) 2.061 2.121 ( 0.342 -7.286 0.011) 7.294 2.316 ( -1.048 3.932 0.203) 4.075 2.481 ( 0.533 0.275 -0.320) 0.680 2.537 ( -0.308 -0.838 -1.877) 2.078 2.561 ( -0.559 -1.205 -0.657) 1.482 2.606 ( 1.039 -0.898 -8.334) 8.447 2.655 ( 1.174 -0.822 8.882) 8.997 2.822 ( 0.037 1.735 1.901) 2.574 2.860 ( -1.132 -7.847 -0.194) 7.930 3.048 ( -1.800 2.240 -1.585) 3.282 3.119 ( 2.039 0.261 0.458) 2.106 3.246 ( -1.335 -0.224 0.385) 1.407 3.313 ( 2.784 -0.956 -2.002) 3.560 3.336 ( -1.047 -2.881 0.313) 3.081 3.381 ( -0.027 -5.116 -1.262) 5.269 3.392 ( -1.546 -2.484 1.200) 3.163 3.653 ( 0.621 1.822 0.334) 1.953 4.017 ( 0.031 -6.916 0.212) 6.920 4.049 ( 0.224 -0.412 -0.080) 0.476 4.094 ( -1.053 -1.597 -1.864) 2.671 4.140 ( -0.289 2.757 0.430) 2.806 4.272 ( 0.697 -2.495 1.583) 3.036 4.398 ( 0.182 -0.904 0.001) 0.923 4.637 ( -11.122 -4.801 -8.149) 14.600 4.665 ( -4.559 -1.002 -0.063) 4.669 4.718 ( 3.429 -0.624 0.016) 3.485 4.796 ( -0.081 1.815 -0.188) 1.826 4.983 ( -1.093 1.907 -1.863) 2.882 5.023 ( 3.363 4.103 6.543) 8.423 5.123 ( 2.131 -0.109 5.555) 5.951 5.172 ( 1.285 -0.996 -2.846) 3.278 5.268 ( 0.420 0.322 -0.333) 0.625 5.309 ( 1.304 0.589 -1.991) 2.452 5.369 ( 0.129 1.942 0.127) 1.951 5.408 ( -0.297 0.265 0.868) 0.955 5.472 ( 2.861 2.866 0.487) 4.079 5.613 ( -0.082 2.285 -0.242) 2.299 5.624 ( 0.430 2.499 -0.112) 2.538 5.693 ( 0.041 1.040 -0.080) 1.044 5.765 ( -0.057 -1.871 -0.240) 1.887 5.854 ( 0.059 0.934 -0.212) 0.959 6.008 ( -0.456 -4.911 -0.056) 4.932 6.026 ( -0.602 1.602 0.132) 1.716 6.208 ( 0.731 2.832 0.527) 2.971 6.332 ( -5.176 -2.526 0.195) 5.763 ======================= Grid point 2 (3/140) ======================= q-point: ( 0.15 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.760 ( 3.237 -18.177 1.114) 18.497 0.839 ( -2.378 -22.113 -0.093) 22.240 1.211 ( 1.367 -10.807 -0.662) 10.913 1.472 ( 7.908 -18.769 -1.326) 20.410 1.501 ( 3.670 -24.871 -2.518) 25.266 1.532 ( 1.299 -5.440 6.463) 8.547 1.636 ( -0.719 -11.538 -3.489) 12.075 1.836 ( -1.431 -0.567 3.227) 3.575 2.030 ( -3.199 -7.155 -0.874) 7.886 2.100 ( -0.140 -4.232 0.110) 4.236 2.132 ( -0.042 -6.971 1.756) 7.189 2.173 ( -1.377 -5.165 0.990) 5.436 2.239 ( -0.777 -0.681 -0.376) 1.099 2.312 ( 1.139 -8.172 0.135) 8.252 2.485 ( 0.830 -0.841 -1.685) 2.058 2.555 ( -0.755 -2.715 -2.131) 3.533 2.609 ( 0.214 -3.539 -2.015) 4.078 2.626 ( 0.152 -2.128 -4.183) 4.695 2.700 ( 1.165 -1.358 7.095) 7.318 2.828 ( 1.615 -2.789 1.372) 3.503 2.943 ( -2.626 -0.554 -2.170) 3.451 3.034 ( -2.980 -2.808 0.530) 4.129 3.157 ( 3.784 -2.797 1.330) 4.890 3.228 ( -1.768 0.460 1.044) 2.104 3.300 ( 2.542 1.538 -6.722) 7.349 3.419 ( -0.864 -2.919 2.557) 3.976 3.445 ( -2.839 -5.886 -1.823) 6.784 3.520 ( -1.046 -7.559 -0.013) 7.631 3.628 ( 3.278 1.049 1.798) 3.883 4.009 ( 0.867 5.586 1.290) 5.798 4.022 ( 0.126 2.539 0.247) 2.554 4.150 ( -0.789 -3.998 -1.674) 4.406 4.225 ( -0.249 -8.117 0.024) 8.121 4.335 ( 1.360 -3.756 2.920) 4.948 4.416 ( 1.595 -0.339 -0.425) 1.685 4.656 ( -2.113 -2.084 -1.095) 3.163 4.673 ( -2.489 -1.544 -1.182) 3.159 4.730 ( 0.754 1.732 0.935) 2.108 4.773 ( 1.310 -0.409 -0.757) 1.567 4.940 ( -1.596 1.287 -2.302) 3.083 4.977 ( -0.265 2.305 2.296) 3.264 5.095 ( -0.165 4.088 0.119) 4.093 5.206 ( 0.271 -2.310 0.269) 2.341 5.254 ( -0.777 0.847 0.107) 1.154 5.301 ( 0.960 0.588 -1.304) 1.723 5.341 ( -0.320 0.692 -0.503) 0.913 5.393 ( -1.568 1.039 1.869) 2.651 5.434 ( 2.786 2.305 -0.356) 3.633 5.551 ( -1.342 3.287 -0.013) 3.550 5.581 ( 1.687 2.413 -0.495) 2.986 5.684 ( 0.020 0.206 -0.078) 0.221 5.792 ( -0.537 -1.393 -0.569) 1.598 5.863 ( 0.145 -1.296 -0.375) 1.357 5.973 ( -1.498 2.976 1.418) 3.621 6.096 ( -0.978 -3.594 0.046) 3.725 6.156 ( 1.292 2.536 0.079) 2.847 6.347 ( -3.282 -1.246 0.224) 3.517 ======================= Grid point 3 (4/140) ======================= q-point: ( 0.23 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.108 ( 2.634 -16.297 1.020) 16.540 1.227 ( -2.869 -19.877 0.180) 20.084 1.432 ( -0.045 -11.595 -1.634) 11.709 1.643 ( 2.345 -7.315 -5.654) 9.538 1.680 ( -1.645 -7.323 3.615) 8.330 1.855 ( 1.523 -3.097 2.862) 4.484 1.869 ( -0.011 -10.291 1.549) 10.407 1.991 ( -3.130 -13.188 0.017) 13.555 2.138 ( -1.182 -0.899 0.650) 1.621 2.154 ( -4.320 -7.545 2.354) 9.008 2.177 ( -0.203 -2.116 -0.548) 2.195 2.288 ( -0.224 -5.445 -1.162) 5.572 2.334 ( 1.074 -7.946 1.401) 8.140 2.414 ( 0.803 -1.802 0.404) 2.014 2.514 ( 0.604 -1.274 -3.437) 3.715 2.618 ( 0.418 -1.941 0.128) 1.989 2.676 ( -0.501 -4.077 -2.128) 4.626 2.684 ( 0.390 -5.707 -0.385) 5.733 2.800 ( 3.323 -7.746 2.995) 8.945 2.873 ( 0.858 0.692 2.042) 2.320 2.997 ( 0.412 -8.210 -3.580) 8.967 3.066 ( -3.355 -2.090 0.063) 3.953 3.214 ( -0.553 -0.681 3.571) 3.677 3.249 ( 1.752 -1.958 1.461) 3.007 3.269 ( 1.724 0.596 -7.955) 8.162 3.430 ( -1.657 0.849 -0.090) 1.864 3.536 ( -1.266 -3.862 -1.068) 4.202 3.596 ( -1.961 -4.404 -2.345) 5.360 3.719 ( 4.911 -5.249 1.622) 7.368 3.926 ( 1.656 2.224 1.927) 3.377 3.980 ( 1.836 2.565 3.525) 4.731 4.226 ( 0.128 -4.511 -1.265) 4.687 4.330 ( 0.382 -3.301 1.219) 3.539 4.420 ( 1.951 0.400 -0.422) 2.036 4.448 ( 1.579 -5.158 2.139) 5.803 4.654 ( 0.572 2.768 0.233) 2.836 4.681 ( -0.718 -0.294 -0.846) 1.148 4.717 ( -0.478 -1.562 -0.382) 1.678 4.796 ( 0.992 -0.494 -0.980) 1.480 4.896 ( -1.547 2.817 -0.011) 3.214 4.944 ( -0.265 1.182 -0.935) 1.530 5.030 ( -1.931 -0.029 -0.139) 1.936 5.216 ( -1.693 1.690 -1.300) 2.723 5.264 ( -0.416 -2.057 1.828) 2.783 5.295 ( 0.309 -0.772 -0.741) 1.114 5.330 ( -1.136 0.105 -0.916) 1.463 5.380 ( -0.283 0.048 1.617) 1.642 5.412 ( 0.057 0.649 -0.392) 0.760 5.496 ( -1.515 1.373 -0.664) 2.150 5.551 ( 1.628 1.572 0.072) 2.264 5.674 ( -0.232 0.937 -0.116) 0.972 5.811 ( -0.469 -0.823 -0.409) 1.032 5.885 ( -0.375 -0.777 -0.612) 1.058 5.908 ( -1.849 2.942 2.041) 4.030 6.073 ( -1.152 3.223 0.124) 3.425 6.184 ( 0.492 -2.780 -0.366) 2.847 6.344 ( -2.363 -0.075 0.102) 2.367 ======================= Grid point 4 (5/140) ======================= q-point: ( 0.31 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( 1.496 -13.507 0.639) 13.604 1.541 ( -2.533 -13.733 -0.797) 13.987 1.625 ( -1.541 -9.729 -1.351) 9.942 1.771 ( -1.525 -6.965 -2.640) 7.603 1.829 ( 2.448 -6.773 4.033) 8.254 1.894 ( 0.037 -0.954 3.170) 3.311 2.023 ( -1.233 -4.702 -0.388) 4.877 2.065 ( -4.723 -2.141 0.581) 5.218 2.133 ( -0.572 0.150 -1.535) 1.645 2.202 ( -3.483 -0.580 -2.310) 4.219 2.267 ( -3.220 -4.633 5.250) 7.706 2.301 ( -6.882 0.070 0.116) 6.883 2.445 ( -1.215 -1.374 -4.958) 5.287 2.490 ( 3.673 -2.302 3.128) 5.346 2.516 ( 3.346 -0.524 0.165) 3.391 2.643 ( -0.683 -2.455 -3.818) 4.590 2.743 ( -0.210 -2.394 -2.107) 3.196 2.779 ( 0.154 -2.450 3.323) 4.131 2.884 ( 2.640 -1.366 4.112) 5.074 2.989 ( 1.361 -5.887 -0.939) 6.115 3.064 ( -0.078 0.896 -1.259) 1.547 3.143 ( 0.669 -2.964 -3.564) 4.683 3.193 ( 0.376 2.049 0.537) 2.151 3.264 ( 1.896 -4.767 -1.237) 5.277 3.339 ( -2.010 -1.900 -0.877) 2.901 3.410 ( -0.294 -4.285 -0.403) 4.314 3.593 ( 0.465 -2.765 -0.153) 2.808 3.718 ( 0.970 -9.089 -0.978) 9.193 3.823 ( 3.037 -4.735 -1.472) 5.815 3.934 ( 2.244 1.293 2.014) 3.281 3.999 ( 3.051 -3.117 5.591) 7.091 4.311 ( 1.336 -3.631 -0.434) 3.893 4.380 ( 1.339 -1.578 1.635) 2.638 4.421 ( 1.982 0.174 -0.499) 2.051 4.525 ( 0.205 -1.663 0.251) 1.694 4.606 ( -1.499 1.154 0.220) 1.904 4.671 ( -0.450 0.044 -0.984) 1.083 4.754 ( 0.515 -1.915 -2.066) 2.863 4.786 ( 0.930 0.947 -0.842) 1.572 4.852 ( 0.826 1.393 3.888) 4.212 4.925 ( -2.187 0.229 -3.028) 3.742 5.058 ( -1.109 -2.291 0.051) 2.546 5.174 ( -1.915 0.740 -0.203) 2.063 5.287 ( -1.592 -1.807 0.498) 2.459 5.316 ( -1.373 0.294 -0.576) 1.518 5.351 ( 0.055 -3.292 0.586) 3.344 5.373 ( -1.582 -0.199 0.108) 1.598 5.431 ( 0.162 -2.349 -0.074) 2.356 5.475 ( -0.520 0.247 -1.294) 1.416 5.540 ( 0.695 0.285 0.486) 0.895 5.645 ( -0.226 1.860 0.131) 1.879 5.806 ( -0.833 1.174 -0.950) 1.725 5.846 ( -1.928 2.090 2.584) 3.842 5.892 ( -0.424 0.426 -0.352) 0.697 5.999 ( -1.590 3.614 -0.611) 3.995 6.222 ( -0.146 -0.897 -0.079) 0.912 6.327 ( -1.389 0.637 -0.044) 1.529 ======================= Grid point 5 (6/140) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( 0.188 -9.854 -0.187) 9.857 1.697 ( 0.419 -5.169 -2.124) 5.604 1.781 ( -3.729 -6.433 1.322) 7.552 1.877 ( -0.751 -3.959 1.772) 4.402 1.898 ( -1.805 -0.240 0.811) 1.993 1.956 ( 1.061 -4.739 0.588) 4.891 2.019 ( -2.742 1.993 1.553) 3.728 2.065 ( -2.445 1.515 0.944) 3.027 2.157 ( -3.715 0.922 -2.362) 4.498 2.170 ( -0.990 -3.333 -0.571) 3.523 2.252 ( -2.014 0.293 1.956) 2.823 2.353 ( -2.795 -4.009 -0.988) 4.986 2.427 ( 0.045 0.411 -0.666) 0.784 2.475 ( -0.593 2.141 -3.010) 3.741 2.562 ( 2.427 -0.447 1.011) 2.667 2.714 ( 0.798 -5.080 -2.413) 5.680 2.741 ( 1.060 1.719 -0.682) 2.132 2.813 ( -0.930 0.005 4.696) 4.788 2.910 ( 0.799 1.767 2.941) 3.523 3.007 ( 0.285 3.464 -1.994) 4.007 3.042 ( -1.107 -2.534 -4.377) 5.177 3.103 ( -0.895 3.334 1.582) 3.797 3.182 ( 5.285 0.686 0.666) 5.370 3.281 ( -1.681 1.683 -3.119) 3.923 3.472 ( 1.384 -9.255 0.087) 9.359 3.548 ( -1.125 -6.958 0.176) 7.051 3.637 ( -0.077 -1.491 0.413) 1.549 3.830 ( 1.814 -1.093 -0.755) 2.248 3.928 ( 3.012 1.580 2.416) 4.172 3.991 ( 0.158 -8.840 -0.936) 8.891 4.114 ( 3.830 -8.497 3.182) 9.848 4.359 ( 0.268 -1.451 -0.420) 1.534 4.423 ( 2.565 -1.181 0.827) 2.942 4.430 ( 1.080 -0.211 0.012) 1.101 4.536 ( -0.467 -0.318 -1.287) 1.405 4.601 ( -1.305 -0.993 0.736) 1.797 4.689 ( -0.001 -2.053 -0.778) 2.196 4.765 ( 0.606 -0.121 -0.971) 1.151 4.806 ( -0.031 -1.648 -1.507) 2.234 4.848 ( 1.019 0.791 2.234) 2.580 4.900 ( -2.164 -0.310 -0.604) 2.268 5.076 ( 0.470 0.587 0.161) 0.769 5.169 ( -1.528 -0.589 -0.062) 1.639 5.279 ( -3.008 0.136 0.246) 3.021 5.350 ( -1.613 -1.098 0.412) 1.994 5.370 ( -0.354 -3.429 -0.036) 3.448 5.420 ( -0.643 -3.064 -0.102) 3.132 5.461 ( 0.170 0.111 -1.233) 1.249 5.487 ( 1.006 -1.776 -0.270) 2.059 5.551 ( -0.058 -1.070 0.439) 1.158 5.606 ( -0.254 1.942 0.387) 1.997 5.764 ( -0.747 1.992 -0.928) 2.321 5.810 ( -1.081 1.593 2.234) 2.949 5.862 ( -0.908 2.364 -0.132) 2.536 5.926 ( -1.391 2.646 -1.034) 3.163 6.217 ( -0.618 0.895 0.032) 1.088 6.307 ( -0.412 0.862 -0.062) 0.958 ======================= Grid point 6 (7/140) ======================= q-point: ( 0.46 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.749 ( 0.585 -1.472 -0.143) 1.590 1.783 ( -1.110 -4.398 -0.892) 4.623 1.837 ( -0.299 -1.775 -0.105) 1.803 1.875 ( -0.372 -0.001 0.946) 1.017 1.919 ( -1.640 1.154 0.903) 2.199 1.951 ( -2.124 0.933 0.789) 2.451 2.006 ( 0.115 1.858 -0.541) 1.939 2.058 ( -0.504 -2.695 2.857) 3.960 2.102 ( -0.919 1.540 -2.655) 3.204 2.246 ( -0.984 -2.207 0.351) 2.442 2.254 ( 0.219 -1.374 1.148) 1.803 2.392 ( -0.075 2.321 -1.111) 2.574 2.414 ( -2.699 -3.906 -2.816) 5.521 2.448 ( 1.576 1.168 -0.257) 1.978 2.589 ( 1.294 -1.008 1.069) 1.958 2.713 ( 0.722 0.542 -0.544) 1.054 2.770 ( -1.507 2.684 1.244) 3.320 2.804 ( -0.474 -3.160 -0.780) 3.289 2.856 ( 1.402 3.688 1.228) 4.132 2.955 ( 0.612 1.640 0.195) 1.762 3.067 ( -0.740 0.694 3.039) 3.204 3.087 ( -0.291 -2.687 -4.589) 5.326 3.212 ( 2.821 -0.344 1.576) 3.250 3.240 ( -1.255 0.974 -1.596) 2.252 3.597 ( 0.810 -3.671 -0.780) 3.840 3.623 ( -0.212 -1.458 0.095) 1.477 3.643 ( -0.683 0.946 0.912) 1.481 3.856 ( -0.385 -2.069 -1.058) 2.356 3.895 ( 1.728 2.793 1.557) 3.634 4.093 ( -0.353 -2.862 -0.279) 2.898 4.316 ( 2.529 -5.800 0.990) 6.404 4.387 ( 0.845 -2.230 0.563) 2.450 4.435 ( -0.134 0.070 -0.084) 0.173 4.450 ( 1.026 -0.146 0.148) 1.047 4.520 ( -1.318 0.906 -1.366) 2.103 4.629 ( 1.770 -1.383 2.417) 3.300 4.710 ( -1.912 0.045 -2.293) 2.986 4.784 ( 1.198 -0.507 0.295) 1.334 4.798 ( -1.506 -0.176 -2.832) 3.212 4.854 ( 0.277 -0.511 2.431) 2.499 4.932 ( -0.324 -2.671 0.237) 2.700 5.035 ( 0.790 3.423 -0.173) 3.518 5.166 ( -0.797 0.118 0.174) 0.824 5.285 ( -1.314 -1.977 -0.119) 2.377 5.330 ( -0.793 1.503 0.388) 1.743 5.450 ( 0.153 0.013 -0.468) 0.493 5.454 ( -0.077 -2.223 0.049) 2.225 5.479 ( 0.096 -4.278 -0.306) 4.290 5.510 ( 0.256 -0.363 -0.384) 0.587 5.558 ( -0.201 1.637 0.639) 1.769 5.573 ( -0.053 1.176 0.107) 1.182 5.738 ( -0.080 0.012 -0.557) 0.563 5.784 ( -0.238 0.911 1.094) 1.443 5.807 ( -0.842 2.057 -0.191) 2.231 5.887 ( -0.464 0.888 -0.426) 1.089 6.195 ( -0.348 0.707 0.019) 0.789 6.292 ( -0.041 0.498 -0.017) 0.500 ======================= Grid point 14 (8/140) ======================= q-point: ( 0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.187 ( 17.337 -0.000 -0.823) 17.356 0.264 ( 21.872 -0.000 5.317) 22.509 0.420 ( 33.896 -0.000 12.207) 36.027 1.011 ( 3.454 -0.000 -3.593) 4.984 1.013 ( 7.969 -0.000 -0.233) 7.972 1.442 ( -3.329 0.000 -4.764) 5.812 1.512 ( 1.645 -0.000 3.276) 3.666 1.763 ( -5.064 0.000 2.936) 5.853 1.834 ( -2.785 0.000 -4.806) 5.554 1.921 ( 1.308 -0.000 3.834) 4.051 1.962 ( 2.692 -0.000 -0.471) 2.732 2.034 ( -1.362 0.000 -0.630) 1.501 2.094 ( 1.936 -0.000 1.885) 2.702 2.351 ( -2.812 0.000 0.273) 2.825 2.482 ( -0.254 0.000 0.006) 0.254 2.544 ( -2.477 0.000 -6.245) 6.718 2.551 ( 2.643 -0.000 -6.697) 7.200 2.601 ( 0.674 -0.000 -3.881) 3.939 2.677 ( 3.063 -0.000 5.908) 6.655 2.747 ( 0.382 -0.000 0.006) 0.382 2.865 ( 0.135 -0.000 5.308) 5.310 3.049 ( -4.612 0.000 -3.142) 5.580 3.180 ( 4.883 -0.000 -8.514) 9.815 3.231 ( -0.433 0.000 -0.345) 0.554 3.242 ( -0.254 0.000 0.340) 0.424 3.303 ( -3.343 0.000 0.056) 3.343 3.361 ( -0.755 0.000 -1.072) 1.312 3.385 ( 2.986 -0.000 -1.445) 3.317 3.680 ( 1.223 -0.000 1.602) 2.015 3.862 ( 0.031 -0.000 -0.006) 0.032 4.024 ( -0.103 0.000 -0.069) 0.124 4.033 ( -0.038 0.000 0.074) 0.083 4.109 ( -0.303 0.000 -6.023) 6.030 4.254 ( 2.450 -0.000 4.144) 4.814 4.303 ( -0.571 0.000 -0.009) 0.571 4.387 ( -0.111 0.000 0.007) 0.111 4.627 ( -5.407 0.000 0.024) 5.407 4.727 ( 2.813 -0.000 -0.617) 2.880 4.811 ( -0.488 0.000 -0.203) 0.528 4.988 ( -2.135 0.000 -2.311) 3.146 5.086 ( -0.013 0.000 1.841) 1.841 5.159 ( -3.046 0.000 10.515) 10.947 5.259 ( -0.963 0.000 4.146) 4.256 5.280 ( 0.551 -0.000 3.124) 3.172 5.343 ( 4.921 -0.000 -16.433) 17.154 5.395 ( 0.273 -0.000 1.570) 1.594 5.419 ( 0.790 -0.000 1.664) 1.841 5.635 ( 0.441 -0.000 -1.425) 1.491 5.649 ( 0.182 -0.000 -0.025) 0.184 5.651 ( 0.206 -0.000 0.026) 0.208 5.720 ( -0.179 0.000 -0.872) 0.890 5.847 ( 4.502 -0.000 -11.892) 12.716 5.858 ( -0.487 0.000 -0.002) 0.487 5.898 ( 0.491 -0.000 0.001) 0.491 5.949 ( -3.957 0.000 7.895) 8.831 6.155 ( -5.530 0.000 13.269) 14.376 6.248 ( 1.303 -0.000 1.287) 1.831 ======================= Grid point 15 (9/140) ======================= q-point: ( 0.15 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.442 ( 7.511 -16.386 1.047) 18.056 0.494 ( 12.162 -13.356 4.657) 18.654 0.993 ( 20.216 -28.198 5.276) 35.095 1.075 ( 5.326 -5.109 -1.674) 7.567 1.216 ( 8.447 -13.957 -2.178) 16.459 1.451 ( -3.698 -4.416 -4.853) 7.532 1.525 ( 2.657 -0.559 3.170) 4.174 1.787 ( -5.149 -3.689 2.390) 6.770 1.878 ( -2.610 -6.173 -4.491) 8.067 1.989 ( 1.249 -5.754 2.280) 6.314 2.014 ( -0.041 -4.166 2.643) 4.933 2.088 ( -1.693 -4.896 0.488) 5.203 2.137 ( 1.740 -4.376 1.157) 4.849 2.297 ( -2.513 2.945 0.072) 3.872 2.486 ( 0.279 -0.053 -0.568) 0.635 2.509 ( -1.836 -0.580 -4.899) 5.263 2.553 ( 2.235 -1.140 -8.153) 8.530 2.597 ( -0.223 -0.634 0.378) 0.771 2.711 ( 3.059 -0.585 6.725) 7.411 2.833 ( -0.638 -0.446 3.789) 3.868 2.844 ( -1.147 -4.012 0.764) 4.242 3.008 ( -3.348 0.564 -3.097) 4.596 3.148 ( 1.832 0.272 0.808) 2.021 3.234 ( -0.512 0.334 0.547) 0.821 3.310 ( -1.461 -1.996 -3.825) 4.555 3.343 ( 0.906 -4.841 -2.140) 5.370 3.370 ( -0.265 -3.492 -3.285) 4.801 3.377 ( -1.079 -0.768 4.218) 4.421 3.672 ( 2.190 1.309 1.347) 2.886 4.019 ( 0.109 -7.858 0.691) 7.889 4.055 ( 0.742 -0.489 0.396) 0.973 4.072 ( -1.347 -1.970 -1.316) 2.726 4.130 ( -1.396 0.734 -0.128) 1.582 4.282 ( -0.736 -2.878 0.647) 3.040 4.396 ( -0.716 -2.422 -0.823) 2.656 4.494 ( -6.713 -12.006 -3.816) 14.275 4.611 ( -4.794 -1.459 -0.994) 5.109 4.743 ( 0.831 -0.445 -0.970) 1.352 4.797 ( 0.336 1.251 0.508) 1.392 4.960 ( -1.166 1.453 -1.973) 2.714 5.052 ( -0.668 3.845 2.244) 4.502 5.174 ( -2.513 -0.489 12.293) 12.557 5.187 ( 6.338 5.032 -6.634) 10.464 5.273 ( 0.886 1.076 -1.202) 1.841 5.316 ( 1.816 0.822 -3.789) 4.281 5.373 ( 0.412 2.361 0.575) 2.465 5.410 ( -0.567 1.132 2.474) 2.779 5.524 ( 5.352 5.431 0.131) 7.626 5.611 ( -0.057 2.818 -0.852) 2.945 5.633 ( 1.219 1.932 -0.264) 2.299 5.693 ( 0.149 0.929 -0.252) 0.974 5.761 ( -0.280 -0.993 -0.545) 1.167 5.854 ( 0.132 0.778 -0.597) 0.990 5.992 ( -2.718 -2.376 1.299) 3.837 6.025 ( 0.620 -1.877 -0.827) 2.142 6.221 ( 0.730 2.771 0.449) 2.900 6.258 ( -7.318 -5.604 2.709) 9.607 ======================= Grid point 16 (10/140) ======================= q-point: ( 0.23 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.814 ( 3.946 -17.968 2.652) 18.586 0.844 ( 4.885 -17.522 1.934) 18.293 1.234 ( 3.592 -9.010 -1.915) 9.887 1.465 ( -1.939 -10.190 -7.739) 12.942 1.576 ( 2.756 -7.031 4.688) 8.889 1.607 ( 7.431 -18.378 2.628) 19.997 1.641 ( 5.804 -16.697 -1.323) 17.726 1.830 ( -2.264 -2.592 4.767) 5.880 1.993 ( -2.452 -7.319 -1.587) 7.880 2.090 ( -2.225 -3.553 3.346) 5.364 2.141 ( 0.406 -8.348 0.212) 8.361 2.150 ( -2.930 -2.505 0.625) 3.905 2.231 ( -0.984 -2.605 0.369) 2.809 2.320 ( 0.279 -7.767 0.181) 7.774 2.488 ( 1.180 -0.325 -2.613) 2.885 2.543 ( 0.654 -4.189 -4.012) 5.837 2.583 ( -0.441 -3.463 -6.408) 7.298 2.635 ( 0.445 -2.665 2.728) 3.839 2.737 ( 1.543 -0.403 4.607) 4.875 2.855 ( 1.662 -3.215 2.161) 4.215 2.901 ( -3.064 -1.532 -2.082) 4.008 3.006 ( -2.359 -2.016 0.002) 3.103 3.182 ( -0.838 -2.121 2.357) 3.280 3.237 ( 2.980 -0.773 -0.986) 3.233 3.296 ( 2.426 1.606 -7.812) 8.337 3.393 ( -4.170 -2.936 0.680) 5.145 3.428 ( -1.516 -4.975 1.507) 5.415 3.505 ( -0.183 -6.548 -1.697) 6.767 3.676 ( 3.542 -0.857 1.824) 4.075 4.016 ( -0.172 4.604 -0.596) 4.646 4.037 ( 1.478 2.304 3.951) 4.807 4.144 ( 0.879 -4.162 -0.418) 4.274 4.220 ( -0.484 -8.027 -0.031) 8.041 4.357 ( 0.261 -4.871 2.254) 5.374 4.435 ( 2.021 -1.287 -0.364) 2.423 4.624 ( -2.800 -3.608 -1.663) 4.861 4.642 ( -1.979 -5.480 -0.825) 5.884 4.731 ( -1.194 1.701 -0.097) 2.081 4.785 ( 1.394 0.209 -0.461) 1.483 4.916 ( -1.393 1.973 -1.235) 2.712 4.978 ( -0.607 2.970 0.898) 3.161 5.093 ( -0.232 5.915 -0.027) 5.920 5.210 ( 0.204 -1.578 -0.128) 1.596 5.247 ( -0.684 0.995 0.557) 1.329 5.306 ( 0.900 0.876 -1.795) 2.191 5.334 ( -0.449 1.332 -0.579) 1.520 5.388 ( -0.994 0.931 2.475) 2.825 5.464 ( 2.643 3.776 -0.129) 4.611 5.536 ( -1.146 3.781 -0.610) 3.998 5.600 ( 2.202 2.296 -0.517) 3.223 5.683 ( -0.049 0.411 -0.213) 0.465 5.782 ( -0.864 -1.584 -0.776) 1.964 5.862 ( 0.051 -1.140 -0.614) 1.296 5.959 ( -2.496 2.792 2.722) 4.629 6.089 ( -0.256 -2.511 0.352) 2.548 6.167 ( 0.749 2.303 -0.757) 2.537 6.303 ( -4.783 -2.542 0.930) 5.496 ======================= Grid point 17 (11/140) ======================= q-point: ( 0.31 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.153 ( 4.529 -14.715 2.619) 15.617 1.205 ( -1.151 -18.457 1.355) 18.543 1.430 ( 1.100 -10.126 -2.213) 10.423 1.597 ( -4.070 -8.647 -6.291) 11.442 1.723 ( 4.219 -6.917 3.681) 8.899 1.868 ( -1.179 -5.050 4.211) 6.680 1.887 ( 2.224 -6.702 -0.086) 7.062 1.945 ( -5.009 -8.299 -0.126) 9.695 2.094 ( -4.309 -4.194 -0.853) 6.073 2.151 ( -1.727 -4.097 6.137) 7.578 2.172 ( -0.940 -1.900 -1.871) 2.827 2.256 ( -4.361 -1.847 0.601) 4.774 2.330 ( -0.839 -8.093 -1.255) 8.232 2.454 ( 4.483 -4.757 2.105) 6.867 2.509 ( 1.308 -2.329 -4.646) 5.359 2.622 ( -0.045 -1.908 -2.528) 3.168 2.660 ( 1.169 -3.419 -1.303) 3.841 2.703 ( 1.312 -5.983 2.682) 6.687 2.849 ( 3.772 -9.125 1.627) 10.007 2.883 ( -0.771 -0.395 1.743) 1.947 2.979 ( -1.230 -6.857 -2.988) 7.580 3.045 ( -0.547 -3.689 -0.566) 3.773 3.209 ( -1.980 -1.192 3.262) 3.998 3.249 ( 1.074 0.539 -9.657) 9.732 3.285 ( 2.933 0.155 1.139) 3.150 3.408 ( -2.381 0.095 0.456) 2.426 3.533 ( 0.593 -5.690 1.009) 5.809 3.571 ( -0.488 -3.785 -2.536) 4.582 3.773 ( 4.027 -5.018 0.353) 6.444 3.944 ( 0.571 1.507 0.502) 1.688 4.022 ( 2.715 1.505 5.427) 6.252 4.239 ( 2.584 -4.631 0.476) 5.325 4.333 ( -0.145 -4.365 0.069) 4.368 4.436 ( 1.317 -1.061 -0.839) 1.888 4.484 ( 2.765 -2.874 3.571) 5.353 4.657 ( -0.381 1.968 -0.379) 2.040 4.666 ( -0.853 0.330 -0.977) 1.338 4.710 ( -0.471 -1.431 -1.009) 1.813 4.801 ( 0.631 -0.826 -1.459) 1.792 4.877 ( -1.898 0.877 0.405) 2.130 4.939 ( 0.123 2.199 -1.251) 2.533 5.003 ( -2.807 0.066 -0.203) 2.815 5.192 ( -1.884 1.877 -0.866) 2.797 5.262 ( -1.253 -0.552 1.526) 2.050 5.296 ( 0.556 -1.572 -0.675) 1.799 5.315 ( -0.968 0.501 -0.799) 1.352 5.383 ( -0.404 0.103 1.768) 1.816 5.409 ( -0.325 1.751 -0.480) 1.844 5.477 ( -1.196 1.310 -1.137) 2.107 5.570 ( 1.757 1.878 0.083) 2.573 5.669 ( -0.396 0.923 -0.234) 1.032 5.802 ( -0.821 -0.848 -0.603) 1.325 5.875 ( -1.492 0.447 0.496) 1.635 5.897 ( -1.446 1.841 1.929) 3.034 6.059 ( -1.487 3.560 -0.119) 3.860 6.188 ( 0.447 -2.475 -0.600) 2.586 6.314 ( -3.080 -0.929 0.291) 3.230 ======================= Grid point 18 (12/140) ======================= q-point: ( 0.38 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.429 ( 2.202 -11.939 1.462) 12.228 1.514 ( -2.126 -14.113 0.456) 14.280 1.604 ( -1.304 -8.601 -1.270) 8.791 1.741 ( -2.155 -8.756 -2.088) 9.256 1.871 ( 1.661 -4.670 0.755) 5.014 1.903 ( -0.201 -0.831 5.330) 5.398 1.998 ( -4.323 -4.574 -0.037) 6.294 2.011 ( -3.303 -2.938 -0.474) 4.446 2.117 ( -1.379 -0.578 -2.027) 2.518 2.156 ( -3.346 0.425 -1.756) 3.803 2.226 ( -6.530 -2.214 0.083) 6.896 2.266 ( -1.609 -3.103 6.567) 7.439 2.401 ( -2.458 -1.794 -5.170) 5.999 2.546 ( 3.277 1.770 2.272) 4.363 2.558 ( 4.208 -2.336 1.421) 5.019 2.620 ( -1.108 -2.237 -2.906) 3.831 2.728 ( 1.026 -2.867 -4.848) 5.725 2.806 ( 1.198 -2.021 4.718) 5.271 2.915 ( -0.045 -1.912 2.114) 2.851 2.986 ( 0.107 -1.649 -1.444) 2.195 3.072 ( 1.436 -1.942 0.904) 2.579 3.138 ( 0.948 -1.788 -4.232) 4.691 3.195 ( 0.240 -0.589 -1.461) 1.593 3.272 ( 0.379 -3.061 -2.195) 3.785 3.318 ( -1.085 -3.717 0.299) 3.883 3.402 ( -0.870 -4.218 -0.392) 4.325 3.601 ( 0.771 -2.321 0.362) 2.472 3.741 ( 3.287 -10.740 0.439) 11.240 3.868 ( 4.998 -3.345 0.805) 6.068 3.956 ( 0.945 -0.722 0.743) 1.403 4.044 ( 2.118 -1.626 3.431) 4.348 4.332 ( 2.148 -2.820 0.755) 3.624 4.402 ( 1.765 -2.720 0.527) 3.285 4.441 ( 1.889 0.690 -0.386) 2.048 4.528 ( -0.031 -0.218 0.515) 0.560 4.590 ( -1.301 1.863 0.316) 2.294 4.669 ( 0.575 -0.536 -0.268) 0.830 4.743 ( -0.886 -1.984 -3.446) 4.074 4.798 ( 1.495 0.521 0.075) 1.585 4.872 ( -0.366 -0.303 3.869) 3.898 4.889 ( -1.572 1.688 -3.012) 3.794 5.044 ( -1.105 -3.389 -0.446) 3.592 5.153 ( -1.771 0.422 0.022) 1.821 5.262 ( -3.137 -0.692 0.411) 3.238 5.301 ( -1.103 -0.529 -0.422) 1.294 5.352 ( -2.218 0.754 0.304) 2.362 5.355 ( 0.171 -3.345 0.484) 3.384 5.434 ( 0.282 -2.512 -0.109) 2.530 5.464 ( -0.338 -0.603 -1.759) 1.890 5.550 ( 0.738 0.926 0.575) 1.317 5.642 ( -0.408 1.709 0.099) 1.760 5.790 ( -1.504 1.328 -0.724) 2.133 5.835 ( -1.812 1.538 2.872) 3.728 5.885 ( -0.588 0.564 -0.417) 0.915 5.977 ( -1.862 3.720 -0.953) 4.268 6.219 ( -0.323 -0.583 -0.080) 0.671 6.311 ( -1.455 -0.143 -0.019) 1.462 ======================= Grid point 19 (13/140) ======================= q-point: ( 0.46 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.636 ( 0.126 -8.959 0.284) 8.964 1.697 ( 0.906 -5.798 -1.863) 6.157 1.744 ( -3.722 -7.144 1.246) 8.151 1.871 ( -1.297 -5.259 0.416) 5.433 1.873 ( -3.091 0.175 1.467) 3.426 1.965 ( -0.133 -0.307 -0.825) 0.890 1.994 ( -3.228 -1.335 3.057) 4.642 2.045 ( -1.635 0.641 2.361) 2.943 2.122 ( -1.356 1.003 -1.607) 2.330 2.147 ( -2.223 -5.133 -3.141) 6.416 2.241 ( -0.998 -0.800 1.562) 2.018 2.314 ( -2.779 -3.751 -2.409) 5.253 2.422 ( -0.271 -1.700 0.018) 1.721 2.485 ( 2.804 4.309 0.710) 5.190 2.594 ( 2.060 0.035 1.140) 2.354 2.694 ( -2.624 -5.023 -2.222) 6.087 2.747 ( 1.484 0.930 -2.392) 2.965 2.825 ( -0.866 1.721 4.928) 5.292 2.923 ( -0.223 1.248 1.875) 2.263 2.991 ( 0.774 -0.490 -4.342) 4.437 3.040 ( 1.064 2.690 -0.634) 2.961 3.099 ( -1.050 2.906 2.202) 3.794 3.234 ( 1.632 -0.516 -4.241) 4.573 3.249 ( 0.405 0.849 -0.217) 0.965 3.484 ( 0.582 -8.647 0.033) 8.667 3.533 ( -1.376 -7.460 -0.110) 7.586 3.637 ( -0.222 -1.081 0.802) 1.364 3.862 ( 3.928 0.995 1.164) 4.216 3.963 ( 2.339 1.088 0.331) 2.601 3.996 ( 1.308 -6.036 -0.224) 6.180 4.161 ( 2.683 -10.152 2.035) 10.696 4.366 ( 0.993 -0.658 0.766) 1.416 4.434 ( 0.011 0.385 -0.480) 0.615 4.457 ( 2.846 -1.249 0.389) 3.133 4.522 ( -1.103 0.462 -0.670) 1.371 4.600 ( 0.356 -2.497 1.519) 2.944 4.688 ( 0.078 -0.903 -0.885) 1.267 4.752 ( -1.373 -1.119 -3.495) 3.918 4.804 ( 0.736 0.438 -0.410) 0.950 4.855 ( -0.156 0.353 0.123) 0.405 4.893 ( -0.408 -1.292 2.606) 2.937 5.081 ( 0.581 -0.077 -0.252) 0.638 5.151 ( -1.522 -0.784 -0.157) 1.719 5.244 ( -3.455 -0.498 0.215) 3.498 5.328 ( -2.524 -1.008 0.422) 2.750 5.368 ( -0.055 -4.335 -0.067) 4.336 5.416 ( -0.302 -2.882 0.263) 2.909 5.456 ( -0.035 -0.330 -1.695) 1.728 5.498 ( 1.150 -1.543 -0.249) 1.940 5.552 ( -0.229 -1.018 0.523) 1.168 5.604 ( -0.425 1.935 0.363) 2.014 5.753 ( -0.656 1.423 -0.565) 1.666 5.803 ( -1.566 1.428 1.965) 2.890 5.852 ( -0.792 2.498 -0.156) 2.626 5.907 ( -1.239 2.093 -1.115) 2.676 6.210 ( -0.724 0.888 0.029) 1.146 6.303 ( -0.323 0.489 -0.040) 0.588 ======================= Grid point 20 (14/140) ======================= q-point: ( 0.54 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.752 ( 0.168 -0.899 -0.412) 1.003 1.767 ( -1.240 -4.771 -0.734) 4.984 1.837 ( 0.875 -3.656 -1.174) 3.939 1.877 ( -0.361 0.087 0.640) 0.740 1.903 ( -1.451 -0.172 1.756) 2.284 1.940 ( -0.693 -1.020 0.225) 1.254 2.004 ( -0.402 1.883 0.029) 1.926 2.064 ( -0.493 -3.338 3.096) 4.580 2.084 ( -0.498 1.186 -2.783) 3.066 2.234 ( -1.464 -3.067 -0.300) 3.412 2.266 ( 0.984 -2.187 0.906) 2.564 2.356 ( -1.815 -0.675 -3.191) 3.733 2.414 ( 0.714 -0.355 1.466) 1.668 2.480 ( 3.717 0.450 1.100) 3.902 2.610 ( 1.363 0.302 1.414) 1.987 2.714 ( -1.106 -0.626 -1.344) 1.850 2.739 ( -3.223 0.091 -2.397) 4.018 2.784 ( -2.678 0.022 3.003) 4.024 2.865 ( 0.139 3.747 0.327) 3.764 2.961 ( 0.021 2.067 1.180) 2.380 3.054 ( -0.244 -0.511 -4.497) 4.533 3.089 ( 0.313 -1.709 3.092) 3.546 3.206 ( -2.200 -1.249 -4.132) 4.845 3.265 ( 4.243 2.068 1.685) 5.012 3.599 ( -0.076 -3.776 -0.508) 3.811 3.620 ( -0.359 -1.680 0.069) 1.720 3.638 ( -0.635 0.863 1.055) 1.504 3.858 ( 1.436 0.000 -0.276) 1.462 3.917 ( 1.412 3.023 0.544) 3.381 4.104 ( 2.238 -2.566 0.076) 3.406 4.324 ( -0.879 -3.294 -0.375) 3.430 4.403 ( 0.234 -1.891 0.718) 2.036 4.427 ( -0.667 0.047 -0.816) 1.055 4.471 ( 2.393 1.215 1.547) 3.098 4.510 ( -0.013 -0.433 0.407) 0.594 4.630 ( -2.408 0.370 -1.729) 2.988 4.705 ( 1.758 -1.741 1.760) 3.036 4.779 ( -0.192 -1.342 -2.125) 2.521 4.794 ( 0.755 -0.442 -0.742) 1.148 4.860 ( -0.717 0.358 1.831) 1.998 4.924 ( -1.021 -2.359 -0.138) 2.574 5.046 ( 1.226 3.506 0.022) 3.715 5.157 ( -0.904 -0.650 -0.070) 1.116 5.271 ( -1.092 -3.294 -0.141) 3.473 5.322 ( -0.930 0.439 0.328) 1.080 5.450 ( 0.131 -0.484 -0.705) 0.865 5.454 ( -0.058 -1.473 0.292) 1.503 5.479 ( 0.089 -4.839 -0.219) 4.844 5.513 ( 0.459 -0.151 -0.049) 0.485 5.556 ( -0.281 1.976 0.046) 1.996 5.572 ( -0.347 0.944 0.383) 1.076 5.735 ( -0.065 -0.154 -0.487) 0.515 5.783 ( -0.478 0.171 0.965) 1.090 5.800 ( -0.388 1.834 -0.106) 1.877 5.880 ( -0.396 0.236 -0.460) 0.651 6.192 ( -0.318 0.353 0.014) 0.476 6.292 ( -0.015 0.433 0.002) 0.433 ======================= Grid point 21 (15/140) ======================= q-point: (-0.38 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.743 ( -0.613 1.659 0.052) 1.770 1.797 ( 0.751 4.621 0.924) 4.772 1.839 ( 0.423 -0.817 -1.744) 1.971 1.881 ( 0.887 0.098 0.138) 0.903 1.931 ( 1.293 -0.632 -0.257) 1.462 1.975 ( 2.368 -2.252 -1.548) 3.616 2.009 ( 0.060 -1.509 1.716) 2.286 2.052 ( 0.257 1.317 -2.760) 3.069 2.123 ( 1.195 -2.850 2.517) 3.986 2.255 ( 1.273 0.370 -1.586) 2.067 2.257 ( 1.322 3.132 -0.121) 3.402 2.380 ( -1.499 -2.673 -0.040) 3.065 2.437 ( 0.378 0.650 0.752) 1.063 2.476 ( 3.179 0.595 4.488) 5.533 2.577 ( -0.209 2.632 -0.299) 2.657 2.708 ( -0.322 -0.283 -0.369) 0.565 2.766 ( -5.170 -0.317 -0.396) 5.195 2.781 ( -0.716 -1.811 -1.048) 2.212 2.837 ( -0.775 -2.815 -0.388) 2.945 2.948 ( -0.966 -0.948 0.868) 1.608 3.056 ( 0.518 -1.302 -5.232) 5.416 3.107 ( -0.839 -0.501 5.241) 5.331 3.203 ( 1.808 6.204 0.055) 6.462 3.251 ( 0.405 -2.997 -0.429) 3.055 3.589 ( -1.079 3.731 0.704) 3.947 3.624 ( -0.004 1.358 0.059) 1.359 3.643 ( 0.086 -1.064 -0.719) 1.287 3.869 ( 0.933 2.867 1.112) 3.214 3.874 ( -0.511 -1.102 -1.880) 2.238 4.110 ( 2.060 2.881 0.047) 3.542 4.272 ( -4.071 8.101 -0.753) 9.097 4.383 ( -0.199 0.543 -0.151) 0.597 4.427 ( -1.209 0.462 -0.608) 1.430 4.443 ( -0.490 2.389 0.364) 2.465 4.539 ( 0.500 -0.694 1.349) 1.598 4.609 ( 0.247 -0.365 -1.048) 1.137 4.733 ( 0.581 1.188 1.375) 1.908 4.771 ( -0.669 0.779 -0.307) 1.072 4.831 ( 2.262 -0.948 2.666) 3.623 4.835 ( -1.405 0.687 -2.480) 2.932 4.933 ( 0.271 2.187 -0.065) 2.204 5.028 ( -0.662 -2.656 -0.171) 2.742 5.173 ( 0.626 -0.884 -0.283) 1.119 5.300 ( 1.279 0.788 0.104) 1.506 5.336 ( 0.404 -2.322 -0.372) 2.386 5.450 ( 0.026 0.394 -0.107) 0.409 5.455 ( -0.003 1.706 0.434) 1.760 5.479 ( -0.179 3.735 0.308) 3.752 5.511 ( 0.024 1.054 0.691) 1.260 5.555 ( -0.088 -1.006 -1.129) 1.515 5.573 ( -0.045 -1.906 0.160) 1.913 5.742 ( 0.270 -0.412 0.739) 0.888 5.780 ( -0.211 -1.072 -1.238) 1.651 5.819 ( 0.998 -2.446 0.246) 2.653 5.893 ( 0.442 -1.583 0.312) 1.672 6.199 ( 0.295 -1.028 -0.022) 1.070 6.293 ( 0.057 -0.575 0.033) 0.579 ======================= Grid point 22 (16/140) ======================= q-point: (-0.31 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.633 ( -0.070 10.508 0.343) 10.513 1.702 ( -0.113 4.251 1.886) 4.652 1.812 ( 2.758 5.792 -1.277) 6.541 1.873 ( -0.150 1.836 -1.954) 2.685 1.908 ( 0.686 2.959 -0.619) 3.100 1.946 ( -0.420 6.062 -0.165) 6.079 2.040 ( 1.683 -2.566 -0.529) 3.114 2.081 ( 0.958 -2.097 -0.336) 2.329 2.176 ( 0.335 3.223 -0.489) 3.277 2.216 ( 4.459 -1.860 3.342) 5.875 2.272 ( 3.590 -1.608 -2.993) 4.943 2.381 ( 1.985 2.369 0.295) 3.104 2.429 ( 0.427 -0.472 0.561) 0.848 2.495 ( -0.611 0.299 2.650) 2.736 2.542 ( -0.779 1.198 0.045) 1.430 2.697 ( -3.182 2.119 3.293) 5.046 2.731 ( -0.491 -1.515 -1.826) 2.423 2.817 ( 2.182 -0.026 -2.717) 3.485 2.888 ( -1.161 -0.956 -2.615) 3.017 2.992 ( -2.489 -3.552 -0.004) 4.337 3.074 ( -0.141 3.211 1.380) 3.497 3.114 ( 2.097 -2.083 1.403) 3.272 3.139 ( -2.011 -2.264 1.603) 3.426 3.303 ( 0.989 -2.204 1.043) 2.632 3.456 ( -1.494 9.968 -0.069) 10.079 3.555 ( 0.539 6.441 -0.475) 6.481 3.635 ( -0.268 1.629 -0.036) 1.651 3.826 ( -0.031 2.328 1.884) 2.995 3.884 ( -2.618 -1.058 -3.444) 4.454 3.998 ( 0.330 12.148 1.891) 12.299 4.061 ( -3.200 6.441 -3.512) 8.004 4.360 ( -0.060 2.428 0.685) 2.524 4.396 ( -1.734 0.879 -0.550) 2.020 4.415 ( -1.464 0.479 -0.399) 1.591 4.542 ( 0.012 0.268 0.655) 0.708 4.618 ( 1.675 0.583 0.204) 1.785 4.695 ( 0.554 2.058 0.621) 2.220 4.761 ( -0.389 -0.206 0.810) 0.922 4.807 ( -0.683 2.908 0.949) 3.134 4.821 ( -1.643 -0.295 -3.294) 3.692 4.936 ( 2.840 -0.787 2.488) 3.857 5.068 ( -0.686 -1.356 -0.817) 1.725 5.183 ( 1.119 0.319 -0.019) 1.164 5.306 ( 2.161 -0.508 -0.190) 2.228 5.359 ( 0.430 2.228 -0.081) 2.270 5.375 ( 0.463 1.949 -0.212) 2.014 5.430 ( 1.001 3.010 0.339) 3.190 5.462 ( -0.248 -0.091 0.490) 0.556 5.478 ( -0.890 1.543 0.333) 1.812 5.550 ( -0.018 1.059 -0.291) 1.099 5.607 ( 0.103 -1.923 -0.299) 1.949 5.776 ( 0.664 -2.280 1.227) 2.673 5.810 ( 0.516 -2.069 -2.095) 2.989 5.872 ( 0.678 -2.077 0.059) 2.186 5.944 ( 1.121 -3.076 0.695) 3.347 6.223 ( 0.399 -0.846 -0.027) 0.936 6.312 ( 0.364 -1.239 0.064) 1.292 ======================= Grid point 23 (17/140) ======================= q-point: (-0.23 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.391 ( -0.732 14.389 -0.189) 14.409 1.569 ( 1.667 12.876 0.953) 13.018 1.644 ( 0.978 10.336 1.024) 10.433 1.782 ( -1.492 8.022 1.533) 8.302 1.811 ( 1.920 5.181 -2.452) 6.045 1.876 ( -1.204 1.801 -2.236) 3.113 2.033 ( 0.474 5.471 -0.057) 5.492 2.098 ( 1.768 0.466 -0.625) 1.932 2.142 ( 0.219 -0.601 1.041) 1.222 2.247 ( 3.517 1.143 0.991) 3.828 2.297 ( 4.427 4.723 -2.493) 6.937 2.360 ( 2.997 0.428 0.128) 3.030 2.435 ( -3.264 3.752 0.099) 4.974 2.459 ( -1.732 2.608 -0.249) 3.141 2.505 ( 0.701 -0.222 2.097) 2.222 2.665 ( 0.428 2.067 4.507) 4.977 2.728 ( -0.962 1.321 -4.464) 4.754 2.790 ( 1.882 3.738 -0.587) 4.226 2.843 ( -2.449 1.410 -1.086) 3.027 2.965 ( -2.453 7.857 -0.601) 8.253 3.073 ( 0.262 -1.752 1.142) 2.107 3.152 ( -0.512 1.851 3.662) 4.135 3.187 ( 0.653 -2.386 -2.380) 3.433 3.245 ( -1.982 5.499 0.839) 5.905 3.361 ( 1.208 1.215 0.550) 1.800 3.412 ( 0.028 4.351 0.191) 4.355 3.592 ( -0.063 2.363 0.508) 2.417 3.725 ( 1.047 7.293 1.834) 7.593 3.817 ( -0.251 7.467 4.229) 8.585 3.895 ( -2.836 -2.695 -2.787) 4.803 3.939 ( -3.206 3.529 -6.447) 8.018 4.306 ( -0.255 3.362 0.843) 3.475 4.364 ( -0.474 1.668 -1.220) 2.120 4.402 ( -1.699 -0.088 0.175) 1.710 4.524 ( 0.008 2.584 -0.077) 2.585 4.618 ( 0.894 -0.515 -0.237) 1.058 4.681 ( 0.533 0.147 0.820) 0.989 4.753 ( -0.631 1.493 0.939) 1.873 4.786 ( -0.077 -1.148 2.200) 2.483 4.827 ( -0.991 -2.322 -3.774) 4.540 4.954 ( 1.267 0.683 1.990) 2.456 5.067 ( 0.583 1.336 -0.346) 1.499 5.193 ( 1.279 -1.207 0.271) 1.779 5.296 ( 0.458 2.296 -0.227) 2.352 5.333 ( 1.174 -0.638 0.378) 1.389 5.349 ( 0.007 3.437 -0.444) 3.466 5.384 ( 0.582 1.060 -0.046) 1.210 5.431 ( 0.067 1.803 0.076) 1.806 5.484 ( 0.390 -0.991 0.610) 1.227 5.532 ( -0.475 0.371 -0.273) 0.662 5.646 ( 0.093 -1.978 -0.090) 1.982 5.815 ( 0.320 -0.860 0.555) 1.072 5.856 ( 1.258 -2.760 -1.421) 3.349 5.897 ( 0.215 -0.316 0.216) 0.439 6.015 ( 0.901 -3.463 0.256) 3.587 6.223 ( 0.047 1.114 0.050) 1.116 6.340 ( 0.849 -1.197 0.042) 1.468 ======================= Grid point 24 (18/140) ======================= q-point: (-0.15 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.087 ( -0.857 17.047 -0.239) 17.071 1.254 ( 1.507 19.757 0.163) 19.815 1.440 ( 0.331 12.285 0.693) 12.309 1.619 ( -1.676 7.270 0.272) 7.465 1.701 ( 0.990 8.496 0.393) 8.563 1.837 ( -0.519 1.685 -0.124) 1.767 1.861 ( -0.021 11.350 -1.895) 11.507 2.013 ( 0.913 18.481 -0.035) 18.504 2.138 ( 0.271 2.473 -0.893) 2.643 2.171 ( -0.280 2.808 0.933) 2.973 2.216 ( 5.013 5.330 -0.453) 7.332 2.284 ( -0.825 5.115 0.226) 5.186 2.293 ( -4.084 5.857 -0.867) 7.193 2.423 ( 0.992 2.649 -0.000) 2.829 2.521 ( 0.030 1.192 1.494) 1.912 2.619 ( 0.224 3.631 0.160) 3.642 2.667 ( -0.128 3.282 -1.524) 3.621 2.706 ( 0.553 5.215 3.951) 6.566 2.760 ( -1.690 5.989 -2.766) 6.810 2.857 ( -0.658 -0.681 -1.022) 1.393 3.001 ( -0.418 8.112 1.275) 8.222 3.109 ( 3.364 0.940 0.766) 3.576 3.183 ( -2.835 2.070 -1.775) 3.934 3.250 ( 2.325 2.440 -3.011) 4.520 3.269 ( -2.476 -1.439 4.918) 5.691 3.444 ( 0.622 -0.988 0.224) 1.189 3.564 ( 2.149 1.304 1.637) 3.000 3.623 ( 1.440 6.312 1.720) 6.699 3.660 ( -3.872 6.862 -2.421) 8.243 3.906 ( -0.547 -3.061 -1.021) 3.273 3.954 ( -1.111 -4.024 -1.321) 4.379 4.237 ( 0.714 4.112 1.137) 4.325 4.318 ( -0.569 2.689 -1.088) 2.956 4.403 ( -1.007 -0.670 0.164) 1.220 4.433 ( -0.352 6.409 -0.629) 6.449 4.648 ( -0.300 -1.995 -0.109) 2.020 4.687 ( 0.149 -0.604 0.141) 0.638 4.723 ( 0.299 1.576 0.225) 1.620 4.789 ( -0.506 0.946 0.315) 1.118 4.908 ( 0.573 -4.999 -0.045) 5.032 4.950 ( 0.197 -0.113 0.464) 0.517 5.045 ( 0.647 0.086 0.015) 0.652 5.235 ( 0.721 -1.741 0.955) 2.113 5.260 ( 0.070 2.719 -1.114) 2.939 5.294 ( -0.146 0.688 0.299) 0.764 5.343 ( 0.556 0.148 0.532) 0.784 5.377 ( 0.062 -0.317 -0.837) 0.897 5.412 ( -0.084 0.328 0.192) 0.389 5.514 ( 1.498 -1.642 0.257) 2.238 5.534 ( -1.496 -1.274 -0.081) 1.967 5.676 ( 0.076 -0.938 0.034) 0.942 5.816 ( 0.158 0.726 0.133) 0.755 5.889 ( 0.024 1.119 0.260) 1.149 5.918 ( 0.801 -3.163 -0.697) 3.337 6.082 ( 0.473 -3.258 -0.095) 3.294 6.181 ( -0.253 3.192 0.115) 3.204 6.362 ( 0.898 -0.504 -0.010) 1.030 ======================= Grid point 25 (19/140) ======================= q-point: (-0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.741 ( -0.000 18.875 -0.000) 18.875 0.859 ( -0.000 22.034 -0.000) 22.034 1.207 ( -0.000 11.507 -0.000) 11.507 1.410 ( -0.000 28.459 -0.000) 28.459 1.499 ( -0.000 22.343 -0.000) 22.343 1.509 ( -0.000 3.650 -0.000) 3.650 1.651 ( -0.000 9.925 -0.000) 9.925 1.838 ( 0.000 -0.372 0.000) 0.372 2.058 ( -0.000 5.599 -0.000) 5.599 2.090 ( -0.000 8.492 -0.000) 8.492 2.134 ( -0.000 3.049 -0.000) 3.049 2.175 ( -0.000 8.286 -0.000) 8.286 2.247 ( 0.000 -2.719 0.000) 2.719 2.302 ( -0.000 9.967 -0.000) 9.967 2.484 ( -0.000 1.221 -0.000) 1.221 2.567 ( -0.000 1.649 -0.000) 1.649 2.603 ( -0.000 3.081 -0.000) 3.081 2.659 ( -0.000 3.587 -0.000) 3.587 2.660 ( -0.000 1.390 -0.000) 1.390 2.816 ( -0.000 2.403 -0.000) 2.403 2.963 ( 0.000 -0.838 0.000) 0.838 3.058 ( -0.000 5.078 -0.000) 5.078 3.123 ( -0.000 1.449 -0.000) 1.449 3.242 ( 0.000 -0.632 0.000) 0.632 3.295 ( 0.000 -1.090 0.000) 1.090 3.417 ( -0.000 3.862 -0.000) 3.862 3.472 ( -0.000 6.317 -0.000) 6.317 3.520 ( -0.000 7.522 -0.000) 7.522 3.605 ( 0.000 -2.558 0.000) 2.558 4.001 ( 0.000 -5.775 0.000) 5.775 4.021 ( 0.000 -2.911 0.000) 2.911 4.161 ( -0.000 4.169 -0.000) 4.169 4.226 ( -0.000 7.924 -0.000) 7.924 4.319 ( -0.000 3.669 -0.000) 3.669 4.407 ( -0.000 0.122 -0.000) 0.122 4.672 ( 0.000 -0.810 0.000) 0.810 4.697 ( -0.000 1.169 -0.000) 1.169 4.715 ( 0.000 -0.993 0.000) 0.993 4.767 ( -0.000 0.142 -0.000) 0.142 4.961 ( 0.000 -1.026 0.000) 1.026 4.967 ( 0.000 -1.661 0.000) 1.661 5.096 ( 0.000 -3.429 0.000) 3.429 5.204 ( -0.000 2.428 -0.000) 2.428 5.259 ( 0.000 -0.548 0.000) 0.548 5.298 ( 0.000 -0.453 0.000) 0.453 5.344 ( 0.000 -0.409 0.000) 0.409 5.408 ( -0.000 0.069 -0.000) 0.069 5.409 ( 0.000 -2.875 0.000) 2.875 5.564 ( 0.000 -2.696 0.000) 2.696 5.567 ( 0.000 -2.863 0.000) 2.863 5.683 ( 0.000 -0.131 0.000) 0.131 5.797 ( -0.000 1.310 -0.000) 1.310 5.863 ( -0.000 1.348 -0.000) 1.348 5.979 ( 0.000 -2.994 0.000) 2.994 6.104 ( -0.000 4.637 -0.000) 4.637 6.146 ( 0.000 -3.273 0.000) 3.273 6.365 ( -0.000 0.497 -0.000) 0.497 ======================= Grid point 28 (20/140) ======================= q-point: ( 0.15 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.373 ( 17.146 -0.000 -0.769) 17.163 0.513 ( 20.029 -0.000 4.868) 20.612 0.828 ( 32.063 -0.000 11.871) 34.189 1.049 ( 6.611 -0.000 -5.494) 8.596 1.129 ( 12.926 -0.000 -0.511) 12.936 1.378 ( -3.680 0.000 -6.453) 7.428 1.553 ( 2.510 -0.000 5.364) 5.923 1.708 ( -6.434 0.000 2.126) 6.776 1.784 ( -2.733 0.000 -4.921) 5.629 1.941 ( -0.193 0.000 2.773) 2.780 1.992 ( 1.938 -0.000 1.945) 2.746 2.011 ( -2.073 0.000 -0.827) 2.232 2.123 ( 0.900 -0.000 3.063) 3.193 2.313 ( -3.707 0.000 -0.492) 3.739 2.478 ( -0.513 0.000 0.008) 0.513 2.480 ( -3.556 0.000 -7.142) 7.978 2.552 ( 3.014 -0.000 -9.674) 10.132 2.602 ( -0.107 0.000 1.352) 1.356 2.739 ( 4.270 -0.000 4.970) 6.553 2.752 ( 0.550 -0.000 -0.001) 0.550 2.885 ( -1.730 0.000 6.852) 7.067 2.988 ( -3.705 0.000 -3.516) 5.107 3.179 ( -1.015 0.000 -2.884) 3.057 3.224 ( -0.641 0.000 -0.251) 0.688 3.239 ( -0.527 0.000 0.250) 0.583 3.273 ( -1.234 0.000 -2.282) 2.594 3.345 ( -2.349 0.000 2.303) 3.290 3.411 ( 3.904 -0.000 -4.857) 6.232 3.709 ( 2.255 -0.000 2.756) 3.561 3.862 ( 0.046 -0.000 -0.008) 0.046 4.022 ( -0.183 0.000 -0.120) 0.219 4.033 ( -0.061 0.000 0.126) 0.140 4.096 ( 0.484 -0.000 0.459) 0.667 4.282 ( 0.019 -0.000 1.360) 1.361 4.295 ( -0.841 0.000 -0.013) 0.841 4.385 ( -0.371 0.000 0.011) 0.371 4.568 ( -5.106 0.000 -1.096) 5.223 4.735 ( -0.553 0.000 -1.689) 1.777 4.811 ( 0.451 -0.000 1.188) 1.270 4.966 ( -0.302 0.000 -1.519) 1.549 5.083 ( -1.291 0.000 0.467) 1.373 5.170 ( 0.351 -0.000 2.876) 2.897 5.268 ( 0.391 -0.000 1.807) 1.849 5.294 ( 0.117 -0.000 1.196) 1.202 5.333 ( 1.895 -0.000 -8.892) 9.092 5.408 ( 0.669 -0.000 2.809) 2.888 5.439 ( 1.410 -0.000 2.492) 2.864 5.636 ( 0.974 -0.000 -2.566) 2.745 5.651 ( 0.327 -0.000 -0.036) 0.329 5.654 ( 0.357 -0.000 0.038) 0.359 5.714 ( -0.110 0.000 -1.374) 1.378 5.851 ( 2.645 -0.000 -6.815) 7.310 5.852 ( -0.655 0.000 -0.003) 0.655 5.904 ( 0.663 -0.000 0.001) 0.663 5.932 ( -3.508 0.000 4.992) 6.101 6.147 ( -3.157 0.000 8.246) 8.830 6.268 ( 1.212 -0.000 1.346) 1.811 ======================= Grid point 29 (21/140) ======================= q-point: ( 0.23 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.559 ( 12.380 -10.566 0.426) 16.281 0.686 ( 17.655 -6.837 7.030) 20.195 1.124 ( 6.713 -6.443 -2.987) 9.772 1.219 ( 14.499 -13.243 -1.044) 19.665 1.332 ( 13.156 -14.405 2.184) 19.630 1.400 ( -0.618 -6.160 -3.087) 6.917 1.573 ( 2.956 -0.824 4.123) 5.140 1.743 ( -4.485 -5.162 3.930) 7.887 1.835 ( -1.899 -7.003 -4.357) 8.463 1.997 ( -1.250 -5.540 0.821) 5.739 2.023 ( -0.426 -2.166 2.421) 3.277 2.069 ( -1.928 -5.638 0.916) 6.028 2.150 ( -1.145 -3.227 2.745) 4.389 2.268 ( -2.363 1.637 -0.526) 2.922 2.461 ( -1.765 -1.589 -3.979) 4.634 2.496 ( 0.954 -1.328 -1.733) 2.383 2.544 ( 2.402 0.138 -10.414) 10.689 2.598 ( -0.928 -0.764 2.826) 3.071 2.762 ( 2.646 0.211 2.115) 3.394 2.833 ( -0.260 -4.679 2.306) 5.223 2.841 ( -2.607 1.415 3.491) 4.581 2.965 ( -1.741 -0.325 -2.560) 3.112 3.155 ( -1.093 -0.329 1.454) 1.848 3.245 ( 1.932 -0.087 -0.459) 1.988 3.274 ( -2.199 -2.605 -3.518) 4.899 3.315 ( -3.456 -4.815 0.611) 5.958 3.353 ( -0.335 -2.072 -3.456) 4.043 3.406 ( 2.843 -0.918 0.606) 3.048 3.704 ( 2.489 1.171 1.334) 3.057 4.022 ( -0.194 -10.187 0.709) 10.213 4.058 ( -0.695 -1.077 0.167) 1.293 4.068 ( 0.643 -1.209 1.307) 1.893 4.121 ( -0.084 -0.942 2.332) 2.517 4.249 ( -3.892 -3.561 -3.178) 6.158 4.380 ( -1.267 -4.825 0.652) 5.031 4.460 ( -0.526 -8.099 -0.540) 8.134 4.555 ( -4.594 -1.815 -1.540) 5.174 4.727 ( -2.136 -0.090 -1.855) 2.830 4.813 ( 1.821 0.719 2.039) 2.826 4.949 ( -0.127 1.566 -0.991) 1.858 5.043 ( -1.041 3.214 -0.448) 3.408 5.188 ( 1.015 -0.994 0.598) 1.542 5.222 ( 1.145 5.880 2.106) 6.350 5.272 ( 0.083 1.572 -2.522) 2.973 5.317 ( 0.608 0.492 -2.388) 2.513 5.386 ( 1.413 3.417 1.288) 3.915 5.415 ( -0.609 1.961 3.211) 3.811 5.575 ( 3.875 5.662 -0.600) 6.887 5.606 ( 0.105 3.579 -1.381) 3.838 5.649 ( 2.131 1.158 -0.639) 2.508 5.694 ( 0.261 0.858 -0.466) 1.011 5.756 ( -0.379 0.296 -0.339) 0.588 5.852 ( 0.134 0.574 -0.855) 1.038 5.966 ( -3.160 -1.667 2.611) 4.425 6.029 ( 0.942 -4.105 -1.811) 4.585 6.189 ( -5.175 -3.765 3.327) 7.213 6.242 ( 0.311 2.489 1.491) 2.918 ======================= Grid point 30 (22/140) ======================= q-point: ( 0.31 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.873 ( 6.037 -15.911 2.352) 17.179 0.959 ( 12.016 -11.142 5.794) 17.381 1.274 ( 5.472 -7.192 -3.371) 9.645 1.396 ( -4.618 -7.915 -7.668) 11.949 1.609 ( 0.241 -9.009 4.513) 10.079 1.678 ( 7.210 -11.453 -2.288) 13.726 1.718 ( 3.954 -12.978 2.822) 13.857 1.830 ( -1.169 -4.226 5.998) 7.430 1.967 ( -1.140 -6.646 -1.897) 7.005 2.070 ( -4.159 -3.634 1.820) 5.815 2.124 ( -1.672 -2.729 0.907) 3.326 2.141 ( -0.161 -9.246 -0.311) 9.252 2.221 ( -1.434 -1.734 2.807) 3.597 2.322 ( -0.001 -8.925 -0.152) 8.927 2.492 ( 1.332 -0.806 -2.378) 2.842 2.525 ( -0.717 -3.704 -6.755) 7.738 2.571 ( 1.320 -4.709 -1.499) 5.115 2.650 ( 1.220 -3.672 0.799) 3.951 2.766 ( 1.328 -1.000 1.175) 2.036 2.868 ( -1.159 -2.782 -2.037) 3.638 2.873 ( -1.213 -1.216 4.715) 5.019 2.985 ( -0.909 -2.409 -0.905) 2.729 3.177 ( -1.385 -1.566 2.456) 3.225 3.241 ( 0.859 -0.270 -7.774) 7.826 3.319 ( 4.495 0.129 -1.528) 4.749 3.352 ( -3.634 -3.346 1.253) 5.096 3.404 ( -2.599 -5.296 0.112) 5.900 3.514 ( 2.171 -5.624 -0.556) 6.054 3.710 ( 1.848 -1.253 0.208) 2.242 4.006 ( -1.120 4.027 -0.519) 4.212 4.073 ( 1.818 1.059 4.578) 5.039 4.170 ( 2.925 -4.588 2.473) 5.977 4.217 ( 0.041 -7.528 -0.058) 7.528 4.350 ( -1.797 -6.991 -0.624) 7.245 4.459 ( 1.864 -3.277 1.776) 4.167 4.583 ( -3.292 -3.845 -2.148) 5.499 4.624 ( -1.252 -8.407 -0.983) 8.556 4.703 ( -2.874 0.794 -1.534) 3.354 4.805 ( 2.051 2.041 0.998) 3.061 4.896 ( -2.243 2.712 -0.133) 3.521 4.978 ( 0.817 2.703 -0.759) 2.923 5.087 ( -0.616 7.843 -0.838) 7.912 5.204 ( -0.964 0.307 -1.356) 1.691 5.249 ( 0.295 -0.171 2.200) 2.226 5.307 ( 0.567 1.038 -1.741) 2.105 5.329 ( -0.084 2.256 -0.616) 2.340 5.388 ( -0.749 1.001 2.683) 2.960 5.488 ( 1.682 5.349 -0.158) 5.610 5.523 ( -0.572 4.076 -1.132) 4.269 5.626 ( 2.913 2.504 -0.613) 3.890 5.680 ( -0.226 0.666 -0.425) 0.822 5.769 ( -0.895 -1.694 -0.411) 1.960 5.859 ( -0.242 -0.879 -0.573) 1.076 5.942 ( -2.670 2.486 3.322) 4.934 6.092 ( 0.333 -1.349 0.716) 1.563 6.165 ( -0.105 1.873 -1.994) 2.738 6.256 ( -4.554 -2.983 1.742) 5.716 ======================= Grid point 31 (23/140) ======================= q-point: ( 0.38 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.210 ( 1.925 -16.224 3.145) 16.637 1.234 ( 6.465 -11.116 3.948) 13.451 1.441 ( 2.490 -8.179 -2.377) 8.874 1.527 ( -4.089 -10.327 -5.507) 12.397 1.767 ( 0.676 -7.432 2.178) 7.774 1.876 ( -5.685 -5.387 1.392) 7.955 1.883 ( 1.523 -4.244 2.391) 5.104 1.911 ( 0.436 -4.976 -0.133) 4.997 2.050 ( -2.618 -4.209 -1.408) 5.153 2.112 ( -7.471 -3.895 -1.035) 8.488 2.153 ( -1.375 -0.626 1.190) 1.924 2.241 ( -1.423 -0.763 6.552) 6.748 2.309 ( -1.102 -6.234 -2.581) 6.837 2.491 ( 0.986 -6.750 -3.510) 7.672 2.525 ( 4.095 -3.120 0.941) 5.234 2.603 ( -0.153 -3.544 -4.264) 5.547 2.690 ( 3.122 -1.888 1.371) 3.897 2.729 ( 1.769 -7.002 1.394) 7.355 2.866 ( -2.574 -3.114 0.482) 4.069 2.888 ( 1.857 -7.339 0.600) 7.594 2.960 ( -0.732 -6.155 -0.410) 6.212 3.043 ( 0.740 -4.641 -1.770) 5.022 3.199 ( -1.923 -0.994 3.008) 3.706 3.223 ( 0.836 0.413 -9.359) 9.406 3.316 ( 2.071 1.781 0.455) 2.769 3.384 ( -2.488 -0.613 0.919) 2.723 3.551 ( 2.011 -10.195 0.325) 10.397 3.577 ( 2.569 -0.900 0.215) 2.730 3.803 ( 1.712 -6.504 -1.368) 6.864 3.948 ( -0.053 1.184 1.146) 1.649 4.075 ( 3.115 1.235 4.715) 5.784 4.279 ( 3.254 -4.285 1.952) 5.724 4.333 ( 0.756 -4.972 -0.685) 5.076 4.442 ( 0.566 -2.757 -0.918) 2.961 4.524 ( 1.586 -1.086 3.315) 3.832 4.638 ( -1.927 -3.173 -2.204) 4.317 4.661 ( -0.086 3.203 0.590) 3.258 4.701 ( -0.181 0.169 -1.620) 1.638 4.796 ( -0.352 -2.565 -2.285) 3.453 4.861 ( -1.686 0.091 2.045) 2.652 4.932 ( -0.690 3.921 -2.056) 4.481 4.978 ( -1.158 -0.462 0.203) 1.263 5.170 ( -1.599 1.693 -0.449) 2.371 5.247 ( -1.985 1.350 0.663) 2.491 5.301 ( 0.019 -0.338 -0.720) 0.796 5.306 ( 0.182 -0.882 0.146) 0.913 5.384 ( -0.749 1.488 1.724) 2.397 5.402 ( -0.417 1.473 -0.697) 1.682 5.462 ( -0.738 1.480 -1.360) 2.141 5.591 ( 1.940 2.378 0.060) 3.069 5.663 ( -0.528 0.903 -0.383) 1.114 5.789 ( -1.292 -0.550 -0.436) 1.470 5.861 ( -1.731 1.045 1.844) 2.737 5.889 ( -1.082 1.138 0.955) 1.838 6.041 ( -1.541 4.170 -0.411) 4.465 6.190 ( 0.376 -2.326 -0.709) 2.460 6.281 ( -3.046 -1.796 0.433) 3.562 ======================= Grid point 32 (24/140) ======================= q-point: ( 0.46 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.460 ( 1.817 -9.805 1.879) 10.148 1.505 ( -0.042 -13.318 2.535) 13.557 1.590 ( -0.254 -7.268 -1.002) 7.342 1.712 ( -1.491 -10.350 -2.242) 10.694 1.851 ( -4.301 -1.419 0.446) 4.551 1.907 ( -4.758 -3.082 1.427) 5.846 1.972 ( 1.333 -4.482 1.356) 4.868 1.986 ( -1.932 -2.156 -0.046) 2.896 2.087 ( -2.343 -0.661 -2.146) 3.245 2.124 ( -1.356 -0.127 -0.556) 1.471 2.164 ( -4.475 -4.760 -0.516) 6.554 2.267 ( -2.073 -0.898 3.530) 4.191 2.369 ( -1.189 -2.772 0.277) 3.029 2.562 ( 0.203 -1.049 -4.385) 4.513 2.602 ( 0.659 -0.474 -1.496) 1.702 2.613 ( 2.685 -0.870 2.644) 3.867 2.742 ( 4.312 -1.514 -1.891) 4.945 2.835 ( 0.640 -1.849 4.755) 5.142 2.898 ( -2.246 -1.909 -1.332) 3.235 2.994 ( 0.798 -1.420 0.812) 1.820 3.093 ( 1.075 -2.730 1.918) 3.505 3.130 ( 1.134 -1.847 -6.338) 6.698 3.190 ( -0.051 -1.221 -1.022) 1.593 3.255 ( -1.398 -1.348 -2.414) 3.098 3.320 ( 0.404 -5.540 0.879) 5.624 3.388 ( -1.350 -4.029 -0.135) 4.252 3.612 ( 0.934 -1.626 0.504) 1.942 3.786 ( 3.967 -10.860 1.034) 11.608 3.923 ( 3.845 -4.317 -0.418) 5.796 3.970 ( 1.274 -2.485 2.092) 3.489 4.074 ( 1.715 0.596 1.748) 2.520 4.359 ( 1.879 -1.975 1.461) 3.093 4.420 ( 1.507 -3.560 -1.047) 4.005 4.459 ( 1.733 1.559 -0.128) 2.334 4.526 ( -0.745 0.144 0.995) 1.251 4.589 ( 0.794 1.966 1.106) 2.391 4.673 ( -0.658 -0.995 -1.349) 1.801 4.715 ( -0.852 -1.563 -2.562) 3.119 4.812 ( 0.607 -0.057 -0.689) 0.920 4.850 ( -2.401 0.169 -0.907) 2.572 4.896 ( 1.035 0.379 2.693) 2.910 5.035 ( -0.186 -4.048 -0.573) 4.092 5.136 ( -1.197 0.430 0.037) 1.273 5.226 ( -3.568 0.020 0.259) 3.577 5.283 ( -2.305 -0.444 -0.157) 2.353 5.330 ( -1.507 0.367 -0.100) 1.554 5.361 ( 0.372 -2.795 0.820) 2.936 5.433 ( -0.252 -1.553 -0.649) 1.702 5.458 ( 0.317 -2.133 -1.384) 2.563 5.561 ( 0.716 1.563 0.550) 1.805 5.637 ( -0.582 1.561 0.020) 1.666 5.769 ( -1.782 1.085 -0.198) 2.096 5.828 ( -1.373 1.500 2.411) 3.154 5.877 ( -0.638 0.637 -0.440) 1.003 5.953 ( -1.637 3.689 -1.052) 4.171 6.214 ( -0.515 -0.254 -0.064) 0.578 6.297 ( -1.101 -0.945 -0.002) 1.450 ======================= Grid point 33 (25/140) ======================= q-point: ( 0.54 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( -0.901 -7.837 0.454) 7.902 1.701 ( 0.628 -4.967 -1.056) 5.117 1.720 ( -0.921 -8.634 1.188) 8.764 1.839 ( -3.408 -0.984 0.996) 3.684 1.860 ( -1.120 -6.021 0.193) 6.127 1.939 ( -3.382 2.829 -0.269) 4.418 1.978 ( -1.500 -5.005 1.267) 5.377 2.050 ( 0.176 0.731 3.290) 3.375 2.094 ( -3.509 -3.729 -4.928) 7.107 2.113 ( -0.154 -0.949 -1.297) 1.615 2.246 ( 0.774 -1.484 1.521) 2.261 2.286 ( -0.593 -4.516 -1.270) 4.729 2.424 ( -0.387 -2.266 2.533) 3.421 2.527 ( 3.439 2.955 0.720) 4.591 2.595 ( -2.457 -0.476 -2.049) 3.235 2.661 ( -0.832 -1.720 -0.862) 2.096 2.763 ( 3.224 1.732 -2.170) 4.255 2.825 ( -2.457 2.283 5.346) 6.311 2.924 ( -0.078 0.057 0.400) 0.412 2.995 ( 1.879 0.714 -2.773) 3.425 3.052 ( 1.107 2.526 0.394) 2.786 3.099 ( -0.705 2.811 2.606) 3.898 3.189 ( -2.485 1.832 -7.376) 7.996 3.280 ( 1.712 -2.640 0.800) 3.246 3.486 ( -0.080 -7.987 0.004) 7.987 3.519 ( -1.078 -8.000 -0.059) 8.073 3.639 ( -0.051 -0.682 0.890) 1.122 3.916 ( 4.055 2.052 1.996) 4.964 3.979 ( 0.965 1.620 -0.566) 1.969 4.023 ( 3.557 -5.831 0.335) 6.838 4.183 ( 0.378 -9.709 0.235) 9.719 4.384 ( 1.150 -0.293 1.508) 1.919 4.427 ( -0.624 1.068 -0.965) 1.569 4.479 ( 0.975 -1.937 -1.103) 2.433 4.526 ( 1.860 0.896 2.870) 3.536 4.610 ( -0.089 -1.417 0.110) 1.424 4.674 ( -1.409 -1.589 -1.313) 2.496 4.734 ( 0.489 -1.350 -2.024) 2.481 4.807 ( -0.169 0.584 -1.725) 1.829 4.855 ( -0.151 -1.090 0.931) 1.442 4.898 ( -0.159 0.124 2.088) 2.097 5.088 ( 0.894 -0.578 -0.168) 1.078 5.136 ( -1.100 -0.713 -0.120) 1.316 5.207 ( -3.321 -1.469 0.061) 3.632 5.301 ( -2.515 -1.675 0.274) 3.034 5.368 ( 0.055 -4.717 0.013) 4.717 5.415 ( -0.049 -2.548 0.681) 2.638 5.447 ( -0.258 -0.865 -1.853) 2.061 5.511 ( 1.277 -1.247 -0.286) 1.808 5.550 ( -0.497 -0.881 0.556) 1.154 5.600 ( -0.493 1.865 0.252) 1.945 5.745 ( -0.468 0.740 -0.276) 0.918 5.792 ( -1.550 1.591 1.348) 2.598 5.845 ( -0.501 2.333 -0.072) 2.387 5.892 ( -0.883 1.641 -0.905) 2.071 6.202 ( -0.648 0.808 0.022) 1.036 6.300 ( -0.191 0.219 -0.019) 0.291 ======================= Grid point 34 (26/140) ======================= q-point: ( 0.62 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.750 ( -0.147 -1.022 -1.034) 1.462 1.752 ( -1.050 -5.072 -0.126) 5.181 1.847 ( 1.574 -4.382 -1.175) 4.802 1.869 ( -0.627 2.070 0.317) 2.186 1.908 ( 0.339 -5.311 2.323) 5.807 1.930 ( -1.151 -2.069 -0.597) 2.442 1.999 ( -0.525 1.489 0.268) 1.601 2.068 ( -0.592 0.076 -1.280) 1.413 2.075 ( 0.640 -1.559 1.423) 2.206 2.209 ( -2.453 -5.697 -1.271) 6.332 2.279 ( 0.925 -2.476 0.510) 2.692 2.350 ( 2.291 0.651 -0.698) 2.482 2.429 ( 0.536 -0.255 2.702) 2.767 2.528 ( 3.531 1.416 0.401) 3.826 2.619 ( -2.408 -2.864 0.488) 3.773 2.651 ( -4.129 -0.802 -1.163) 4.364 2.731 ( 1.429 1.663 -2.518) 3.339 2.769 ( -2.606 2.450 3.699) 5.145 2.867 ( 0.155 3.887 -0.072) 3.891 2.964 ( -0.463 2.066 1.417) 2.548 3.038 ( -0.113 0.293 -2.458) 2.478 3.100 ( -0.207 -0.130 0.679) 0.722 3.167 ( -1.487 -4.038 -3.502) 5.548 3.305 ( 2.128 1.575 0.259) 2.660 3.593 ( -0.549 -3.423 0.155) 3.471 3.618 ( 0.016 -2.187 -0.205) 2.197 3.637 ( -0.270 0.836 0.928) 1.278 3.884 ( 2.653 2.040 0.690) 3.417 3.929 ( 0.782 2.702 0.088) 2.815 4.137 ( 3.560 -1.677 -0.265) 3.944 4.305 ( -2.307 -2.805 0.025) 3.632 4.392 ( -1.509 0.630 -0.648) 1.759 4.417 ( -0.683 -0.627 -0.774) 1.208 4.495 ( 1.075 1.323 -0.044) 1.705 4.529 ( 1.388 -0.081 2.642) 2.986 4.599 ( -0.811 -0.097 -0.767) 1.121 4.732 ( 1.114 -1.687 1.712) 2.649 4.778 ( 1.178 -3.115 -1.198) 3.539 4.791 ( -0.537 -0.360 -1.979) 2.081 4.850 ( -1.935 1.442 0.832) 2.552 4.919 ( 0.192 -2.072 0.522) 2.146 5.058 ( 0.777 3.703 0.007) 3.783 5.147 ( -0.758 -1.415 -0.214) 1.620 5.261 ( -0.675 -4.375 -0.125) 4.428 5.314 ( -0.748 -0.595 0.221) 0.981 5.448 ( 0.018 -0.804 -0.425) 0.910 5.455 ( -0.004 -0.840 0.101) 0.846 5.480 ( 0.092 -5.220 -0.083) 5.221 5.520 ( 0.577 -0.304 0.192) 0.680 5.552 ( -0.370 1.883 -0.352) 1.951 5.569 ( -0.423 1.310 0.452) 1.449 5.732 ( -0.142 -0.174 -0.378) 0.440 5.783 ( -0.175 -0.911 0.827) 1.243 5.797 ( -0.215 1.947 -0.145) 1.964 5.875 ( -0.281 -0.264 -0.377) 0.540 6.189 ( -0.220 0.051 0.008) 0.226 6.292 ( 0.002 0.388 0.011) 0.388 ======================= Grid point 35 (27/140) ======================= q-point: (-0.31 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.737 ( -0.359 1.476 0.047) 1.520 1.806 ( 0.328 4.980 0.635) 5.031 1.834 ( 0.143 -2.454 -1.778) 3.034 1.891 ( 0.603 1.238 0.389) 1.431 1.947 ( 1.586 -1.452 0.447) 2.196 1.981 ( -0.258 -1.839 -1.234) 2.229 2.023 ( 0.736 -0.502 2.143) 2.321 2.045 ( 0.463 -0.566 -2.708) 2.805 2.145 ( 1.112 -4.517 1.905) 5.027 2.257 ( 0.093 -0.776 -1.105) 1.354 2.286 ( 3.851 3.932 -0.632) 5.540 2.365 ( -1.171 -3.260 0.375) 3.484 2.447 ( 0.510 0.705 1.083) 1.390 2.507 ( 0.196 0.899 1.392) 1.669 2.586 ( 1.278 2.950 0.742) 3.300 2.683 ( -6.733 -1.851 -0.816) 7.030 2.707 ( -0.001 0.535 0.197) 0.570 2.784 ( 0.658 -4.021 -0.519) 4.108 2.830 ( -0.446 -0.623 -0.133) 0.778 2.939 ( -1.156 -0.194 0.903) 1.479 3.044 ( 0.567 -2.090 -3.684) 4.273 3.110 ( -1.180 -1.001 3.023) 3.396 3.231 ( 1.917 6.048 1.030) 6.427 3.249 ( 0.137 -3.089 -1.421) 3.403 3.580 ( -0.781 3.727 0.448) 3.834 3.623 ( -0.190 1.462 -0.103) 1.478 3.642 ( 0.048 -0.763 -0.250) 0.804 3.870 ( 0.749 0.992 -1.127) 1.678 3.881 ( 0.519 2.813 0.808) 2.973 4.127 ( 1.030 3.328 -1.249) 3.701 4.237 ( -2.065 8.923 1.058) 9.219 4.377 ( -0.626 -0.429 -0.511) 0.915 4.412 ( -1.059 0.817 -0.439) 1.408 4.441 ( -0.206 3.627 0.256) 3.642 4.539 ( -0.504 -0.469 0.011) 0.688 4.627 ( 2.081 -0.972 1.289) 2.634 4.734 ( -0.429 1.261 -0.090) 1.335 4.768 ( -0.231 0.842 0.227) 0.902 4.808 ( -1.463 0.753 -2.348) 2.867 4.859 ( 1.032 -0.015 1.676) 1.969 4.943 ( 1.360 0.192 0.898) 1.641 5.016 ( -1.071 -1.552 -0.791) 2.045 5.178 ( 0.362 -1.460 -0.199) 1.517 5.313 ( 0.946 0.026 0.101) 0.952 5.336 ( -0.032 -2.814 -0.263) 2.826 5.450 ( 0.099 1.014 -0.238) 1.046 5.457 ( 0.003 0.540 0.396) 0.669 5.478 ( -0.202 3.592 0.216) 3.605 5.516 ( 0.231 2.098 0.746) 2.239 5.548 ( -0.317 -1.059 -1.045) 1.521 5.574 ( 0.002 -2.322 0.142) 2.327 5.749 ( 0.464 -0.954 0.975) 1.441 5.771 ( -0.471 -0.907 -1.275) 1.634 5.829 ( 0.630 -2.636 0.171) 2.715 5.898 ( 0.277 -2.158 0.159) 2.182 6.202 ( 0.169 -1.246 -0.016) 1.257 6.293 ( 0.042 -0.642 0.028) 0.644 ======================= Grid point 36 (28/140) ======================= q-point: (-0.23 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( -0.013 10.870 0.156) 10.871 1.707 ( -0.010 3.636 0.793) 3.721 1.832 ( 1.365 5.725 -0.544) 5.910 1.862 ( -0.610 0.482 -0.895) 1.186 1.911 ( 0.203 4.705 -0.183) 4.713 1.944 ( -0.047 6.407 0.014) 6.407 2.051 ( 0.572 -2.925 -0.118) 2.983 2.085 ( 0.107 -2.110 -0.056) 2.113 2.176 ( 0.094 3.206 -0.321) 3.223 2.259 ( 1.182 -0.629 1.699) 2.163 2.308 ( 3.498 -3.341 -1.544) 5.077 2.396 ( 0.429 -0.283 0.261) 0.576 2.443 ( 1.538 -0.029 0.713) 1.696 2.481 ( -1.999 1.412 -0.046) 2.448 2.532 ( -1.071 2.814 -0.058) 3.012 2.692 ( -0.488 -0.480 4.973) 5.019 2.713 ( -0.599 -1.109 -4.109) 4.298 2.833 ( 1.598 -0.839 -0.711) 1.940 2.868 ( -0.870 -1.119 -1.185) 1.848 2.964 ( -1.779 -1.513 -0.095) 2.337 3.066 ( -0.634 1.861 0.122) 1.970 3.122 ( 0.034 -4.766 -0.704) 4.818 3.159 ( 1.269 1.739 2.890) 3.604 3.312 ( 0.326 -2.986 -0.025) 3.004 3.443 ( -0.661 10.692 -0.017) 10.713 3.557 ( 0.059 5.910 -0.313) 5.919 3.632 ( -0.191 1.629 0.055) 1.641 3.835 ( 0.113 1.426 0.979) 1.733 3.853 ( -0.818 1.426 -1.541) 2.253 4.009 ( -0.103 12.113 2.886) 12.453 4.024 ( -1.006 7.151 -3.577) 8.059 4.361 ( -0.080 3.015 0.294) 3.030 4.383 ( -0.480 0.172 -0.113) 0.522 4.400 ( -0.770 0.741 -0.299) 1.109 4.543 ( 0.019 -0.049 0.204) 0.211 4.632 ( 0.653 0.987 0.123) 1.189 4.704 ( 0.446 1.545 0.372) 1.651 4.764 ( 0.171 -0.221 1.126) 1.161 4.794 ( -1.115 -0.290 -2.066) 2.366 4.803 ( -0.336 3.264 0.139) 3.285 4.969 ( 1.377 -0.406 1.438) 2.032 5.057 ( -0.533 -2.220 -0.718) 2.393 5.192 ( 0.413 0.108 -0.018) 0.427 5.323 ( 0.857 -0.684 -0.077) 1.099 5.361 ( 0.010 2.502 0.028) 2.503 5.378 ( 0.127 1.646 -0.130) 1.656 5.443 ( 0.878 3.099 0.338) 3.238 5.458 ( -0.495 0.719 -0.184) 0.892 5.472 ( -0.367 0.364 0.263) 0.580 5.549 ( -0.017 1.034 -0.100) 1.039 5.607 ( 0.023 -1.908 -0.113) 1.911 5.786 ( 0.319 -2.196 0.899) 2.394 5.806 ( 0.091 -2.619 -1.197) 2.881 5.877 ( 0.244 -1.896 0.015) 1.912 5.954 ( 0.429 -3.283 0.239) 3.319 6.225 ( 0.136 -0.800 -0.011) 0.812 6.315 ( 0.147 -1.476 0.028) 1.484 ======================= Grid point 37 (29/140) ======================= q-point: (-0.15 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( -0.000 14.674 -0.000) 14.674 1.580 ( -0.000 12.443 -0.000) 12.443 1.652 ( -0.000 10.488 -0.000) 10.488 1.774 ( -0.000 8.844 -0.000) 8.844 1.823 ( -0.000 3.962 -0.000) 3.962 1.860 ( -0.000 2.379 -0.000) 2.379 2.035 ( -0.000 5.762 -0.000) 5.762 2.105 ( 0.000 -0.056 0.000) 0.056 2.146 ( 0.000 -0.837 0.000) 0.837 2.273 ( 0.000 -0.052 0.000) 0.052 2.326 ( -0.000 4.272 -0.000) 4.272 2.365 ( -0.000 4.100 -0.000) 4.100 2.415 ( -0.000 5.862 -0.000) 5.862 2.451 ( -0.000 0.327 -0.000) 0.327 2.516 ( 0.000 -1.127 0.000) 1.127 2.681 ( -0.000 2.138 -0.000) 2.138 2.708 ( -0.000 1.032 -0.000) 1.032 2.796 ( -0.000 3.872 -0.000) 3.872 2.831 ( -0.000 2.059 -0.000) 2.059 2.947 ( -0.000 7.809 -0.000) 7.809 3.077 ( 0.000 -1.500 0.000) 1.500 3.156 ( 0.000 -0.604 0.000) 0.604 3.189 ( 0.000 -1.243 0.000) 1.243 3.234 ( -0.000 6.589 -0.000) 6.589 3.368 ( -0.000 0.858 -0.000) 0.858 3.413 ( -0.000 4.527 -0.000) 4.527 3.593 ( -0.000 1.938 -0.000) 1.938 3.739 ( -0.000 6.627 -0.000) 6.627 3.832 ( -0.000 10.517 -0.000) 10.517 3.870 ( 0.000 -3.501 0.000) 3.501 3.899 ( -0.000 2.082 -0.000) 2.082 4.307 ( -0.000 2.958 -0.000) 2.958 4.360 ( -0.000 2.010 -0.000) 2.010 4.391 ( 0.000 -0.140 0.000) 0.140 4.524 ( -0.000 2.831 -0.000) 2.831 4.623 ( 0.000 -0.243 0.000) 0.243 4.686 ( -0.000 0.457 -0.000) 0.457 4.751 ( -0.000 1.263 -0.000) 1.263 4.796 ( 0.000 -0.174 0.000) 0.174 4.808 ( 0.000 -3.776 0.000) 3.776 4.965 ( -0.000 1.052 -0.000) 1.052 5.069 ( -0.000 0.950 -0.000) 0.950 5.201 ( 0.000 -1.419 0.000) 1.419 5.298 ( -0.000 2.383 -0.000) 2.383 5.341 ( 0.000 -0.694 0.000) 0.694 5.348 ( -0.000 3.444 -0.000) 3.444 5.387 ( -0.000 1.511 -0.000) 1.511 5.432 ( -0.000 1.513 -0.000) 1.513 5.488 ( 0.000 -1.371 0.000) 1.371 5.529 ( -0.000 0.725 -0.000) 0.725 5.646 ( 0.000 -2.023 0.000) 2.023 5.818 ( 0.000 -0.736 0.000) 0.736 5.860 ( 0.000 -3.024 0.000) 3.024 5.899 ( 0.000 -0.278 0.000) 0.278 6.020 ( 0.000 -3.394 0.000) 3.394 6.223 ( -0.000 1.194 -0.000) 1.194 6.345 ( 0.000 -1.401 0.000) 1.401 ======================= Grid point 42 (30/140) ======================= q-point: ( 0.23 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.555 ( 16.754 -0.000 -0.637) 16.766 0.733 ( 16.707 -0.000 3.957) 17.169 1.114 ( 9.102 -0.000 -5.269) 10.517 1.181 ( 20.199 -0.000 4.550) 20.705 1.271 ( 13.327 -0.000 -0.557) 13.338 1.350 ( 6.153 -0.000 1.143) 6.258 1.600 ( 2.024 -0.000 5.724) 6.072 1.649 ( -5.393 0.000 2.641) 6.005 1.741 ( -1.638 0.000 -4.319) 4.619 1.932 ( -2.651 0.000 0.576) 2.713 1.990 ( -1.444 0.000 0.114) 1.449 2.008 ( -0.268 0.000 0.006) 0.268 2.126 ( -3.293 0.000 6.139) 6.966 2.272 ( -3.475 0.000 -0.807) 3.568 2.433 ( 0.022 -0.000 -4.793) 4.793 2.471 ( -0.751 0.000 0.005) 0.751 2.543 ( 2.876 -0.000 -12.062) 12.400 2.605 ( -0.489 0.000 2.203) 2.257 2.758 ( 0.461 -0.000 -0.010) 0.461 2.800 ( 3.749 -0.000 2.654) 4.593 2.850 ( -6.921 0.000 -0.085) 6.921 2.962 ( -0.030 0.000 0.115) 0.119 3.149 ( -3.067 0.000 0.457) 3.101 3.216 ( -0.671 0.000 -0.049) 0.673 3.233 ( -0.644 0.000 0.056) 0.646 3.259 ( -0.142 0.000 -1.649) 1.655 3.328 ( -2.366 0.000 2.344) 3.331 3.432 ( 3.437 -0.000 -5.107) 6.156 3.743 ( 1.971 -0.000 2.349) 3.066 3.863 ( 0.037 -0.000 -0.004) 0.038 4.019 ( -0.222 0.000 -0.142) 0.264 4.033 ( -0.062 0.000 0.143) 0.156 4.129 ( 3.089 -0.000 6.523) 7.218 4.254 ( -4.694 0.000 -2.828) 5.480 4.286 ( -0.759 0.000 -0.012) 0.759 4.379 ( -0.709 0.000 0.010) 0.709 4.509 ( -4.570 0.000 -1.144) 4.711 4.713 ( -1.428 0.000 -2.169) 2.597 4.835 ( 2.497 -0.000 3.102) 3.982 4.962 ( -0.447 0.000 -0.880) 0.987 5.068 ( -0.519 0.000 -1.615) 1.697 5.187 ( 1.401 -0.000 0.486) 1.483 5.280 ( 0.125 -0.000 2.180) 2.184 5.282 ( -0.983 0.000 -4.727) 4.829 5.321 ( 0.219 -0.000 -2.481) 2.491 5.429 ( 0.630 -0.000 3.721) 3.774 5.465 ( 1.529 -0.000 2.186) 2.668 5.637 ( 1.270 -0.000 -3.242) 3.482 5.655 ( 0.396 -0.000 -0.038) 0.398 5.659 ( 0.423 -0.000 0.040) 0.425 5.708 ( 0.109 -0.000 -1.242) 1.247 5.845 ( -0.630 0.000 -0.003) 0.630 5.852 ( 1.738 -0.000 -5.576) 5.840 5.911 ( 0.640 -0.000 0.000) 0.640 5.915 ( -2.818 0.000 4.922) 5.672 6.150 ( -1.465 0.000 6.635) 6.795 6.282 ( 0.622 -0.000 0.487) 0.790 ======================= Grid point 43 (31/140) ======================= q-point: ( 0.31 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.704 ( 13.497 -7.206 0.421) 15.306 0.906 ( 17.023 -6.146 6.044) 19.081 1.193 ( 8.276 -4.469 -3.290) 9.964 1.254 ( -0.451 -3.012 -9.454) 9.933 1.447 ( 6.926 -7.910 4.669) 11.503 1.512 ( 12.712 -8.746 5.221) 16.289 1.612 ( 1.709 -2.521 2.823) 4.153 1.733 ( -0.130 -6.317 5.219) 8.195 1.811 ( 0.422 -7.987 -3.594) 8.768 1.973 ( -2.863 -5.815 -0.102) 6.483 2.012 ( -2.104 -1.328 -1.420) 2.864 2.056 ( -1.179 -5.647 1.024) 5.859 2.137 ( -3.623 -3.156 6.059) 7.733 2.243 ( -2.231 -0.002 0.297) 2.251 2.441 ( 0.512 -1.361 -2.551) 2.936 2.502 ( 1.464 -2.140 -1.992) 3.270 2.526 ( 1.482 0.363 -9.941) 10.057 2.601 ( 0.181 -1.031 1.870) 2.143 2.772 ( -1.248 1.024 -2.675) 3.125 2.803 ( -3.438 -2.102 -0.717) 4.093 2.855 ( 0.965 -2.558 4.798) 5.523 2.954 ( 0.147 0.169 -0.079) 0.238 3.143 ( -1.974 -1.222 2.158) 3.170 3.227 ( -1.725 -0.108 -5.431) 5.700 3.269 ( 0.422 -3.813 -0.096) 3.838 3.291 ( -1.420 -2.345 1.999) 3.393 3.342 ( -0.102 -3.336 -1.062) 3.502 3.433 ( 2.160 -0.892 -1.298) 2.673 3.732 ( 1.880 1.469 0.615) 2.464 4.018 ( -0.901 -10.835 0.428) 10.881 4.052 ( -1.106 -1.191 -0.627) 1.742 4.068 ( -0.509 -1.978 0.336) 2.070 4.164 ( 3.789 -0.494 7.887) 8.764 4.187 ( -4.479 -3.698 -3.729) 6.902 4.374 ( -0.782 -5.942 1.602) 6.203 4.447 ( -1.431 -7.023 -1.800) 7.390 4.504 ( -3.656 -2.090 -0.535) 4.245 4.697 ( -1.560 0.532 -2.062) 2.639 4.852 ( 3.148 0.717 3.549) 4.798 4.934 ( -2.262 2.150 -1.411) 3.425 5.037 ( 0.959 2.627 -1.986) 3.430 5.198 ( 0.210 -0.249 -0.060) 0.331 5.221 ( -0.328 5.083 -5.269) 7.329 5.268 ( -0.224 1.305 2.711) 3.018 5.314 ( 0.056 0.309 -0.929) 0.980 5.410 ( 1.531 5.220 0.908) 5.515 5.419 ( -0.644 1.726 3.480) 3.937 5.597 ( 0.776 3.588 -1.842) 4.107 5.609 ( 1.474 5.307 -0.488) 5.530 5.671 ( 2.238 -0.149 -1.113) 2.504 5.694 ( 0.078 0.943 -0.536) 1.087 5.755 ( 0.606 1.796 0.086) 1.897 5.851 ( 0.266 0.442 -0.953) 1.084 5.944 ( -2.927 -1.475 3.165) 4.556 6.029 ( 0.375 -5.851 -2.175) 6.254 6.161 ( -2.845 -1.176 4.983) 5.857 6.247 ( 0.074 3.294 -0.167) 3.299 ======================= Grid point 44 (32/140) ======================= q-point: ( 0.38 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.961 ( 8.133 -12.566 2.145) 15.121 1.135 ( 15.041 -6.754 7.210) 17.996 1.317 ( -3.839 -7.287 -7.203) 10.941 1.327 ( 5.935 -5.865 -2.891) 8.831 1.620 ( -0.912 -7.376 3.292) 8.128 1.722 ( 0.328 -9.223 0.427) 9.238 1.749 ( 1.441 -7.888 1.146) 8.100 1.853 ( 0.862 -4.563 6.022) 7.605 1.951 ( -0.384 -5.676 -2.912) 6.390 2.007 ( -6.513 -1.905 -2.307) 7.167 2.120 ( -0.605 -2.597 1.320) 2.976 2.138 ( -0.254 -9.833 -1.231) 9.913 2.228 ( -0.487 -3.173 7.063) 7.758 2.322 ( 0.590 -9.174 -0.924) 9.239 2.485 ( -2.485 -5.172 -2.212) 6.150 2.500 ( 1.852 -0.917 -4.308) 4.778 2.593 ( 3.397 -5.187 -1.263) 6.328 2.669 ( 1.903 -4.054 -0.200) 4.483 2.764 ( -1.804 -2.232 -1.950) 3.470 2.842 ( -2.013 -3.111 -2.505) 4.473 2.886 ( 0.157 -0.477 6.462) 6.481 2.979 ( 0.343 -2.434 -1.247) 2.756 3.169 ( -1.528 -1.294 1.857) 2.731 3.215 ( 0.001 -0.634 -7.152) 7.180 3.322 ( -1.725 -2.556 -0.509) 3.125 3.366 ( 3.425 -0.179 0.842) 3.531 3.389 ( 0.114 -6.776 0.349) 6.786 3.537 ( 1.946 -6.740 -0.023) 7.016 3.719 ( 0.363 -0.320 -0.622) 0.788 3.986 ( -2.195 2.650 -0.627) 3.498 4.105 ( 1.022 -0.745 3.069) 3.319 4.208 ( 1.560 -6.615 1.703) 7.006 4.236 ( 3.110 -4.589 2.852) 6.234 4.324 ( -1.817 -8.963 -1.068) 9.207 4.482 ( 0.238 -4.639 2.692) 5.369 4.542 ( -2.503 -4.442 -1.565) 5.334 4.598 ( -2.267 -8.941 -1.976) 9.433 4.673 ( -1.143 0.282 -1.264) 1.728 4.830 ( 1.114 5.099 -0.028) 5.220 4.869 ( -2.081 1.220 1.355) 2.767 4.988 ( 1.719 2.531 -1.679) 3.490 5.071 ( -1.388 8.490 -1.816) 8.793 5.183 ( -1.727 1.119 -1.316) 2.443 5.266 ( 0.743 -0.284 3.089) 3.189 5.305 ( 0.214 0.861 -1.411) 1.667 5.328 ( 0.652 3.325 -1.130) 3.572 5.390 ( -0.751 1.183 2.593) 2.948 5.498 ( 0.551 6.286 -0.704) 6.349 5.517 ( 0.147 4.485 -0.826) 4.562 5.658 ( 3.243 2.880 -0.625) 4.382 5.675 ( -0.169 0.840 -0.816) 1.183 5.760 ( -0.801 -1.411 0.304) 1.651 5.853 ( -0.470 -0.552 -0.306) 0.787 5.926 ( -2.436 2.158 2.944) 4.388 6.101 ( 0.534 0.080 1.164) 1.283 6.152 ( -0.612 0.390 -2.452) 2.557 6.218 ( -3.487 -2.144 1.589) 4.391 ======================= Grid point 45 (33/140) ======================= q-point: ( 0.46 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( 3.370 -13.371 2.870) 14.085 1.334 ( 6.997 -6.864 4.882) 10.950 1.460 ( 1.242 -7.488 -0.915) 7.645 1.486 ( 2.183 -10.447 -4.562) 11.607 1.745 ( -5.321 -6.584 0.280) 8.470 1.816 ( -6.045 -3.272 3.289) 7.620 1.899 ( 0.650 -6.634 -3.055) 7.332 1.924 ( 0.228 -2.026 2.462) 3.197 2.022 ( -7.344 -4.697 -0.046) 8.718 2.034 ( 1.203 -3.899 -2.861) 4.984 2.136 ( -2.146 0.524 -0.428) 2.250 2.234 ( -2.456 -2.403 1.216) 3.645 2.313 ( 0.460 -3.087 5.850) 6.631 2.477 ( 0.059 -5.736 -5.255) 7.779 2.572 ( 2.984 -4.816 1.410) 5.838 2.598 ( 2.013 -3.742 -2.679) 5.023 2.725 ( 2.629 -4.086 -0.440) 4.878 2.751 ( 1.768 -6.952 0.154) 7.175 2.837 ( -3.393 -4.608 2.090) 6.093 2.887 ( -1.871 -6.028 -0.295) 6.318 2.963 ( 1.211 -5.580 -0.170) 5.712 3.045 ( 0.907 -5.401 -1.649) 5.719 3.190 ( -1.909 -0.747 3.299) 3.883 3.199 ( 0.776 0.011 -7.913) 7.951 3.334 ( 1.238 2.342 -0.134) 2.653 3.363 ( -1.864 -0.514 1.054) 2.202 3.582 ( 4.052 -7.864 -1.349) 8.949 3.621 ( 3.793 -3.436 2.992) 5.929 3.800 ( -0.906 -7.965 -2.259) 8.329 3.955 ( 0.248 0.055 1.939) 1.955 4.117 ( 1.504 0.819 2.788) 3.272 4.316 ( 2.655 -3.761 1.756) 4.928 4.347 ( 1.573 -4.727 -0.776) 5.042 4.450 ( 1.437 -4.400 0.500) 4.656 4.534 ( -1.338 -0.181 1.339) 1.901 4.602 ( -2.584 -2.779 -2.648) 4.627 4.672 ( 0.862 -1.559 1.444) 2.293 4.696 ( 0.387 4.174 -1.324) 4.396 4.772 ( -2.032 -4.317 -2.987) 5.629 4.860 ( -0.333 -0.302 3.425) 3.455 4.910 ( -1.455 4.206 -1.492) 4.694 4.979 ( 0.906 -0.320 -0.498) 1.082 5.153 ( -1.336 0.858 -0.357) 1.628 5.228 ( -1.779 3.193 0.247) 3.663 5.292 ( -0.700 1.547 -0.502) 1.771 5.316 ( 0.952 -2.016 0.521) 2.290 5.378 ( -1.113 4.556 0.846) 4.766 5.398 ( 0.047 -0.873 -0.257) 0.911 5.450 ( -0.470 1.838 -1.204) 2.247 5.613 ( 1.975 3.042 0.043) 3.627 5.656 ( -0.511 0.945 -0.520) 1.193 5.771 ( -1.674 -0.044 0.050) 1.675 5.852 ( -1.087 0.882 2.080) 2.507 5.880 ( -0.997 0.924 0.152) 1.368 6.024 ( -1.239 4.770 -0.467) 4.950 6.191 ( 0.305 -2.063 -0.661) 2.188 6.253 ( -2.419 -2.664 0.432) 3.624 ======================= Grid point 46 (34/140) ======================= q-point: ( 0.54 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.476 ( 0.315 -8.748 1.208) 8.836 1.533 ( 1.957 -10.590 4.209) 11.563 1.593 ( 1.411 -6.047 -0.652) 6.244 1.697 ( 0.633 -10.383 -2.018) 10.597 1.795 ( -5.711 -2.208 0.647) 6.157 1.850 ( -5.323 -4.826 0.684) 7.218 1.956 ( -3.275 -0.863 -2.334) 4.113 1.978 ( -0.534 -3.224 -2.328) 4.013 2.067 ( -1.124 -0.249 2.946) 3.163 2.113 ( -1.453 -0.932 -2.194) 2.792 2.140 ( 1.673 -7.495 0.605) 7.703 2.254 ( -0.986 -0.570 -0.197) 1.156 2.372 ( -1.339 -2.802 7.264) 7.900 2.525 ( -1.876 -1.386 -7.808) 8.149 2.613 ( 2.050 1.011 -1.613) 2.798 2.639 ( 1.042 -1.236 0.433) 1.674 2.800 ( 5.688 -0.780 0.931) 5.816 2.849 ( -2.158 0.327 6.233) 6.604 2.880 ( 0.633 -3.902 -1.377) 4.186 2.997 ( -0.361 -2.486 -1.035) 2.717 3.106 ( -0.142 -1.143 1.970) 2.282 3.118 ( 1.298 -4.839 -6.069) 7.870 3.188 ( -0.054 0.693 0.331) 0.770 3.231 ( -1.315 -1.366 -2.099) 2.829 3.327 ( 0.266 -6.195 0.554) 6.226 3.374 ( -1.129 -3.677 0.127) 3.848 3.624 ( 0.877 -0.882 0.425) 1.314 3.827 ( 2.699 -9.696 0.644) 10.085 3.938 ( 0.625 -5.373 -2.276) 5.869 4.005 ( 2.509 -4.594 3.155) 6.112 4.098 ( 1.551 2.122 1.277) 2.922 4.384 ( 1.687 -1.410 1.366) 2.588 4.426 ( 1.054 -3.459 -1.220) 3.816 4.475 ( 0.677 3.502 -0.105) 3.569 4.531 ( 0.953 -1.514 2.107) 2.764 4.604 ( -0.621 0.161 0.059) 0.644 4.638 ( -1.265 0.052 -2.963) 3.223 4.719 ( 1.163 -1.279 0.257) 1.748 4.790 ( -2.850 -0.911 -2.176) 3.700 4.834 ( -0.787 -0.145 -0.032) 0.801 4.924 ( 2.059 0.517 2.750) 3.475 5.035 ( 0.493 -4.543 -0.600) 4.609 5.128 ( -0.334 0.645 -0.067) 0.730 5.190 ( -3.129 0.606 0.191) 3.193 5.252 ( -2.936 -0.033 -0.108) 2.938 5.319 ( -0.560 -0.197 -0.175) 0.619 5.369 ( 0.483 -2.574 0.877) 2.762 5.424 ( -0.593 -0.573 -1.142) 1.408 5.459 ( 0.561 -3.337 -0.624) 3.441 5.570 ( 0.618 2.190 0.422) 2.315 5.630 ( -0.609 1.432 -0.049) 1.557 5.751 ( -1.417 0.680 0.078) 1.573 5.823 ( -0.864 1.801 1.621) 2.572 5.869 ( -0.508 0.572 -0.387) 0.858 5.935 ( -1.059 3.559 -0.797) 3.798 6.208 ( -0.522 -0.048 -0.042) 0.526 6.287 ( -0.599 -1.530 -0.000) 1.644 ======================= Grid point 47 (35/140) ======================= q-point: ( 0.62 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( -1.398 -7.018 0.175) 7.158 1.702 ( 0.203 -4.933 0.111) 4.938 1.732 ( 1.671 -8.338 0.647) 8.529 1.810 ( -2.490 -2.894 0.931) 3.929 1.851 ( -0.463 -5.585 -0.371) 5.616 1.903 ( -2.842 1.252 0.058) 3.106 1.969 ( -0.696 -5.270 0.440) 5.334 2.038 ( -2.703 -5.300 -4.169) 7.265 2.064 ( 0.044 0.411 2.534) 2.567 2.109 ( -0.040 0.713 -1.080) 1.294 2.258 ( 0.414 -0.636 0.087) 0.764 2.301 ( 3.339 -6.664 1.251) 7.558 2.431 ( -1.025 -2.155 5.313) 5.824 2.510 ( -4.287 -1.553 -6.219) 7.711 2.588 ( 2.773 2.765 0.125) 3.918 2.656 ( -0.481 -0.423 -0.379) 0.744 2.796 ( 3.267 3.703 -2.235) 5.420 2.821 ( -1.795 2.102 6.322) 6.900 2.926 ( 0.346 0.818 -0.226) 0.916 3.000 ( 0.341 1.311 -1.575) 2.077 3.068 ( 1.208 1.625 1.283) 2.398 3.102 ( -0.482 2.270 2.302) 3.268 3.136 ( -1.879 2.871 -6.869) 7.679 3.289 ( -0.030 -3.284 0.046) 3.284 3.485 ( -0.073 -7.498 0.068) 7.499 3.510 ( -0.565 -8.489 0.037) 8.508 3.642 ( 0.084 -0.512 0.581) 0.779 3.949 ( 1.082 1.889 0.247) 2.191 3.991 ( 1.358 0.080 0.430) 1.427 4.073 ( 4.590 -5.045 1.281) 6.940 4.174 ( -1.666 -7.584 -0.922) 7.819 4.396 ( 0.201 0.476 0.807) 0.958 4.417 ( -0.483 1.623 -0.808) 1.876 4.487 ( 1.694 -1.972 -0.069) 2.601 4.557 ( -0.936 0.345 0.559) 1.143 4.598 ( 0.781 0.141 1.859) 2.021 4.668 ( 0.465 -4.257 -1.365) 4.494 4.737 ( 0.691 -0.430 -0.802) 1.143 4.789 ( -1.358 -0.362 -1.614) 2.141 4.852 ( -0.970 -1.060 0.495) 1.519 4.910 ( 0.990 1.081 1.212) 1.902 5.098 ( 0.739 -0.671 -0.014) 0.999 5.126 ( -0.582 0.004 -0.004) 0.582 5.175 ( -2.192 -2.974 -0.093) 3.696 5.278 ( -1.622 -2.362 0.128) 2.868 5.369 ( 0.057 -4.979 0.038) 4.979 5.419 ( 0.163 -2.136 1.111) 2.413 5.437 ( -0.354 -1.366 -1.760) 2.256 5.523 ( 1.288 -1.127 -0.366) 1.750 5.545 ( -0.834 -0.619 0.539) 1.171 5.596 ( -0.339 1.738 0.114) 1.774 5.741 ( -0.240 0.173 -0.097) 0.311 5.781 ( -0.926 1.777 0.653) 2.107 5.841 ( -0.238 2.128 -0.008) 2.141 5.882 ( -0.459 1.397 -0.500) 1.553 6.196 ( -0.383 0.711 0.012) 0.807 6.299 ( -0.081 0.071 -0.007) 0.108 ======================= Grid point 48 (36/140) ======================= q-point: (-0.31 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( -0.335 -6.169 -0.397) 6.190 1.746 ( -0.189 -0.396 -0.129) 0.457 1.853 ( 0.100 -0.722 -0.386) 0.825 1.878 ( 1.384 -1.718 0.506) 2.264 1.911 ( -1.386 -3.532 -0.842) 3.886 1.918 ( 0.125 -6.852 1.125) 6.945 1.996 ( -0.176 1.388 0.136) 1.406 2.058 ( -0.269 0.531 -0.956) 1.126 2.090 ( 0.730 -0.990 1.020) 1.598 2.181 ( -1.458 -7.387 -0.785) 7.571 2.288 ( 0.345 -2.492 0.129) 2.519 2.389 ( 3.826 2.438 -0.171) 4.540 2.448 ( 1.259 -1.312 4.261) 4.633 2.508 ( -5.492 -1.006 -4.143) 6.952 2.595 ( 0.722 -2.634 0.757) 2.834 2.647 ( 0.174 1.515 0.698) 1.677 2.740 ( 2.032 2.361 -2.829) 4.208 2.754 ( -2.561 3.006 3.160) 5.058 2.868 ( 0.057 3.467 0.023) 3.468 2.962 ( -0.336 2.240 0.341) 2.291 3.035 ( 0.041 1.479 0.560) 1.582 3.085 ( -0.928 -0.773 -2.561) 2.832 3.157 ( 0.166 -4.510 0.022) 4.514 3.316 ( 0.327 0.659 -0.261) 0.781 3.591 ( -0.139 -3.098 0.206) 3.108 3.617 ( 0.030 -2.590 -0.125) 2.593 3.638 ( -0.070 0.968 0.372) 1.039 3.909 ( 1.123 2.145 0.365) 2.449 3.937 ( 0.543 3.373 0.200) 3.422 4.172 ( 2.585 0.447 -0.339) 2.645 4.276 ( -2.353 -4.161 0.105) 4.781 4.377 ( -0.547 1.025 -0.390) 1.226 4.409 ( -0.379 -0.395 -0.298) 0.624 4.505 ( 0.752 1.899 0.022) 2.043 4.530 ( -1.048 0.402 -0.069) 1.125 4.617 ( 1.833 -1.013 1.642) 2.661 4.740 ( 0.057 -0.146 0.299) 0.338 4.770 ( -1.145 -1.856 -1.952) 2.927 4.792 ( 1.006 -3.870 0.201) 4.003 4.834 ( -1.045 1.805 0.226) 2.098 4.926 ( 0.448 -1.568 0.452) 1.693 5.062 ( 0.118 4.020 -0.073) 4.023 5.141 ( -0.265 -1.950 -0.101) 1.970 5.256 ( -0.217 -4.937 -0.051) 4.942 5.308 ( -0.288 -1.255 0.079) 1.290 5.447 ( -0.010 -0.830 -0.133) 0.841 5.455 ( 0.003 -0.650 0.006) 0.650 5.480 ( 0.041 -5.376 -0.009) 5.377 5.526 ( 0.391 -0.781 0.194) 0.895 5.547 ( -0.316 1.984 -0.285) 2.029 5.567 ( -0.170 1.726 0.200) 1.746 5.730 ( -0.077 -0.220 -0.141) 0.272 5.785 ( 0.016 -1.824 0.390) 1.865 5.794 ( -0.099 2.329 -0.126) 2.335 5.871 ( -0.108 -0.533 -0.151) 0.564 6.187 ( -0.078 -0.124 0.003) 0.146 6.292 ( 0.003 0.364 0.006) 0.364 ======================= Grid point 49 (37/140) ======================= q-point: (-0.23 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.735 ( -0.000 1.342 -0.000) 1.342 1.809 ( -0.000 5.195 -0.000) 5.195 1.831 ( 0.000 -2.928 0.000) 2.928 1.896 ( -0.000 1.724 -0.000) 1.724 1.966 ( 0.000 -4.560 0.000) 4.560 1.968 ( -0.000 0.920 -0.000) 0.920 2.032 ( -0.000 2.509 -0.000) 2.509 2.042 ( 0.000 -3.581 0.000) 3.581 2.156 ( 0.000 -5.237 0.000) 5.237 2.254 ( 0.000 -1.124 0.000) 1.124 2.314 ( -0.000 4.160 -0.000) 4.160 2.358 ( 0.000 -3.556 0.000) 3.556 2.451 ( -0.000 1.168 -0.000) 1.168 2.506 ( -0.000 0.878 -0.000) 0.878 2.597 ( -0.000 3.326 -0.000) 3.326 2.639 ( 0.000 -3.011 0.000) 3.011 2.710 ( -0.000 0.698 -0.000) 0.698 2.787 ( 0.000 -4.875 0.000) 4.875 2.827 ( -0.000 0.563 -0.000) 0.563 2.934 ( -0.000 0.100 -0.000) 0.100 3.041 ( 0.000 -2.555 0.000) 2.555 3.109 ( 0.000 -0.744 0.000) 0.744 3.243 ( 0.000 -4.289 0.000) 4.289 3.248 ( -0.000 6.352 -0.000) 6.352 3.577 ( -0.000 3.699 -0.000) 3.699 3.621 ( -0.000 1.627 -0.000) 1.627 3.642 ( 0.000 -0.559 0.000) 0.559 3.874 ( -0.000 2.408 -0.000) 2.408 3.886 ( -0.000 2.218 -0.000) 2.218 4.127 ( -0.000 4.178 -0.000) 4.178 4.230 ( -0.000 8.466 -0.000) 8.466 4.371 ( 0.000 -0.552 0.000) 0.552 4.404 ( -0.000 0.800 -0.000) 0.800 4.440 ( -0.000 3.939 -0.000) 3.939 4.535 ( 0.000 -0.663 0.000) 0.663 4.644 ( 0.000 -0.448 0.000) 0.448 4.731 ( -0.000 0.978 -0.000) 0.978 4.764 ( -0.000 0.128 -0.000) 0.128 4.795 ( -0.000 1.316 -0.000) 1.316 4.867 ( -0.000 0.810 -0.000) 0.810 4.957 ( 0.000 -1.413 0.000) 1.413 5.005 ( 0.000 -0.651 0.000) 0.651 5.180 ( 0.000 -1.667 0.000) 1.667 5.319 ( 0.000 -0.086 0.000) 0.086 5.335 ( 0.000 -3.112 0.000) 3.112 5.451 ( -0.000 1.300 -0.000) 1.300 5.458 ( 0.000 -0.156 0.000) 0.156 5.477 ( -0.000 3.724 -0.000) 3.724 5.519 ( -0.000 2.931 -0.000) 2.931 5.544 ( 0.000 -1.594 0.000) 1.594 5.574 ( 0.000 -2.403 0.000) 2.403 5.757 ( 0.000 -2.216 0.000) 2.216 5.762 ( -0.000 0.213 -0.000) 0.213 5.833 ( 0.000 -2.670 0.000) 2.670 5.900 ( 0.000 -2.390 0.000) 2.390 6.202 ( 0.000 -1.322 0.000) 1.322 6.294 ( 0.000 -0.669 0.000) 0.669 ======================= Grid point 56 (38/140) ======================= q-point: ( 0.31 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.731 ( 15.670 -0.000 -0.609) 15.682 0.903 ( 11.979 -0.000 2.492) 12.235 1.205 ( 10.258 -0.000 -3.491) 10.835 1.209 ( -1.276 0.000 -8.198) 8.297 1.427 ( 8.520 -0.000 6.914) 10.972 1.573 ( 19.735 -0.000 7.815) 21.226 1.622 ( 0.763 -0.000 2.198) 2.327 1.630 ( 0.061 -0.000 3.043) 3.043 1.725 ( 0.804 -0.000 -1.423) 1.635 1.893 ( -4.049 0.000 -0.695) 4.108 1.977 ( -1.210 0.000 0.384) 1.269 1.984 ( -1.977 0.000 -3.280) 3.829 2.115 ( -3.770 0.000 9.174) 9.919 2.228 ( -3.975 0.000 0.798) 4.055 2.447 ( 3.976 -0.000 -1.897) 4.406 2.462 ( -0.863 0.000 0.004) 0.863 2.525 ( 3.115 -0.000 -14.898) 15.220 2.608 ( -0.480 0.000 2.495) 2.541 2.758 ( -6.779 0.000 -4.952) 8.395 2.761 ( 0.229 -0.000 -0.008) 0.230 2.838 ( 1.495 -0.000 1.130) 1.874 2.966 ( -0.304 0.000 1.648) 1.676 3.122 ( -2.466 0.000 2.071) 3.221 3.209 ( -0.544 0.000 0.104) 0.553 3.226 ( -0.588 0.000 -0.093) 0.596 3.248 ( -1.643 0.000 -0.517) 1.722 3.313 ( -1.685 0.000 1.906) 2.544 3.449 ( 2.850 -0.000 -4.191) 5.068 3.770 ( 1.743 -0.000 1.676) 2.418 3.863 ( 0.014 -0.000 0.001) 0.014 4.016 ( -0.207 0.000 -0.130) 0.245 4.033 ( -0.050 0.000 0.125) 0.135 4.147 ( -7.399 0.000 -6.203) 9.655 4.223 ( 4.071 -0.000 10.270) 11.048 4.279 ( -0.450 0.000 -0.008) 0.450 4.370 ( -0.936 0.000 0.008) 0.936 4.467 ( -2.747 0.000 0.635) 2.820 4.695 ( -0.426 0.000 -2.218) 2.258 4.883 ( 2.872 -0.000 3.898) 4.842 4.939 ( -2.157 0.000 -2.158) 3.051 5.065 ( 1.244 -0.000 -2.720) 2.991 5.197 ( -0.146 0.000 0.254) 0.293 5.242 ( -0.617 0.000 -8.274) 8.297 5.291 ( -0.934 0.000 4.775) 4.865 5.318 ( 0.614 -0.000 -1.248) 1.391 5.442 ( -1.046 0.000 3.250) 3.414 5.487 ( 1.272 -0.000 1.669) 2.099 5.638 ( 1.130 -0.000 -3.135) 3.332 5.659 ( 0.372 -0.000 -0.034) 0.373 5.663 ( 0.393 -0.000 0.036) 0.395 5.707 ( 0.251 -0.000 -0.348) 0.429 5.838 ( -0.508 0.000 -0.002) 0.508 5.847 ( 0.886 -0.000 -4.715) 4.798 5.911 ( -1.072 0.000 4.367) 4.496 5.918 ( 0.517 -0.000 -0.000) 0.517 6.164 ( -0.255 0.000 5.681) 5.686 6.285 ( 0.125 -0.000 -0.823) 0.832 ======================= Grid point 57 (39/140) ======================= q-point: ( 0.38 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.850 ( 12.747 -5.087 0.293) 13.728 1.080 ( 10.442 -9.321 2.810) 14.276 1.204 ( -1.762 -2.103 -6.006) 6.603 1.287 ( 10.733 -2.262 -2.376) 11.223 1.520 ( 2.167 -5.376 5.591) 8.053 1.598 ( 0.712 -1.770 1.219) 2.264 1.661 ( 5.538 -2.828 3.919) 7.350 1.771 ( 2.659 -4.935 4.870) 7.426 1.812 ( 0.792 -6.991 -2.110) 7.345 1.935 ( -3.882 -4.916 -1.162) 6.371 1.989 ( 0.422 -2.997 -3.009) 4.268 2.048 ( -0.386 -6.197 -0.768) 6.256 2.124 ( -3.542 -2.842 6.871) 8.236 2.228 ( -1.145 -2.316 4.073) 4.823 2.447 ( 1.754 1.009 -2.240) 3.019 2.493 ( 0.851 0.879 -10.555) 10.625 2.525 ( 2.335 -4.565 0.379) 5.142 2.616 ( 0.860 -1.626 1.404) 2.314 2.714 ( -5.046 -0.463 -3.561) 6.193 2.785 ( 0.168 -1.632 -2.689) 3.150 2.878 ( 0.252 -2.465 3.169) 4.023 2.957 ( -0.165 0.280 1.008) 1.059 3.133 ( -1.461 -1.826 2.714) 3.583 3.192 ( -1.237 0.208 -4.370) 4.546 3.267 ( -0.148 -4.525 0.283) 4.536 3.290 ( 0.209 -0.257 -0.206) 0.390 3.338 ( -1.121 -6.642 1.228) 6.846 3.447 ( 1.603 -0.052 -1.679) 2.322 3.753 ( 1.739 1.959 0.455) 2.659 4.006 ( -2.643 -3.233 -1.643) 4.488 4.016 ( -3.136 -6.201 -1.052) 7.028 4.071 ( 0.498 -3.897 0.356) 3.945 4.133 ( -2.725 -6.792 -2.325) 7.679 4.243 ( 4.172 0.531 8.000) 9.038 4.373 ( -0.806 -6.786 1.313) 6.959 4.421 ( -1.607 -5.165 -1.094) 5.519 4.480 ( -0.661 -2.560 2.143) 3.404 4.679 ( -0.543 0.859 -1.900) 2.154 4.880 ( -3.292 1.277 -1.049) 3.683 4.914 ( 3.197 2.150 1.756) 4.234 5.043 ( 1.293 2.284 -2.771) 3.817 5.176 ( -3.078 2.622 -0.828) 4.127 5.202 ( 0.843 2.237 -6.233) 6.676 5.281 ( -0.594 0.882 5.260) 5.366 5.314 ( 0.984 0.517 -1.326) 1.731 5.409 ( -1.499 3.349 1.175) 3.852 5.439 ( 1.342 3.984 1.980) 4.647 5.596 ( 0.466 3.839 -1.740) 4.241 5.621 ( 0.878 4.812 -0.203) 4.896 5.685 ( 0.883 -1.130 -1.409) 2.011 5.693 ( 0.129 0.809 0.408) 0.915 5.769 ( 1.641 2.573 -0.264) 3.063 5.853 ( 0.963 0.449 -1.123) 1.547 5.925 ( -2.781 -1.041 3.083) 4.281 6.023 ( -0.100 -6.498 -1.590) 6.691 6.161 ( -0.984 0.881 5.128) 5.296 6.243 ( -0.170 3.730 -1.673) 4.092 ======================= Grid point 58 (40/140) ======================= q-point: ( 0.46 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.059 ( 8.052 -10.009 1.590) 12.944 1.249 ( -3.731 -6.201 -3.480) 8.030 1.326 ( 13.447 -7.227 4.992) 16.062 1.390 ( 7.534 -4.388 -2.646) 9.112 1.613 ( -2.085 -3.758 1.948) 4.719 1.716 ( -1.456 -6.991 3.107) 7.787 1.753 ( -1.438 -5.291 1.368) 5.651 1.862 ( -4.239 -4.739 3.185) 7.111 1.926 ( -3.223 -1.815 -3.532) 5.114 1.948 ( 0.408 -4.940 -3.255) 5.931 2.107 ( -2.081 -3.330 -1.659) 4.263 2.133 ( 0.935 -6.318 -0.743) 6.430 2.259 ( 0.102 -8.385 8.615) 12.022 2.332 ( 1.646 -5.681 0.269) 5.921 2.454 ( -1.278 -6.299 -3.347) 7.247 2.507 ( 1.612 -2.759 -1.409) 3.492 2.630 ( 3.769 -4.791 -1.161) 6.206 2.685 ( 0.340 -3.758 0.286) 3.784 2.713 ( -4.734 -2.901 -2.955) 6.289 2.815 ( -0.891 -2.529 -2.912) 3.958 2.918 ( 1.174 -1.359 5.339) 5.633 2.978 ( 0.103 -2.173 -1.272) 2.520 3.159 ( -1.239 -1.062 0.950) 1.888 3.192 ( -0.273 -0.948 -4.221) 4.334 3.308 ( -0.477 -2.497 -0.656) 2.626 3.389 ( 0.775 0.515 0.690) 1.158 3.422 ( 4.722 -8.684 0.785) 9.916 3.549 ( 0.027 -9.293 -0.085) 9.294 3.719 ( 0.151 1.820 -0.267) 1.846 3.953 ( -3.073 0.162 -1.057) 3.254 4.117 ( -0.106 -1.771 1.291) 2.194 4.230 ( 1.817 -8.111 0.263) 8.316 4.267 ( 0.266 -5.080 1.216) 5.230 4.325 ( 2.087 -7.566 2.518) 8.243 4.474 ( -2.703 -4.061 1.209) 5.026 4.513 ( -2.346 -5.715 -2.019) 6.499 4.585 ( 1.077 -7.090 1.316) 7.291 4.666 ( 0.214 -0.905 -0.811) 1.234 4.805 ( -3.283 3.988 -2.534) 5.753 4.883 ( 1.715 3.186 2.679) 4.503 4.999 ( 1.313 2.260 -1.945) 3.258 5.046 ( -1.753 7.821 -1.917) 8.242 5.160 ( -1.614 1.438 -0.650) 2.257 5.285 ( 0.272 0.194 3.277) 3.294 5.302 ( 0.328 1.214 -1.444) 1.914 5.333 ( 1.082 3.365 -1.464) 3.826 5.391 ( -0.765 1.450 2.081) 2.649 5.500 ( 0.642 6.381 -1.176) 6.520 5.516 ( -0.211 5.275 -0.045) 5.279 5.667 ( -0.449 1.143 -0.105) 1.233 5.694 ( 3.546 2.672 -1.616) 4.725 5.753 ( -1.010 -0.471 0.980) 1.484 5.847 ( -0.453 -0.234 -0.071) 0.515 5.911 ( -1.908 1.753 1.917) 3.223 6.112 ( 0.446 2.296 1.614) 2.842 6.137 ( -0.363 -2.040 -1.954) 2.848 6.190 ( -2.371 -1.089 0.520) 2.661 ======================= Grid point 59 (41/140) ======================= q-point: ( 0.54 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.299 ( 3.461 -10.822 2.280) 11.589 1.370 ( -1.141 -8.477 -0.657) 8.579 1.518 ( 7.909 -4.300 1.027) 9.061 1.532 ( 7.872 -7.437 0.692) 10.852 1.671 ( -7.610 -5.558 0.577) 9.442 1.755 ( -7.619 -2.240 1.757) 8.133 1.889 ( -1.109 -5.274 -2.035) 5.761 1.912 ( -0.750 -2.558 -2.703) 3.797 1.953 ( -5.012 -6.998 0.680) 8.634 2.059 ( 3.197 -4.319 -0.560) 5.403 2.110 ( -1.700 0.478 -0.699) 1.899 2.217 ( -0.622 -2.767 -0.764) 2.937 2.339 ( -1.000 -1.273 8.112) 8.272 2.458 ( 0.422 -4.339 -5.390) 6.932 2.605 ( 3.408 -3.281 -0.649) 4.776 2.618 ( 1.544 -4.840 0.528) 5.108 2.740 ( 1.066 -5.890 -1.923) 6.287 2.769 ( 1.308 -6.697 0.081) 6.824 2.805 ( -3.973 -10.926 1.652) 11.743 2.863 ( -1.642 -3.842 0.297) 4.189 2.975 ( 1.015 -2.686 -0.384) 2.897 3.049 ( 0.559 -6.488 -0.851) 6.567 3.180 ( -0.716 0.957 -0.729) 1.400 3.185 ( 0.017 -2.032 -1.448) 2.495 3.343 ( 0.693 1.947 -0.634) 2.162 3.351 ( -1.050 0.418 1.040) 1.536 3.626 ( 4.276 -2.759 -0.556) 5.119 3.672 ( 3.312 -6.473 2.018) 7.546 3.770 ( -2.885 -9.518 -1.700) 10.090 3.967 ( 0.679 -2.061 1.652) 2.727 4.126 ( -0.704 0.354 0.519) 0.943 4.349 ( 0.060 -3.593 0.002) 3.593 4.364 ( 4.306 -4.214 1.259) 6.155 4.471 ( 0.496 -5.222 0.067) 5.246 4.513 ( -2.255 -1.428 0.817) 2.792 4.573 ( -0.739 -1.738 -1.488) 2.404 4.675 ( -0.496 -2.181 -0.696) 2.343 4.697 ( -0.211 4.093 -0.109) 4.099 4.744 ( -0.911 -2.756 -1.207) 3.144 4.874 ( 0.443 0.897 2.234) 2.447 4.895 ( -0.539 0.472 -0.186) 0.740 4.985 ( 0.552 0.350 -1.011) 1.204 5.139 ( -0.871 -0.312 -0.280) 0.967 5.213 ( -0.993 4.930 0.121) 5.031 5.284 ( -0.527 2.387 -0.230) 2.455 5.327 ( 0.661 -1.780 0.430) 1.946 5.370 ( -0.632 5.780 0.208) 5.818 5.399 ( 0.066 -1.833 0.015) 1.834 5.442 ( -0.290 2.171 -0.729) 2.309 5.632 ( 1.446 3.529 0.224) 3.820 5.649 ( -0.283 1.300 -0.649) 1.480 5.754 ( -1.400 0.158 0.293) 1.439 5.852 ( -0.282 0.559 1.729) 1.839 5.869 ( -0.807 0.894 -0.565) 1.330 6.012 ( -0.668 5.194 -0.274) 5.244 6.191 ( 0.173 -1.537 -0.441) 1.609 6.233 ( -1.336 -3.579 0.294) 3.832 ======================= Grid point 60 (42/140) ======================= q-point: ( 0.62 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.482 ( 0.152 -7.473 0.510) 7.492 1.558 ( 0.354 -10.002 1.686) 10.149 1.615 ( 1.999 -4.526 0.064) 4.948 1.712 ( 2.315 -7.147 -0.760) 7.551 1.745 ( -3.164 -4.806 0.909) 5.826 1.801 ( -3.477 -6.700 0.224) 7.552 1.905 ( -2.461 -1.619 -2.786) 4.054 1.967 ( -0.245 -1.684 -0.771) 1.868 2.073 ( -0.501 -2.297 3.991) 4.632 2.089 ( -0.655 -1.533 -3.301) 3.698 2.173 ( 2.223 -6.972 0.609) 7.343 2.245 ( -0.260 -0.981 -0.818) 1.303 2.389 ( -0.967 -2.791 7.091) 7.682 2.477 ( -1.017 0.242 -6.696) 6.777 2.630 ( 1.789 0.629 -1.133) 2.209 2.642 ( -0.529 -0.380 0.320) 0.725 2.835 ( 0.169 -0.939 -0.496) 1.075 2.866 ( 1.512 0.671 4.456) 4.753 2.890 ( 0.800 -4.412 0.293) 4.494 2.982 ( -0.838 -3.359 -2.056) 4.027 3.107 ( -0.138 1.639 0.176) 1.654 3.113 ( 0.358 -8.267 -1.675) 8.443 3.190 ( -0.032 1.946 0.499) 2.009 3.214 ( -0.492 -1.300 -1.056) 1.746 3.329 ( -0.014 -6.837 0.173) 6.839 3.366 ( -0.348 -3.275 0.115) 3.295 3.632 ( 0.379 -0.213 0.178) 0.469 3.848 ( 0.889 -8.625 0.162) 8.672 3.932 ( -0.156 -6.247 -1.019) 6.331 4.037 ( 1.404 -4.567 1.254) 4.940 4.112 ( 0.312 1.139 0.495) 1.280 4.395 ( -0.012 -1.248 0.082) 1.251 4.452 ( 2.672 -1.949 0.514) 3.347 4.480 ( 1.377 2.506 0.913) 3.001 4.529 ( -3.681 -0.870 -1.855) 4.213 4.585 ( 0.407 -1.233 1.362) 1.882 4.641 ( 0.836 0.271 -1.384) 1.640 4.729 ( 0.445 -1.353 0.190) 1.437 4.757 ( -1.585 -1.477 -0.550) 2.235 4.824 ( -0.694 -0.141 -0.322) 0.778 4.954 ( 1.388 1.680 1.351) 2.564 5.037 ( 0.119 -5.797 -0.445) 5.815 5.128 ( 0.375 1.179 -0.077) 1.240 5.163 ( -1.601 0.872 0.105) 1.826 5.226 ( -1.410 0.040 -0.062) 1.412 5.315 ( -0.152 -0.431 -0.076) 0.463 5.376 ( 0.285 -2.616 0.491) 2.677 5.415 ( -0.329 -0.129 -0.630) 0.722 5.463 ( 0.233 -3.713 -0.188) 3.726 5.576 ( 0.282 2.659 0.169) 2.680 5.624 ( -0.294 1.316 -0.040) 1.349 5.740 ( -0.538 0.380 0.063) 0.661 5.821 ( -0.297 2.108 0.583) 2.207 5.864 ( -0.196 0.438 -0.166) 0.508 5.925 ( -0.358 3.452 -0.291) 3.483 6.203 ( -0.222 0.013 -0.015) 0.223 6.283 ( -0.178 -1.803 -0.000) 1.812 ======================= Grid point 61 (43/140) ======================= q-point: ( 0.69 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.613 ( 0.000 -6.797 0.000) 6.797 1.704 ( 0.000 -4.704 0.000) 4.704 1.746 ( 0.000 -8.326 0.000) 8.326 1.796 ( 0.000 -3.600 0.000) 3.600 1.848 ( 0.000 -4.739 0.000) 4.739 1.885 ( 0.000 -0.018 0.000) 0.018 1.966 ( 0.000 -5.621 0.000) 5.621 2.014 ( 0.000 -5.679 0.000) 5.679 2.070 ( -0.000 0.495 -0.000) 0.495 2.106 ( -0.000 0.842 -0.000) 0.842 2.260 ( 0.000 -0.915 0.000) 0.915 2.334 ( 0.000 -7.888 0.000) 7.888 2.444 ( 0.000 -2.117 0.000) 2.117 2.453 ( -0.000 0.233 -0.000) 0.233 2.609 ( -0.000 2.034 -0.000) 2.034 2.649 ( 0.000 -0.465 0.000) 0.465 2.805 ( -0.000 2.978 -0.000) 2.978 2.831 ( -0.000 3.881 -0.000) 3.881 2.929 ( -0.000 1.598 -0.000) 1.598 2.996 ( -0.000 0.800 -0.000) 0.800 3.082 ( -0.000 0.638 -0.000) 0.638 3.099 ( -0.000 3.661 -0.000) 3.661 3.111 ( -0.000 2.482 -0.000) 2.482 3.288 ( 0.000 -3.324 0.000) 3.324 3.485 ( 0.000 -7.338 0.000) 7.338 3.507 ( 0.000 -8.689 0.000) 8.689 3.644 ( 0.000 -0.494 0.000) 0.494 3.953 ( -0.000 1.885 -0.000) 1.885 4.001 ( 0.000 -1.067 0.000) 1.067 4.113 ( 0.000 -6.461 0.000) 6.461 4.151 ( 0.000 -4.707 0.000) 4.707 4.398 ( -0.000 0.862 -0.000) 0.862 4.413 ( -0.000 1.771 -0.000) 1.771 4.518 ( 0.000 -0.902 0.000) 0.902 4.519 ( 0.000 -0.841 0.000) 0.841 4.630 ( -0.000 1.085 -0.000) 1.085 4.659 ( 0.000 -5.653 0.000) 5.653 4.740 ( 0.000 -0.047 0.000) 0.047 4.777 ( 0.000 -0.725 0.000) 0.725 4.846 ( 0.000 -1.030 0.000) 1.030 4.919 ( -0.000 1.282 -0.000) 1.282 5.102 ( 0.000 -0.514 0.000) 0.514 5.123 ( -0.000 0.717 -0.000) 0.717 5.162 ( 0.000 -4.108 0.000) 4.108 5.269 ( 0.000 -2.657 0.000) 2.657 5.369 ( 0.000 -5.084 0.000) 5.084 5.427 ( 0.000 -1.119 0.000) 1.119 5.428 ( 0.000 -2.401 0.000) 2.401 5.534 ( 0.000 -3.123 0.000) 3.123 5.537 ( -0.000 1.539 -0.000) 1.539 5.594 ( -0.000 1.664 -0.000) 1.664 5.739 ( 0.000 -0.050 0.000) 0.050 5.777 ( -0.000 1.842 -0.000) 1.842 5.839 ( -0.000 2.051 -0.000) 2.051 5.878 ( -0.000 1.327 -0.000) 1.327 6.194 ( -0.000 0.667 -0.000) 0.667 6.298 ( -0.000 0.025 -0.000) 0.025 ======================= Grid point 71 (44/140) ======================= q-point: ( 0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.888 ( 13.138 -0.000 -0.874) 13.167 1.012 ( 6.934 -0.000 1.076) 7.017 1.160 ( -2.951 0.000 -4.657) 5.513 1.302 ( 8.490 -0.000 -1.496) 8.621 1.503 ( 1.075 -0.000 6.383) 6.473 1.627 ( 1.836 -0.000 -0.385) 1.876 1.633 ( 0.091 -0.000 -0.019) 0.092 1.740 ( 1.280 -0.000 1.362) 1.869 1.789 ( 10.591 -0.000 6.651) 12.507 1.844 ( -4.075 0.000 -0.806) 4.154 1.965 ( -1.087 0.000 -0.005) 1.087 1.969 ( 2.501 -0.000 -5.747) 6.268 2.106 ( -3.841 0.000 7.165) 8.130 2.218 ( 1.004 -0.000 6.416) 6.494 2.453 ( -0.721 0.000 0.001) 0.721 2.482 ( 1.037 -0.000 -2.485) 2.693 2.495 ( 3.259 -0.000 -13.296) 13.690 2.611 ( -1.455 0.000 1.890) 2.385 2.692 ( -1.009 0.000 -3.119) 3.278 2.763 ( 0.036 -0.000 -0.002) 0.036 2.845 ( 0.003 -0.000 -0.986) 0.986 2.964 ( -1.238 0.000 1.651) 2.063 3.113 ( -0.956 0.000 2.657) 2.823 3.205 ( -0.302 0.000 0.152) 0.338 3.215 ( -3.632 0.000 -0.586) 3.679 3.220 ( -0.428 0.000 -0.143) 0.451 3.306 ( -0.610 0.000 0.877) 1.068 3.463 ( 1.933 -0.000 -2.462) 3.130 3.795 ( 1.706 -0.000 1.242) 2.110 3.863 ( -0.005 0.000 0.004) 0.006 4.014 ( -0.144 0.000 -0.089) 0.169 4.024 ( -8.810 0.000 -6.586) 11.000 4.033 ( -0.033 0.000 0.082) 0.088 4.276 ( -0.127 0.000 -0.004) 0.127 4.316 ( 4.251 -0.000 8.186) 9.224 4.360 ( -0.856 0.000 0.005) 0.856 4.465 ( 1.388 -0.000 4.667) 4.869 4.681 ( -0.958 0.000 -2.249) 2.445 4.869 ( -4.115 0.000 -3.443) 5.365 4.959 ( 4.334 -0.000 3.108) 5.333 5.066 ( 0.774 -0.000 -3.438) 3.524 5.182 ( -2.288 0.000 0.643) 2.377 5.214 ( 0.277 -0.000 -7.072) 7.077 5.294 ( -1.524 0.000 4.257) 4.521 5.330 ( 2.155 -0.000 -0.727) 2.275 5.430 ( -2.706 0.000 1.766) 3.231 5.505 ( 0.902 -0.000 1.201) 1.502 5.638 ( 0.758 -0.000 -2.113) 2.245 5.663 ( 0.262 -0.000 -0.024) 0.263 5.667 ( 0.277 -0.000 0.025) 0.278 5.711 ( 0.396 -0.000 0.545) 0.674 5.834 ( -0.327 0.000 -0.002) 0.327 5.837 ( 0.227 -0.000 -3.254) 3.262 5.921 ( 0.232 -0.000 2.650) 2.660 5.923 ( 0.334 -0.000 -0.000) 0.334 6.185 ( 0.264 -0.000 4.618) 4.625 6.280 ( -0.100 0.000 -1.803) 1.806 ======================= Grid point 72 (45/140) ======================= q-point: ( 0.46 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.978 ( 10.209 -3.834 -0.243) 10.908 1.122 ( -2.685 -4.628 -0.743) 5.402 1.202 ( 3.593 -8.356 -1.678) 9.249 1.402 ( 9.951 -3.048 -0.098) 10.407 1.545 ( -0.250 -4.911 3.664) 6.133 1.587 ( -2.108 -1.009 -0.345) 2.362 1.712 ( 0.852 -3.805 1.131) 4.060 1.808 ( -0.215 -5.649 -0.306) 5.661 1.818 ( 2.146 2.360 6.595) 7.326 1.897 ( -1.206 -3.264 -1.978) 4.003 1.978 ( -0.658 -3.879 -4.500) 5.977 2.045 ( 1.158 -7.295 -2.155) 7.695 2.107 ( -3.408 -2.545 4.540) 6.221 2.259 ( 1.898 -2.985 8.524) 9.229 2.437 ( 0.063 2.462 -10.979) 11.251 2.478 ( 1.250 -1.077 -0.466) 1.714 2.564 ( 3.930 -5.384 0.536) 6.688 2.603 ( -3.910 -1.564 0.197) 4.216 2.673 ( -0.796 0.273 -0.616) 1.043 2.780 ( 0.930 -0.827 -3.078) 3.320 2.886 ( -0.210 -3.283 1.293) 3.535 2.957 ( -0.617 -0.108 1.158) 1.317 3.133 ( -0.490 -1.721 3.071) 3.554 3.166 ( -0.704 0.305 -3.752) 3.830 3.272 ( 0.994 -4.318 -0.229) 4.437 3.294 ( 0.245 -1.440 0.735) 1.635 3.323 ( -2.018 -8.527 0.534) 8.779 3.456 ( 0.940 0.702 -0.966) 1.520 3.772 ( 1.293 2.343 0.406) 2.707 3.937 ( -5.098 1.347 -3.363) 6.254 4.004 ( -0.525 -11.144 0.317) 11.161 4.077 ( 0.338 -4.670 0.142) 4.684 4.110 ( -0.734 -7.941 -0.691) 8.005 4.301 ( 2.360 -0.377 3.878) 4.556 4.359 ( -1.836 -4.911 -0.534) 5.270 4.408 ( -0.774 -3.583 0.246) 3.673 4.518 ( 4.392 -2.791 6.513) 8.337 4.661 ( -2.002 0.537 -2.575) 3.306 4.825 ( -3.508 1.538 -3.702) 5.326 4.969 ( 3.813 2.352 3.534) 5.706 5.039 ( 0.109 2.036 -3.340) 3.913 5.143 ( -2.086 3.401 -1.134) 4.148 5.185 ( -0.646 1.678 -2.725) 3.265 5.288 ( -0.716 0.280 2.543) 2.657 5.329 ( 2.014 1.057 -0.296) 2.293 5.393 ( -1.895 2.331 0.506) 3.047 5.456 ( 0.769 4.469 1.021) 4.648 5.595 ( 0.395 3.898 -0.994) 4.042 5.627 ( 0.312 4.691 -0.063) 4.701 5.684 ( -0.039 -0.032 -0.551) 0.553 5.699 ( 0.419 -0.464 0.294) 0.691 5.782 ( 0.934 2.086 -0.400) 2.320 5.865 ( 2.094 0.237 -1.654) 2.679 5.906 ( -2.756 -0.008 2.725) 3.876 6.017 ( -0.113 -6.364 -0.739) 6.408 6.173 ( -0.185 1.674 3.979) 4.321 6.233 ( -0.180 4.123 -2.262) 4.706 ======================= Grid point 73 (46/140) ======================= q-point: ( 0.54 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.141 ( 6.045 -8.217 0.655) 10.222 1.199 ( -4.086 -7.047 -1.050) 8.214 1.415 ( 3.115 -10.076 -1.238) 10.619 1.499 ( 9.078 -3.033 1.775) 9.734 1.592 ( -2.670 -1.862 0.733) 3.337 1.722 ( 0.224 -6.384 2.652) 6.917 1.735 ( -2.265 1.344 1.521) 3.041 1.812 ( -3.584 -5.445 0.119) 6.520 1.880 ( -2.249 -0.183 -2.957) 3.719 1.952 ( 0.787 -8.033 -1.148) 8.153 2.080 ( -1.192 -3.424 -1.065) 3.779 2.143 ( 0.701 -4.375 -0.241) 4.437 2.286 ( 0.308 -13.221 3.281) 13.625 2.357 ( 1.260 0.462 2.661) 2.981 2.430 ( -0.547 -9.077 -3.474) 9.734 2.532 ( 3.013 -4.553 1.564) 5.679 2.618 ( -4.962 -4.020 -2.976) 7.045 2.674 ( 2.320 -2.934 -1.507) 4.033 2.697 ( -0.744 -2.707 1.286) 3.088 2.800 ( -0.249 -2.295 -1.351) 2.675 2.946 ( 0.868 -2.801 2.781) 4.041 2.971 ( -0.370 -1.357 -1.306) 1.919 3.152 ( -0.448 -0.933 0.316) 1.082 3.179 ( -0.117 -1.069 -1.382) 1.751 3.304 ( 0.008 -2.398 -0.310) 2.418 3.396 ( 0.200 0.689 0.242) 0.757 3.480 ( 4.638 -10.361 0.785) 11.379 3.534 ( -2.451 -10.539 -0.359) 10.826 3.722 ( 0.220 3.361 0.075) 3.369 3.920 ( -1.729 -2.036 -0.693) 2.759 4.118 ( -0.182 -1.748 0.303) 1.784 4.240 ( 0.162 -8.411 -0.199) 8.415 4.274 ( 0.673 -8.264 0.333) 8.298 4.361 ( 1.846 -4.814 2.083) 5.561 4.444 ( -2.380 -4.380 -0.520) 5.012 4.487 ( -0.929 -5.540 -0.719) 5.663 4.614 ( 1.734 -3.035 1.775) 3.921 4.668 ( 0.312 -3.987 -0.005) 3.999 4.762 ( -2.252 2.901 -2.005) 4.184 4.907 ( 0.891 5.261 1.153) 5.459 5.002 ( 0.427 1.891 -1.010) 2.186 5.025 ( -0.849 6.844 -0.802) 6.943 5.145 ( -0.683 1.570 -0.144) 1.718 5.293 ( -0.260 -0.575 1.296) 1.442 5.304 ( 0.436 3.201 -0.497) 3.268 5.339 ( 0.599 2.428 -0.753) 2.612 5.390 ( -0.388 1.766 0.868) 2.006 5.504 ( 0.822 6.769 -0.950) 6.885 5.511 ( -0.665 5.363 0.488) 5.427 5.663 ( -0.184 1.116 -0.072) 1.134 5.723 ( 2.824 1.652 -1.630) 3.655 5.743 ( -1.757 1.371 1.435) 2.650 5.843 ( -0.189 -0.019 0.004) 0.190 5.901 ( -0.772 1.337 0.652) 1.676 6.120 ( -0.027 5.910 1.000) 5.994 6.131 ( 0.291 -5.503 -0.816) 5.571 6.171 ( -1.043 -0.703 -0.117) 1.263 ======================= Grid point 74 (47/140) ======================= q-point: ( 0.62 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.331 ( 0.000 -8.457 0.000) 8.457 1.352 ( 0.000 -11.050 0.000) 11.050 1.585 ( 0.000 -1.727 0.000) 1.727 1.598 ( 0.000 -7.896 0.000) 7.896 1.646 ( 0.000 -0.812 0.000) 0.812 1.664 ( 0.000 -5.502 0.000) 5.502 1.869 ( 0.000 -1.311 0.000) 1.311 1.914 ( 0.000 -3.882 0.000) 3.882 1.919 ( 0.000 -10.004 0.000) 10.004 2.079 ( 0.000 -5.075 0.000) 5.075 2.099 ( -0.000 0.327 -0.000) 0.327 2.212 ( 0.000 -2.509 0.000) 2.509 2.350 ( 0.000 -1.010 0.000) 1.010 2.449 ( 0.000 -3.229 0.000) 3.229 2.626 ( 0.000 -5.044 0.000) 5.044 2.631 ( 0.000 -0.698 0.000) 0.698 2.741 ( 0.000 -5.555 0.000) 5.555 2.776 ( 0.000 -17.211 0.000) 17.211 2.780 ( 0.000 -6.652 0.000) 6.652 2.856 ( 0.000 -2.656 0.000) 2.656 2.980 ( 0.000 -1.254 0.000) 1.254 3.050 ( 0.000 -7.055 0.000) 7.055 3.175 ( -0.000 0.847 -0.000) 0.847 3.183 ( 0.000 -2.073 0.000) 2.073 3.346 ( 0.000 -1.199 0.000) 1.199 3.347 ( -0.000 3.788 -0.000) 3.788 3.654 ( -0.000 1.880 -0.000) 1.880 3.699 ( 0.000 -8.249 0.000) 8.249 3.741 ( 0.000 -11.687 0.000) 11.687 3.976 ( 0.000 -3.545 0.000) 3.545 4.120 ( -0.000 0.501 -0.000) 0.501 4.347 ( 0.000 -3.772 0.000) 3.772 4.409 ( 0.000 -4.692 0.000) 4.692 4.450 ( 0.000 -3.315 0.000) 3.315 4.508 ( 0.000 -2.832 0.000) 2.832 4.571 ( 0.000 -2.304 0.000) 2.304 4.666 ( 0.000 -0.474 0.000) 0.474 4.694 ( -0.000 0.924 -0.000) 0.924 4.740 ( 0.000 -0.043 0.000) 0.043 4.879 ( -0.000 6.104 -0.000) 6.104 4.896 ( 0.000 -6.475 0.000) 6.475 4.985 ( -0.000 1.025 -0.000) 1.025 5.133 ( 0.000 -0.899 0.000) 0.899 5.208 ( -0.000 5.702 -0.000) 5.702 5.280 ( -0.000 2.788 -0.000) 2.788 5.332 ( 0.000 -1.672 0.000) 1.672 5.367 ( -0.000 6.070 -0.000) 6.070 5.399 ( 0.000 -2.096 0.000) 2.096 5.439 ( -0.000 2.315 -0.000) 2.315 5.644 ( -0.000 0.941 -0.000) 0.941 5.644 ( -0.000 4.369 -0.000) 4.369 5.747 ( -0.000 0.071 -0.000) 0.071 5.858 ( 0.000 -0.849 0.000) 0.849 5.860 ( -0.000 2.173 -0.000) 2.173 6.007 ( -0.000 5.349 -0.000) 5.349 6.191 ( 0.000 -1.179 0.000) 1.179 6.226 ( 0.000 -4.074 0.000) 4.074 ======================= Grid point 86 (48/140) ======================= q-point: ( 0.46 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.003 ( 7.732 -0.000 -0.847) 7.779 1.065 ( 2.265 -0.000 0.267) 2.281 1.111 ( -3.829 0.000 -0.949) 3.945 1.365 ( 3.246 -0.000 -0.330) 3.263 1.520 ( -0.208 0.000 2.314) 2.324 1.632 ( -0.179 0.000 -0.313) 0.361 1.639 ( 0.879 -0.000 -0.365) 0.952 1.751 ( -0.260 0.000 0.904) 0.941 1.808 ( -1.629 0.000 -0.350) 1.666 1.885 ( 3.083 -0.000 6.101) 6.836 1.956 ( -0.455 0.000 -0.097) 0.465 1.971 ( 2.237 -0.000 -7.668) 7.988 2.085 ( -2.935 0.000 3.212) 4.351 2.286 ( 3.387 -0.000 8.236) 8.906 2.430 ( -1.219 0.000 -10.707) 10.776 2.447 ( -0.287 0.000 -0.002) 0.287 2.520 ( 1.745 -0.000 0.683) 1.874 2.592 ( -1.527 0.000 0.377) 1.573 2.701 ( 1.664 -0.000 -0.694) 1.803 2.763 ( -0.014 0.000 0.000) 0.014 2.840 ( 0.166 -0.000 -0.998) 1.012 2.954 ( -1.127 0.000 0.848) 1.410 3.120 ( 0.407 -0.000 1.959) 2.001 3.175 ( -2.530 0.000 -1.022) 2.728 3.203 ( -0.078 0.000 0.078) 0.110 3.216 ( -0.169 0.000 -0.075) 0.185 3.304 ( -0.116 0.000 0.206) 0.236 3.471 ( 0.631 -0.000 -0.798) 1.017 3.813 ( 0.820 -0.000 0.566) 0.996 3.863 ( -0.005 0.000 0.002) 0.006 3.931 ( -3.921 0.000 -2.850) 4.847 4.012 ( -0.051 0.000 -0.031) 0.060 4.033 ( -0.012 0.000 0.028) 0.030 4.276 ( 0.006 -0.000 -0.001) 0.006 4.353 ( -0.361 0.000 0.002) 0.361 4.357 ( 0.593 -0.000 1.640) 1.743 4.535 ( 5.420 -0.000 7.730) 9.440 4.644 ( -3.799 0.000 -4.316) 5.749 4.819 ( -1.860 0.000 -2.548) 3.155 5.016 ( 3.024 -0.000 3.485) 4.614 5.055 ( -0.340 0.000 -3.428) 3.445 5.163 ( -1.332 0.000 0.402) 1.391 5.192 ( -0.402 0.000 -2.660) 2.690 5.293 ( -0.454 0.000 1.275) 1.353 5.353 ( 2.025 -0.000 -0.054) 2.025 5.404 ( -2.319 0.000 0.558) 2.385 5.515 ( 0.302 -0.000 0.428) 0.524 5.639 ( 0.261 -0.000 -0.715) 0.761 5.665 ( 0.094 -0.000 -0.009) 0.094 5.669 ( 0.099 -0.000 0.009) 0.100 5.718 ( 0.241 -0.000 0.425) 0.489 5.829 ( -0.001 0.000 -1.229) 1.229 5.831 ( -0.113 0.000 -0.001) 0.113 5.925 ( 0.115 -0.000 -0.000) 0.115 5.931 ( 0.251 -0.000 0.846) 0.882 6.201 ( 0.181 -0.000 2.105) 2.113 6.272 ( -0.081 0.000 -1.179) 1.182 ======================= Grid point 87 (49/140) ======================= q-point: ( 0.54 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.065 ( 0.000 -4.073 0.000) 4.073 1.072 ( 0.000 -2.422 0.000) 2.422 1.221 ( 0.000 -9.887 0.000) 9.887 1.469 ( 0.000 -6.147 0.000) 6.147 1.550 ( 0.000 -5.249 0.000) 5.249 1.566 ( -0.000 1.711 -0.000) 1.711 1.710 ( 0.000 -3.981 0.000) 3.981 1.803 ( 0.000 -5.623 0.000) 5.623 1.857 ( 0.000 -1.681 0.000) 1.681 1.886 ( -0.000 7.472 -0.000) 7.472 1.956 ( 0.000 -7.051 0.000) 7.051 2.052 ( 0.000 -9.462 0.000) 9.462 2.092 ( 0.000 -1.442 0.000) 1.442 2.299 ( 0.000 -2.500 0.000) 2.500 2.404 ( -0.000 1.369 -0.000) 1.369 2.490 ( 0.000 -1.851 0.000) 1.851 2.570 ( -0.000 0.850 -0.000) 0.850 2.597 ( 0.000 -6.634 0.000) 6.634 2.666 ( -0.000 1.007 -0.000) 1.007 2.781 ( 0.000 -0.163 0.000) 0.163 2.887 ( 0.000 -3.721 0.000) 3.721 2.955 ( 0.000 -0.477 0.000) 0.477 3.142 ( 0.000 -1.925 0.000) 1.925 3.150 ( -0.000 0.619 -0.000) 0.619 3.280 ( 0.000 -1.556 0.000) 1.556 3.299 ( 0.000 -7.743 0.000) 7.743 3.308 ( 0.000 -6.376 0.000) 6.376 3.459 ( -0.000 0.897 -0.000) 0.897 3.781 ( -0.000 2.489 -0.000) 2.489 3.898 ( -0.000 0.619 -0.000) 0.619 4.002 ( 0.000 -10.996 0.000) 10.996 4.079 ( 0.000 -4.787 0.000) 4.787 4.106 ( 0.000 -8.167 0.000) 8.167 4.333 ( -0.000 0.221 -0.000) 0.221 4.335 ( 0.000 -5.284 0.000) 5.284 4.404 ( 0.000 -3.150 0.000) 3.150 4.591 ( 0.000 -2.712 0.000) 2.712 4.615 ( -0.000 0.501 -0.000) 0.501 4.796 ( -0.000 1.563 -0.000) 1.563 5.010 ( -0.000 3.961 -0.000) 3.961 5.023 ( -0.000 0.756 -0.000) 0.756 5.127 ( -0.000 3.598 -0.000) 3.598 5.175 ( -0.000 1.386 -0.000) 1.386 5.289 ( -0.000 0.212 -0.000) 0.212 5.344 ( -0.000 1.421 -0.000) 1.421 5.380 ( -0.000 1.689 -0.000) 1.689 5.462 ( -0.000 4.550 -0.000) 4.550 5.596 ( -0.000 3.872 -0.000) 3.872 5.628 ( -0.000 4.706 -0.000) 4.706 5.682 ( -0.000 0.182 -0.000) 0.182 5.703 ( 0.000 -0.609 0.000) 0.609 5.786 ( -0.000 1.737 -0.000) 1.737 5.881 ( 0.000 -3.078 0.000) 3.078 5.888 ( -0.000 3.698 -0.000) 3.698 6.015 ( 0.000 -6.248 0.000) 6.248 6.181 ( -0.000 1.736 -0.000) 1.736 6.226 ( -0.000 4.412 -0.000) 4.412 ======================= Grid point 175 (50/140) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.433 ( -0.335 0.000 18.909) 18.912 0.443 ( -3.080 0.000 19.088) 19.335 0.800 ( -0.622 0.000 -4.998) 5.036 0.812 ( -0.018 0.000 -14.423) 14.423 0.854 ( 0.692 -0.000 26.769) 26.778 1.431 ( -6.634 0.000 -6.903) 9.574 1.606 ( 1.617 -0.000 7.499) 7.672 1.612 ( 6.312 -0.000 -14.832) 16.119 1.762 ( -2.345 0.000 -6.381) 6.798 1.965 ( 1.580 -0.000 2.819) 3.232 2.024 ( -1.786 0.000 4.145) 4.514 2.026 ( -0.708 0.000 -1.368) 1.540 2.152 ( 2.897 -0.000 2.653) 3.929 2.338 ( 2.204 -0.000 -2.223) 3.130 2.417 ( -4.740 0.000 -4.747) 6.709 2.483 ( 0.006 -0.000 -0.000) 0.006 2.518 ( -2.017 0.000 -0.653) 2.120 2.599 ( 1.748 -0.000 4.217) 4.565 2.744 ( 0.015 -0.000 -0.017) 0.023 2.749 ( -1.716 0.000 -3.524) 3.920 2.916 ( 2.624 -0.000 4.390) 5.114 3.076 ( 0.592 -0.000 1.345) 1.469 3.164 ( -1.504 0.000 1.072) 1.847 3.226 ( -0.058 0.000 -0.294) 0.300 3.229 ( -0.203 0.000 -4.923) 4.927 3.250 ( 0.048 -0.000 0.305) 0.309 3.308 ( -3.457 0.000 -3.738) 5.091 3.473 ( -1.061 0.000 0.119) 1.067 3.709 ( -0.446 0.000 1.775) 1.830 3.861 ( -0.003 0.000 -0.009) 0.010 4.025 ( -0.102 0.000 0.062) 0.119 4.032 ( 0.116 -0.000 -0.087) 0.145 4.091 ( -2.934 0.000 0.443) 2.967 4.307 ( 2.933 -0.000 4.289) 5.195 4.308 ( -0.030 0.000 0.062) 0.069 4.387 ( 0.020 -0.000 -0.037) 0.042 4.653 ( -0.425 0.000 -1.780) 1.830 4.693 ( -0.067 0.000 -0.377) 0.383 4.773 ( 3.718 -0.000 0.174) 3.722 4.888 ( 3.082 -0.000 2.259) 3.821 4.979 ( -0.699 0.000 -1.985) 2.104 5.127 ( 0.890 -0.000 3.057) 3.184 5.250 ( -1.379 0.000 -2.550) 2.899 5.276 ( -0.235 0.000 -0.438) 0.497 5.300 ( 2.486 -0.000 -3.245) 4.088 5.413 ( 0.107 -0.000 0.142) 0.178 5.516 ( -2.070 0.000 1.691) 2.673 5.647 ( 0.004 -0.000 -0.044) 0.044 5.649 ( -0.723 0.000 0.949) 1.194 5.651 ( -0.003 0.000 0.041) 0.041 5.704 ( -0.234 0.000 -1.125) 1.149 5.835 ( -1.346 0.000 -0.232) 1.365 5.861 ( -0.001 0.000 -0.004) 0.004 5.895 ( -0.001 0.000 0.006) 0.006 6.046 ( -0.786 0.000 0.794) 1.117 6.231 ( 1.482 -0.000 -0.262) 1.505 6.418 ( -2.665 0.000 0.700) 2.755 ======================= Grid point 176 (51/140) ======================= q-point: ( 0.08 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.599 ( -2.343 -13.824 12.871) 19.034 0.686 ( 1.169 -12.680 15.509) 20.067 0.897 ( 3.563 -9.272 -10.882) 14.734 0.959 ( 3.592 -17.870 -9.901) 20.743 1.136 ( 7.270 -19.463 21.206) 29.688 1.425 ( -4.526 -5.101 -5.908) 9.023 1.559 ( 3.417 -0.318 -0.819) 3.528 1.802 ( 2.185 -10.675 -4.085) 11.637 1.812 ( -1.321 -7.562 -5.332) 9.346 2.009 ( -1.566 -0.730 4.574) 4.889 2.035 ( 0.179 -5.399 1.067) 5.507 2.101 ( -0.555 -7.154 -0.146) 7.177 2.162 ( 2.172 0.182 -0.518) 2.240 2.295 ( 0.041 3.681 -1.133) 3.851 2.387 ( -2.506 -0.207 -3.216) 4.083 2.491 ( -1.536 0.166 0.097) 1.548 2.503 ( -0.331 -1.300 -0.493) 1.429 2.630 ( 2.003 -1.629 5.451) 6.031 2.743 ( -1.482 -1.420 -5.247) 5.634 2.857 ( -0.311 -9.009 -0.033) 9.015 2.898 ( 1.087 3.807 3.810) 5.495 3.010 ( -1.753 2.825 0.282) 3.336 3.158 ( 2.279 0.685 0.957) 2.565 3.169 ( 0.774 3.071 -4.574) 5.564 3.246 ( -1.272 0.590 -0.656) 1.547 3.321 ( -1.440 -4.134 -1.145) 4.525 3.359 ( -0.574 -8.332 -0.330) 8.359 3.437 ( -0.025 -0.303 1.048) 1.091 3.695 ( 0.483 1.683 1.638) 2.398 4.036 ( 0.042 -6.754 0.965) 6.822 4.072 ( -0.358 -4.552 0.811) 4.637 4.084 ( 0.063 0.060 2.118) 2.120 4.128 ( -0.721 -4.038 -1.749) 4.459 4.263 ( -0.188 -3.888 -2.954) 4.886 4.397 ( -0.121 -1.145 0.250) 1.178 4.476 ( -0.944 -10.439 -1.122) 10.542 4.638 ( -4.007 -0.377 -1.206) 4.202 4.702 ( 2.329 -0.197 -1.005) 2.544 4.774 ( 2.456 1.552 -1.520) 3.279 4.897 ( 2.352 0.937 0.140) 2.536 4.965 ( 0.613 0.881 -1.898) 2.181 5.112 ( -0.156 2.616 1.225) 2.893 5.234 ( -0.791 0.569 -2.241) 2.444 5.274 ( 0.190 -0.056 -0.132) 0.238 5.300 ( 1.387 0.458 -2.029) 2.500 5.409 ( 0.715 0.601 0.072) 0.937 5.498 ( -0.754 1.566 3.544) 3.948 5.554 ( -0.529 7.653 3.810) 8.566 5.611 ( 0.356 2.907 -0.484) 2.968 5.639 ( -1.372 2.177 1.499) 2.978 5.691 ( -0.054 0.705 -0.226) 0.742 5.779 ( -0.798 1.449 1.607) 2.307 5.827 ( 0.080 0.719 -1.705) 1.852 5.983 ( 0.285 -5.849 -0.848) 5.917 6.051 ( -0.509 0.531 1.146) 1.362 6.196 ( 0.931 3.450 -1.156) 3.756 6.391 ( -3.608 0.171 2.409) 4.342 ======================= Grid point 177 (52/140) ======================= q-point: ( 0.15 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.910 ( 0.886 -15.943 6.949) 17.415 0.974 ( -0.385 -15.514 12.152) 19.710 1.115 ( 0.843 -13.549 -7.329) 15.427 1.278 ( 3.664 -12.749 -9.171) 16.126 1.562 ( -0.663 -9.076 -0.744) 9.131 1.634 ( 4.248 -22.785 7.101) 24.241 1.677 ( 2.274 -11.589 2.998) 12.185 1.921 ( -0.848 -4.762 1.785) 5.155 2.019 ( -2.216 -9.400 1.547) 9.781 2.080 ( 2.179 -8.107 -3.611) 9.138 2.151 ( 0.291 -5.239 0.642) 5.286 2.173 ( -1.435 -0.842 -3.585) 3.952 2.233 ( -1.569 -4.459 -3.693) 5.999 2.271 ( 3.889 -3.741 0.592) 5.429 2.399 ( -2.005 -3.410 -0.600) 4.001 2.498 ( -0.742 -2.090 -0.158) 2.223 2.547 ( -0.038 -3.814 -0.328) 3.829 2.694 ( 0.416 -2.835 4.903) 5.679 2.778 ( -1.101 -3.802 -4.248) 5.806 2.823 ( 0.889 3.134 0.423) 3.285 2.964 ( -0.677 0.092 4.030) 4.087 3.020 ( -2.139 -5.327 -1.285) 5.882 3.097 ( 0.471 2.763 -7.209) 7.735 3.199 ( 4.299 -2.108 0.926) 4.877 3.236 ( -1.093 -1.019 0.900) 1.744 3.402 ( -2.468 -4.221 -1.777) 5.203 3.444 ( 2.720 -2.478 0.521) 3.716 3.531 ( -4.101 -7.036 0.579) 8.164 3.668 ( 2.177 1.236 0.554) 2.564 4.023 ( -0.249 4.596 0.294) 4.612 4.084 ( 0.253 0.456 1.253) 1.357 4.141 ( 2.739 -3.162 2.200) 4.727 4.241 ( -0.572 -6.383 0.916) 6.474 4.378 ( -2.520 -5.560 -1.193) 6.220 4.432 ( 3.099 -2.477 2.189) 4.531 4.629 ( -2.732 -2.837 -0.374) 3.956 4.647 ( -1.617 -5.159 -0.568) 5.437 4.712 ( 0.499 0.160 -1.925) 1.994 4.741 ( 2.177 1.901 -2.324) 3.708 4.885 ( 0.459 0.747 -0.867) 1.234 4.954 ( 1.224 0.194 -1.675) 2.084 5.029 ( -0.904 5.278 -1.057) 5.458 5.218 ( -0.658 0.340 -0.236) 0.777 5.281 ( 0.210 -0.469 -0.086) 0.521 5.297 ( -0.198 -0.126 -0.985) 1.013 5.401 ( 0.410 0.648 0.504) 0.918 5.426 ( -1.832 5.005 4.245) 6.814 5.472 ( 0.511 2.212 3.108) 3.849 5.551 ( 0.607 3.728 -1.842) 4.202 5.576 ( -1.253 2.395 1.632) 3.157 5.678 ( 0.026 0.712 -0.476) 0.857 5.787 ( -0.508 -1.640 0.449) 1.775 5.833 ( 0.349 -1.008 -1.543) 1.876 6.018 ( -0.751 2.612 1.438) 3.075 6.089 ( 0.329 -5.112 -0.525) 5.150 6.126 ( 0.106 3.808 -1.839) 4.230 6.377 ( -2.988 0.052 1.333) 3.273 ======================= Grid point 178 (53/140) ======================= q-point: ( 0.23 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.213 ( 1.917 -13.735 5.160) 14.797 1.299 ( -0.625 -15.594 6.829) 17.035 1.361 ( 0.070 -13.085 -4.655) 13.888 1.502 ( 0.049 -12.485 -5.382) 13.595 1.719 ( 0.754 -7.830 0.025) 7.866 1.889 ( -0.668 -8.160 2.294) 8.502 1.927 ( -0.510 -4.606 -1.425) 4.848 2.037 ( -3.751 -6.152 4.121) 8.301 2.139 ( -1.597 -4.110 -1.163) 4.560 2.163 ( -4.945 -1.543 1.009) 5.277 2.219 ( -1.030 -5.740 -3.420) 6.760 2.278 ( 2.801 -6.508 3.994) 8.133 2.310 ( -3.743 -4.892 -4.412) 7.577 2.391 ( 7.011 -5.734 -1.214) 9.138 2.482 ( 0.170 -4.496 2.595) 5.194 2.569 ( -0.161 -5.195 -1.812) 5.505 2.654 ( 1.075 -3.938 0.219) 4.088 2.746 ( -0.052 -3.083 2.734) 4.121 2.806 ( 1.248 -4.695 -1.318) 5.034 2.912 ( 0.844 -9.185 -2.993) 9.697 2.966 ( -0.019 -0.073 4.600) 4.601 3.043 ( -0.428 1.187 -5.451) 5.595 3.076 ( -0.362 -1.720 -1.659) 2.417 3.249 ( -0.431 -3.309 -1.564) 3.685 3.289 ( 1.326 -1.447 3.479) 3.994 3.407 ( -0.129 1.593 -1.735) 2.359 3.547 ( 2.165 -4.614 2.310) 5.595 3.580 ( -3.104 -3.389 0.246) 4.602 3.716 ( 3.144 -3.698 -1.395) 5.050 3.960 ( 0.785 1.402 0.821) 1.804 4.070 ( 0.369 1.267 0.455) 1.396 4.232 ( 3.327 -4.052 2.301) 5.725 4.334 ( -0.588 -3.922 -0.698) 4.027 4.411 ( 0.300 -0.251 -0.702) 0.804 4.521 ( 2.197 -2.674 1.986) 3.990 4.649 ( -1.101 -0.621 -0.674) 1.432 4.660 ( 0.355 2.927 -0.000) 2.948 4.692 ( -0.398 -0.556 -0.907) 1.136 4.764 ( 0.543 -1.320 -1.230) 1.884 4.886 ( -0.061 -0.922 0.132) 0.933 4.930 ( -0.935 3.492 -0.721) 3.686 4.978 ( -0.460 -2.928 -1.636) 3.385 5.203 ( -1.145 1.060 0.195) 1.573 5.291 ( -0.788 -0.559 1.076) 1.446 5.302 ( -0.741 -0.916 -1.228) 1.701 5.365 ( -0.855 0.918 2.386) 2.696 5.393 ( -0.288 0.167 -0.489) 0.592 5.438 ( -0.800 1.800 3.639) 4.138 5.482 ( -1.471 2.233 -1.179) 2.922 5.553 ( 0.746 0.558 0.289) 0.975 5.659 ( 0.037 1.224 -0.939) 1.544 5.811 ( -0.710 -0.728 0.425) 1.102 5.854 ( 0.237 -1.108 -1.281) 1.710 5.958 ( -1.416 3.066 1.040) 3.534 6.048 ( -0.798 3.786 -1.751) 4.247 6.174 ( 0.187 -3.636 -0.089) 3.641 6.358 ( -2.378 0.572 0.659) 2.533 ======================= Grid point 179 (54/140) ======================= q-point: ( 0.31 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( 0.972 -10.957 2.875) 11.370 1.524 ( 0.640 -8.672 0.044) 8.696 1.628 ( -1.776 -14.312 1.094) 14.463 1.724 ( -1.190 -11.145 -1.873) 11.364 1.845 ( -0.166 -4.115 -0.491) 4.148 1.980 ( -0.511 -4.284 0.139) 4.317 2.009 ( 0.315 -2.593 -0.822) 2.738 2.046 ( -3.489 -0.795 0.350) 3.595 2.148 ( -3.990 0.651 1.013) 4.168 2.170 ( -4.262 -0.823 0.690) 4.395 2.267 ( -4.505 -2.264 -2.629) 5.686 2.317 ( -5.194 0.312 -4.205) 6.690 2.419 ( 2.745 -4.388 4.713) 7.000 2.533 ( 5.060 -4.956 0.062) 7.083 2.549 ( 0.580 -0.708 3.616) 3.730 2.628 ( -2.223 -0.148 1.336) 2.598 2.646 ( 0.920 -0.543 -2.661) 2.867 2.830 ( -0.297 -3.080 -0.885) 3.219 2.921 ( 0.089 0.118 -5.774) 5.776 2.997 ( 3.973 -4.079 2.614) 6.265 3.020 ( -0.963 -1.194 0.911) 1.784 3.071 ( 1.200 -0.737 0.330) 1.446 3.161 ( 1.206 -9.621 -0.744) 9.725 3.289 ( -1.015 1.003 -0.854) 1.664 3.303 ( 0.398 -0.502 0.406) 0.758 3.404 ( -0.520 -5.796 -0.067) 5.820 3.601 ( 1.041 -2.303 0.525) 2.581 3.737 ( 2.654 -10.252 2.741) 10.939 3.810 ( 4.734 -4.052 -0.423) 6.246 3.970 ( 0.739 -0.643 0.111) 0.986 4.048 ( -0.357 0.010 -2.404) 2.430 4.328 ( 3.101 -3.229 1.594) 4.753 4.387 ( -0.173 -2.359 -1.289) 2.694 4.410 ( 1.757 0.514 -0.386) 1.871 4.538 ( 0.769 1.039 1.052) 1.666 4.605 ( -1.327 1.466 -0.422) 2.022 4.665 ( 0.373 -1.365 0.278) 1.443 4.709 ( -0.675 -0.971 -0.615) 1.333 4.780 ( 1.318 -0.491 -0.245) 1.427 4.865 ( -1.347 1.293 -1.405) 2.337 4.929 ( 0.723 -1.171 2.552) 2.899 5.038 ( -1.097 -3.434 -1.134) 3.779 5.174 ( -1.656 0.672 0.238) 1.803 5.301 ( -2.461 -0.526 -0.364) 2.543 5.315 ( -0.680 -1.758 1.195) 2.232 5.367 ( -1.296 -0.527 0.233) 1.419 5.409 ( 0.449 -1.413 -0.645) 1.617 5.422 ( -1.213 -1.075 3.063) 3.466 5.449 ( -0.891 0.420 -1.153) 1.517 5.556 ( 0.296 -0.411 0.688) 0.854 5.628 ( 0.282 1.793 -1.328) 2.249 5.798 ( -1.117 1.566 -0.007) 1.923 5.864 ( -0.198 0.022 -0.587) 0.620 5.899 ( -1.729 2.356 0.043) 2.923 5.967 ( -1.214 3.724 -0.907) 4.021 6.222 ( -0.187 -1.255 0.104) 1.273 6.333 ( -1.495 0.939 0.384) 1.806 ======================= Grid point 180 (55/140) ======================= q-point: ( 0.38 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( 0.434 -7.826 0.995) 7.901 1.663 ( 0.687 -5.445 -0.148) 5.490 1.823 ( -4.233 -5.800 1.621) 7.361 1.868 ( -0.801 -1.959 -2.943) 3.625 1.891 ( -2.007 -5.914 0.158) 6.247 1.976 ( -0.897 2.442 0.842) 2.734 2.033 ( -0.935 0.528 -4.342) 4.473 2.085 ( -0.736 -1.544 3.117) 3.556 2.127 ( -3.353 3.037 0.356) 4.538 2.167 ( -3.951 -7.052 0.111) 8.084 2.266 ( -2.212 0.670 -1.671) 2.852 2.295 ( -2.776 -3.233 -1.009) 4.379 2.468 ( 3.087 1.263 2.797) 4.353 2.517 ( -1.300 2.841 5.857) 6.639 2.591 ( 3.658 -0.115 1.768) 4.065 2.671 ( -0.131 -4.871 -1.177) 5.013 2.690 ( -1.053 -1.752 -3.941) 4.439 2.846 ( 1.397 2.721 -4.390) 5.351 2.887 ( 0.492 -0.190 -2.397) 2.454 2.944 ( -0.734 4.181 1.373) 4.462 3.045 ( 1.384 2.047 2.033) 3.199 3.158 ( 0.990 -4.177 -0.840) 4.374 3.173 ( -1.737 2.318 1.067) 3.087 3.270 ( 0.401 -0.052 2.870) 2.899 3.447 ( 2.093 -8.613 -1.332) 8.963 3.543 ( -1.299 -6.936 -0.583) 7.081 3.642 ( 0.520 -1.093 -0.136) 1.218 3.851 ( 3.894 0.906 2.172) 4.551 3.944 ( 0.205 1.193 -1.779) 2.152 3.974 ( 0.947 -7.905 -0.503) 7.978 4.142 ( 2.242 -9.847 -1.087) 10.157 4.376 ( 1.692 -0.582 1.620) 2.413 4.416 ( 0.301 -0.292 -1.197) 1.268 4.427 ( 2.029 -1.739 -0.661) 2.753 4.529 ( 0.895 0.654 1.358) 1.753 4.612 ( -0.813 -2.444 -0.482) 2.620 4.688 ( -0.783 -1.239 0.023) 1.466 4.718 ( -0.466 -0.744 -0.349) 0.944 4.784 ( 0.096 0.449 -0.896) 1.007 4.863 ( 0.413 -1.687 0.352) 1.772 4.946 ( -0.432 0.082 2.156) 2.201 5.068 ( 0.221 0.416 -0.659) 0.810 5.168 ( -1.652 -0.830 0.052) 1.849 5.281 ( -2.978 0.344 -0.151) 3.002 5.351 ( -1.333 -0.795 -0.497) 1.630 5.391 ( -0.834 -3.737 1.491) 4.109 5.430 ( 0.006 -1.446 0.932) 1.720 5.439 ( -0.873 -0.617 -0.430) 1.152 5.481 ( 0.975 -2.408 0.002) 2.598 5.569 ( -0.237 -0.455 0.744) 0.904 5.595 ( 0.167 1.183 -1.222) 1.709 5.754 ( -0.538 2.108 0.149) 2.181 5.839 ( -1.394 2.856 -1.940) 3.723 5.845 ( -0.894 1.669 0.306) 1.918 5.901 ( -0.853 2.368 0.067) 2.518 6.222 ( -0.681 0.760 0.237) 1.047 6.310 ( -0.489 0.959 0.226) 1.100 ======================= Grid point 181 (56/140) ======================= q-point: ( 0.46 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( 0.155 -1.592 -1.083) 1.931 1.773 ( 0.193 -4.560 0.374) 4.579 1.832 ( -2.284 0.450 0.241) 2.340 1.868 ( -0.001 -0.034 -2.344) 2.345 1.898 ( -2.124 3.602 -1.439) 4.422 1.983 ( -1.125 -2.305 2.487) 3.573 2.008 ( -0.512 0.238 -1.197) 1.323 2.058 ( -0.383 2.401 -0.527) 2.488 2.121 ( -0.326 -1.590 1.974) 2.556 2.261 ( -0.442 -0.356 0.109) 0.577 2.298 ( -2.135 -7.212 -0.934) 7.579 2.312 ( -0.989 1.701 0.691) 2.086 2.459 ( 1.699 -0.137 2.500) 3.026 2.514 ( 0.813 -0.604 6.354) 6.434 2.614 ( 1.678 0.350 0.947) 1.959 2.689 ( -0.577 -0.819 -1.615) 1.901 2.727 ( -1.180 -1.483 -2.726) 3.320 2.766 ( 1.607 4.737 -5.284) 7.277 2.860 ( -0.069 1.508 2.202) 2.670 2.904 ( 1.582 0.877 -3.944) 4.339 3.008 ( -0.208 2.061 -0.541) 2.141 3.185 ( -0.022 -3.433 1.495) 3.745 3.207 ( -2.892 -1.695 1.857) 3.832 3.281 ( 0.543 0.685 2.851) 2.982 3.558 ( 1.755 -2.802 -1.534) 3.645 3.616 ( -0.170 -1.057 -1.201) 1.609 3.642 ( 0.036 0.738 -0.325) 0.807 3.851 ( 0.501 -0.165 0.437) 0.685 3.909 ( 0.275 1.291 -0.532) 1.423 4.092 ( 0.456 -3.149 0.224) 3.190 4.318 ( 0.985 -4.921 -0.092) 5.020 4.399 ( 0.192 -0.516 -1.108) 1.237 4.422 ( 0.091 -0.906 -0.045) 0.912 4.463 ( 1.541 -0.615 0.134) 1.665 4.524 ( 1.259 0.164 1.603) 2.045 4.619 ( -2.401 1.036 -1.873) 3.216 4.731 ( 2.219 -2.490 2.674) 4.275 4.742 ( -0.264 -1.837 -0.997) 2.107 4.781 ( -0.183 -0.543 -0.523) 0.776 4.901 ( -0.547 0.285 0.989) 1.166 4.935 ( -1.532 -0.971 -0.212) 1.826 5.033 ( 1.390 2.648 0.129) 2.994 5.167 ( -1.120 0.341 -0.147) 1.180 5.281 ( -1.349 -1.647 -0.157) 2.135 5.334 ( -0.447 1.478 -0.229) 1.561 5.450 ( -0.605 -0.898 0.548) 1.213 5.466 ( 0.009 -1.870 0.480) 1.931 5.480 ( -0.067 -4.470 0.433) 4.491 5.502 ( 0.660 0.761 -0.033) 1.008 5.564 ( 0.500 0.094 -1.276) 1.373 5.579 ( -0.852 1.867 1.104) 2.330 5.732 ( 0.050 -0.296 0.304) 0.427 5.782 ( -0.219 1.876 -1.818) 2.622 5.804 ( -0.646 1.809 0.459) 1.975 5.869 ( -0.248 0.545 -0.497) 0.778 6.202 ( -0.458 0.679 0.330) 0.883 6.294 ( -0.075 0.516 0.135) 0.539 ======================= Grid point 183 (57/140) ======================= q-point: (-0.46 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.738 ( -0.632 0.140 -1.394) 1.537 1.784 ( 0.850 4.372 -0.602) 4.494 1.814 ( 0.380 1.481 0.259) 1.551 1.861 ( 2.330 -1.401 -0.105) 2.720 1.891 ( 1.249 -1.667 -2.009) 2.894 1.969 ( 1.513 2.064 2.616) 3.659 2.017 ( 0.683 2.814 -0.943) 3.045 2.041 ( 0.107 -2.723 1.519) 3.120 2.135 ( 0.579 0.346 0.236) 0.714 2.243 ( -0.426 4.335 0.928) 4.453 2.258 ( 0.332 0.856 0.440) 1.018 2.394 ( 0.147 -2.715 -2.886) 3.965 2.458 ( -0.923 1.446 3.559) 3.951 2.544 ( -0.523 -0.617 2.387) 2.520 2.593 ( 0.672 1.605 4.245) 4.588 2.695 ( 0.981 0.887 -2.136) 2.512 2.719 ( -0.210 -1.027 -3.155) 3.324 2.761 ( 1.520 -3.034 -4.403) 5.559 2.839 ( -2.293 1.300 1.646) 3.108 2.914 ( 1.115 -2.404 -2.590) 3.705 3.002 ( 0.501 -2.245 -0.732) 2.414 3.196 ( -0.025 3.573 0.039) 3.573 3.219 ( -1.905 0.059 2.295) 2.983 3.284 ( -0.822 -2.012 2.577) 3.371 3.573 ( 0.152 3.368 -2.322) 4.094 3.600 ( 0.299 0.355 -0.951) 1.058 3.636 ( 0.544 0.310 0.409) 0.748 3.866 ( -1.868 -1.767 -0.892) 2.722 3.886 ( -0.034 1.383 1.303) 1.901 4.097 ( 0.056 2.659 -0.064) 2.661 4.308 ( -1.851 7.701 0.890) 7.970 4.377 ( 0.059 -0.271 -0.336) 0.436 4.431 ( -0.538 0.239 -0.404) 0.715 4.457 ( -0.920 1.533 0.465) 1.847 4.546 ( -0.014 -0.709 -0.075) 0.713 4.595 ( 0.990 -0.186 0.314) 1.055 4.748 ( -1.240 1.281 -0.756) 1.937 4.764 ( 1.341 0.454 0.307) 1.449 4.787 ( -1.131 0.782 -1.927) 2.367 4.882 ( 1.495 -0.856 2.599) 3.118 4.929 ( 0.166 2.322 -0.015) 2.328 5.037 ( -1.181 -2.673 -0.040) 2.922 5.164 ( 0.804 -0.302 0.025) 0.860 5.283 ( 1.447 1.771 -0.277) 2.304 5.327 ( 0.450 -1.094 0.166) 1.194 5.454 ( -0.369 0.810 0.181) 0.909 5.471 ( 0.263 2.051 0.655) 2.169 5.484 ( 0.218 2.051 -0.247) 2.077 5.516 ( -0.356 0.649 -0.152) 0.756 5.536 ( -0.168 -0.459 -0.191) 0.525 5.586 ( 0.158 -1.266 0.642) 1.428 5.749 ( 0.369 -0.786 0.525) 1.015 5.757 ( -0.236 -0.064 -1.304) 1.327 5.803 ( 1.403 -1.605 0.042) 2.132 5.879 ( 0.571 -1.523 -0.895) 1.857 6.202 ( 0.217 -0.652 0.349) 0.771 6.294 ( 0.021 -0.542 0.118) 0.555 ======================= Grid point 184 (58/140) ======================= q-point: (-0.38 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( -0.534 9.055 0.566) 9.088 1.703 ( -0.671 3.583 -2.278) 4.299 1.782 ( 3.301 4.699 2.206) 6.152 1.857 ( 1.479 5.999 0.682) 6.217 1.893 ( 2.522 1.609 -0.210) 2.998 1.949 ( 0.107 3.621 1.491) 3.917 1.997 ( 2.880 -2.901 -0.897) 4.185 2.093 ( 2.510 -0.269 3.015) 3.932 2.138 ( 3.311 1.473 -2.518) 4.413 2.173 ( 0.836 -0.068 -0.355) 0.911 2.244 ( 0.624 0.883 0.291) 1.120 2.330 ( 3.579 6.504 -2.437) 7.814 2.490 ( -1.712 -3.093 2.985) 4.627 2.543 ( -2.967 -0.129 1.245) 3.220 2.579 ( 0.650 2.500 3.868) 4.651 2.673 ( 0.458 0.812 -4.888) 4.976 2.742 ( -0.726 -0.971 -4.431) 4.594 2.790 ( -0.457 1.370 2.652) 3.019 2.820 ( 1.037 -1.296 -0.268) 1.681 2.989 ( -0.817 -4.797 -1.910) 5.227 3.088 ( 1.712 -3.834 -1.281) 4.390 3.119 ( -1.860 0.841 1.457) 2.508 3.193 ( -1.328 1.917 0.701) 2.434 3.324 ( -0.443 -1.517 -0.263) 1.602 3.445 ( -0.608 9.607 -1.112) 9.690 3.535 ( 0.641 6.332 -0.494) 6.383 3.635 ( 0.101 0.796 0.260) 0.844 3.870 ( -0.569 1.090 2.351) 2.653 3.890 ( -4.487 -2.567 -0.379) 5.183 4.000 ( -0.953 6.679 -1.926) 7.016 4.084 ( -2.041 12.555 2.672) 12.998 4.378 ( -0.274 1.040 1.022) 1.483 4.412 ( -1.818 1.793 -0.071) 2.554 4.420 ( -1.539 0.117 -0.721) 1.703 4.550 ( -0.641 -0.209 0.058) 0.677 4.601 ( 1.682 1.484 0.297) 2.263 4.693 ( 0.199 2.017 -0.756) 2.163 4.761 ( 0.091 0.126 -2.543) 2.548 4.773 ( -0.605 -0.558 -0.362) 0.899 4.852 ( -1.446 2.813 1.342) 3.436 4.950 ( 2.804 -1.197 1.907) 3.596 5.065 ( -1.178 -0.569 -0.508) 1.404 5.169 ( 1.470 0.682 -0.010) 1.620 5.276 ( 2.992 -0.037 0.094) 2.994 5.344 ( 1.638 0.320 -0.022) 1.670 5.394 ( -0.083 3.448 1.465) 3.747 5.429 ( 0.613 2.476 0.487) 2.597 5.457 ( -0.330 1.296 -1.387) 1.927 5.489 ( -0.788 1.242 -0.197) 1.484 5.565 ( -0.154 -0.613 1.129) 1.294 5.587 ( 0.552 -0.312 -0.856) 1.065 5.769 ( 0.821 -1.299 -1.239) 1.974 5.792 ( 1.232 -2.466 1.755) 3.268 5.851 ( 1.319 -2.087 -0.731) 2.575 5.924 ( 1.260 -2.741 -1.065) 3.199 6.221 ( 0.505 -0.778 0.268) 0.966 6.312 ( 0.380 -0.988 0.164) 1.071 ======================= Grid point 185 (59/140) ======================= q-point: (-0.31 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( -2.258 11.813 3.075) 12.414 1.553 ( 1.736 12.691 -0.209) 12.811 1.653 ( -0.088 9.325 -0.044) 9.326 1.712 ( 0.910 9.655 -3.138) 10.193 1.848 ( 1.259 3.190 0.122) 3.432 1.877 ( 0.707 4.981 4.775) 6.936 2.045 ( 1.174 3.125 -0.282) 3.350 2.056 ( 3.788 1.534 -0.253) 4.095 2.125 ( 0.043 0.185 0.153) 0.243 2.206 ( 4.200 2.960 -1.689) 5.409 2.242 ( 3.410 1.808 1.399) 4.106 2.277 ( 7.470 -0.554 -1.524) 7.644 2.469 ( -0.450 7.202 0.102) 7.217 2.509 ( -3.882 3.105 1.023) 5.075 2.546 ( -1.359 -1.073 3.467) 3.875 2.657 ( -1.440 0.991 -3.798) 4.181 2.719 ( 0.271 0.733 -2.621) 2.735 2.769 ( 0.764 1.445 2.684) 3.142 2.851 ( -1.407 -0.832 -0.090) 1.637 2.991 ( -2.275 6.992 0.715) 7.387 3.090 ( -0.510 -1.562 -0.563) 1.737 3.123 ( -1.105 2.587 -3.897) 4.806 3.185 ( 0.050 10.193 -2.339) 10.458 3.226 ( 0.106 -1.459 0.942) 1.740 3.359 ( -0.204 0.534 -1.329) 1.447 3.410 ( 0.097 3.928 -0.623) 3.978 3.604 ( -0.590 2.104 0.380) 2.218 3.765 ( -0.605 7.919 2.288) 8.265 3.843 ( -3.654 8.522 -4.231) 10.192 3.933 ( -0.858 -0.493 4.702) 4.805 3.938 ( -2.885 -0.960 2.461) 3.912 4.333 ( -1.459 3.050 1.107) 3.558 4.359 ( -0.345 2.952 0.279) 2.985 4.418 ( -2.259 -0.954 -0.764) 2.568 4.536 ( -0.174 2.255 1.092) 2.511 4.603 ( 1.278 -1.927 0.072) 2.314 4.675 ( 0.422 0.603 -0.865) 1.136 4.748 ( -0.424 0.671 -3.315) 3.408 4.785 ( -1.289 -0.142 -0.362) 1.346 4.829 ( 0.611 -1.644 2.032) 2.684 4.964 ( 0.321 0.783 -0.045) 0.847 5.034 ( 1.128 3.493 -1.083) 3.827 5.179 ( 1.807 -1.110 0.024) 2.121 5.287 ( 1.875 0.970 0.443) 2.157 5.331 ( 0.838 0.914 0.426) 1.311 5.370 ( 1.060 0.455 0.211) 1.173 5.397 ( 0.026 0.993 2.968) 3.130 5.410 ( 0.046 2.191 -1.269) 2.532 5.481 ( 0.087 -0.463 -1.191) 1.281 5.553 ( -0.618 0.494 1.255) 1.484 5.624 ( 0.702 -2.156 -1.304) 2.615 5.798 ( 1.249 -0.974 -0.637) 1.707 5.850 ( 1.911 -2.255 2.286) 3.737 5.881 ( 0.753 -0.575 -1.049) 1.414 5.987 ( 1.479 -3.221 -1.385) 3.806 6.223 ( 0.119 1.071 0.027) 1.078 6.334 ( 1.270 -0.843 0.340) 1.562 ======================= Grid point 186 (60/140) ======================= q-point: (-0.23 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.194 ( -4.391 13.424 6.615) 15.596 1.266 ( 1.351 17.832 2.906) 18.118 1.427 ( 0.384 14.156 -1.803) 14.275 1.514 ( -0.895 9.606 -7.841) 12.432 1.736 ( -0.016 7.410 -1.567) 7.574 1.830 ( 1.352 3.821 4.971) 6.414 1.924 ( -0.155 10.121 2.186) 10.355 2.029 ( 2.173 6.347 3.382) 7.513 2.091 ( 4.288 4.031 0.288) 5.892 2.174 ( 1.171 4.471 -1.348) 4.814 2.186 ( 2.233 3.879 2.419) 5.087 2.268 ( 1.434 6.508 -2.628) 7.163 2.318 ( -0.542 6.635 0.461) 6.673 2.402 ( -2.518 4.249 -0.874) 5.016 2.538 ( -3.019 2.069 -2.493) 4.428 2.588 ( 0.818 4.151 -0.927) 4.331 2.659 ( 0.384 6.661 0.142) 6.673 2.732 ( -2.698 5.240 0.141) 5.896 2.784 ( -1.033 0.427 1.445) 1.827 2.898 ( -0.158 1.972 3.295) 3.843 2.977 ( -1.420 6.800 -3.663) 7.853 3.071 ( 3.458 2.589 -1.664) 4.629 3.105 ( 1.779 1.148 -4.751) 5.201 3.219 ( -1.704 1.339 0.199) 2.177 3.338 ( -2.662 -0.054 0.183) 2.669 3.410 ( 1.190 0.114 -2.390) 2.673 3.572 ( 2.700 2.177 1.268) 3.693 3.630 ( -4.162 6.525 -4.296) 8.852 3.669 ( -0.986 5.314 2.402) 5.915 3.939 ( -0.446 -2.013 2.788) 3.468 4.003 ( -1.723 -3.751 4.028) 5.767 4.262 ( -1.430 3.602 0.954) 3.992 4.307 ( 0.736 2.782 0.364) 2.901 4.404 ( -1.403 2.155 -0.597) 2.640 4.482 ( -1.280 2.783 3.372) 4.555 4.654 ( -0.572 -1.881 0.089) 1.968 4.671 ( 0.628 -0.957 -1.093) 1.583 4.713 ( 0.581 2.281 -1.432) 2.755 4.779 ( -1.033 0.157 -1.820) 2.098 4.899 ( 1.051 -1.488 -0.138) 1.827 4.930 ( 0.754 0.260 -2.018) 2.169 4.980 ( 1.508 1.539 -1.325) 2.529 5.214 ( 0.948 -1.414 -0.638) 1.818 5.276 ( 0.810 0.763 1.075) 1.547 5.323 ( 0.417 0.783 -1.266) 1.546 5.356 ( 0.062 -0.192 1.091) 1.110 5.403 ( 0.289 -0.723 2.318) 2.445 5.412 ( -0.723 -1.832 2.214) 2.964 5.498 ( 0.801 -1.399 -1.138) 1.973 5.558 ( -1.008 -1.428 0.535) 1.828 5.660 ( 0.575 -1.438 -1.142) 1.924 5.806 ( 0.596 0.604 -0.100) 0.854 5.870 ( 0.271 1.037 -1.710) 2.018 5.920 ( 2.356 -2.863 2.792) 4.641 6.053 ( 1.328 -3.063 -1.386) 3.614 6.180 ( -0.339 3.204 -0.460) 3.255 6.356 ( 2.104 -0.349 0.760) 2.264 ======================= Grid point 187 (61/140) ======================= q-point: (-0.15 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.919 ( -3.360 15.793 10.561) 19.294 0.928 ( -3.777 16.440 6.822) 18.195 1.144 ( 1.124 14.425 -5.507) 15.481 1.300 ( -1.169 11.279 -10.178) 15.237 1.549 ( -4.971 23.544 4.482) 24.477 1.610 ( -1.427 10.331 2.264) 10.672 1.669 ( -2.865 11.171 2.947) 11.903 1.911 ( 0.409 3.140 6.115) 6.886 2.026 ( 3.183 6.539 -1.657) 7.459 2.072 ( -1.092 6.927 -0.332) 7.021 2.126 ( 2.104 5.204 -3.283) 6.503 2.159 ( 3.138 5.340 2.925) 6.850 2.211 ( 1.472 3.114 -3.727) 5.075 2.290 ( -1.862 5.980 -0.868) 6.323 2.456 ( -1.232 2.300 -3.622) 4.464 2.542 ( -0.645 1.326 -3.106) 3.438 2.555 ( -0.433 2.885 -1.684) 3.368 2.640 ( -0.710 4.271 3.621) 5.644 2.782 ( 1.135 -0.514 4.584) 4.750 2.826 ( -0.637 2.779 -1.730) 3.335 2.962 ( -0.243 -1.307 0.925) 1.620 3.017 ( 3.778 5.427 -0.219) 6.616 3.101 ( 2.042 -1.031 -5.553) 6.006 3.185 ( -3.119 0.720 -0.128) 3.203 3.301 ( -3.404 1.200 -2.304) 4.282 3.391 ( 2.315 2.196 -1.401) 3.485 3.469 ( -2.128 5.333 -1.295) 5.887 3.516 ( 3.686 7.602 1.592) 8.597 3.651 ( -1.734 -2.266 2.015) 3.493 4.011 ( 0.554 -4.613 1.182) 4.794 4.057 ( -0.850 -1.582 2.197) 2.837 4.185 ( -3.393 3.129 0.187) 4.620 4.238 ( 0.023 6.000 0.912) 6.069 4.324 ( 2.909 5.459 2.304) 6.600 4.435 ( -2.512 1.575 1.183) 3.192 4.663 ( 2.922 2.300 -1.319) 3.946 4.675 ( -0.631 0.140 -0.666) 0.928 4.709 ( 1.358 -1.338 -0.878) 2.099 4.735 ( -1.300 3.669 -5.485) 6.726 4.851 ( 1.558 1.859 -0.140) 2.430 4.969 ( -0.169 -0.839 -0.785) 1.161 5.027 ( 1.378 -4.548 -1.175) 4.895 5.238 ( -0.508 -1.311 -1.275) 1.898 5.273 ( 0.307 0.166 0.704) 0.786 5.301 ( 0.754 1.035 -1.729) 2.151 5.388 ( 0.164 -1.438 1.242) 1.907 5.439 ( -1.871 -3.406 4.610) 6.029 5.462 ( -2.115 -3.496 2.967) 5.049 5.541 ( 0.921 -2.859 -1.484) 3.350 5.598 ( -1.109 -3.077 0.723) 3.350 5.680 ( 0.160 -0.702 -0.614) 0.946 5.789 ( 0.233 1.172 -0.238) 1.218 5.842 ( 0.055 1.252 -1.781) 2.178 5.994 ( 1.730 -2.928 2.771) 4.387 6.082 ( 1.018 3.542 -0.661) 3.744 6.131 ( -0.282 -1.726 -1.530) 2.324 6.373 ( 2.650 0.162 1.565) 3.081 ======================= Grid point 188 (62/140) ======================= q-point: (-0.08 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.602 ( -3.304 15.103 12.957) 20.172 0.650 ( -7.516 14.371 13.794) 21.290 0.904 ( 1.755 9.426 -10.765) 14.416 0.997 ( -4.604 18.271 -2.472) 19.003 1.045 ( -4.774 18.418 13.765) 23.484 1.502 ( -4.990 3.489 -3.083) 6.825 1.530 ( 1.610 0.955 0.382) 1.911 1.797 ( 1.879 12.057 -6.898) 14.018 1.851 ( -1.794 5.981 -4.966) 7.978 1.998 ( 0.664 1.582 4.865) 5.159 2.017 ( 1.479 4.734 3.139) 5.869 2.105 ( 0.688 6.624 -0.900) 6.720 2.129 ( 2.559 0.568 1.468) 3.005 2.287 ( 2.150 -3.323 -1.937) 4.406 2.434 ( -2.710 -0.960 -3.886) 4.834 2.504 ( -0.191 1.702 -0.830) 1.903 2.523 ( -2.446 -0.236 -3.214) 4.046 2.591 ( 1.149 1.547 4.214) 4.634 2.774 ( -1.468 1.306 -1.274) 2.342 2.852 ( 2.981 -0.332 4.462) 5.376 2.858 ( 1.110 6.307 0.813) 6.456 3.020 ( 0.191 -2.827 -1.317) 3.124 3.145 ( 0.080 -2.775 -0.023) 2.776 3.176 ( 0.369 -1.312 -3.173) 3.453 3.263 ( -0.955 1.282 -0.524) 1.682 3.347 ( -1.471 2.063 -3.640) 4.435 3.361 ( 0.256 7.485 -0.063) 7.489 3.427 ( 0.793 0.426 1.859) 2.066 3.691 ( -0.896 -1.811 1.972) 2.824 4.032 ( 0.028 6.752 1.197) 6.857 4.057 ( 0.574 2.087 0.837) 2.321 4.115 ( -3.722 1.866 -0.224) 4.170 4.150 ( -2.307 0.023 -0.828) 2.451 4.242 ( 4.931 5.221 -1.389) 7.314 4.402 ( -0.426 1.249 0.103) 1.324 4.503 ( -0.801 13.204 -7.793) 15.353 4.658 ( 2.517 1.163 -2.446) 3.698 4.697 ( -0.814 -0.268 -0.440) 0.964 4.742 ( 2.693 -0.868 1.576) 3.239 4.861 ( 1.524 -0.776 3.024) 3.474 4.980 ( -1.137 -0.844 -2.142) 2.568 5.098 ( 1.510 -1.930 1.878) 3.087 5.254 ( -1.205 -1.052 -2.635) 3.083 5.275 ( -0.212 -0.262 -0.050) 0.341 5.292 ( 1.504 0.125 -2.095) 2.582 5.406 ( -0.209 -0.653 0.223) 0.721 5.509 ( -3.111 -2.091 1.891) 4.199 5.545 ( -1.132 -7.381 5.415) 9.224 5.610 ( 0.207 -3.572 -0.577) 3.624 5.648 ( -1.288 -1.928 1.209) 2.615 5.694 ( -0.221 -1.056 -0.345) 1.133 5.780 ( -0.415 -1.219 1.299) 1.829 5.832 ( 0.196 -0.882 -1.819) 2.031 5.983 ( 0.273 5.844 -0.972) 5.931 6.047 ( 0.407 -1.145 1.469) 1.906 6.187 ( 1.078 -3.038 -0.685) 3.295 6.393 ( 2.354 -0.726 2.449) 3.473 ======================= Grid point 190 (63/140) ======================= q-point: ( 0.08 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.525 ( 3.552 -0.000 17.679) 18.033 0.553 ( 8.806 -0.000 15.819) 18.105 0.791 ( 6.390 -0.000 -13.834) 15.239 0.817 ( 9.352 -0.000 -10.889) 14.354 1.028 ( 11.350 -0.000 26.617) 28.936 1.348 ( -2.614 0.000 -6.089) 6.626 1.626 ( 5.510 -0.000 -13.078) 14.191 1.656 ( 2.090 -0.000 7.779) 8.055 1.712 ( -2.286 0.000 -6.314) 6.716 1.978 ( -0.884 0.000 0.391) 0.967 2.013 ( -0.662 0.000 -0.296) 0.725 2.014 ( -2.567 0.000 4.293) 5.002 2.173 ( 0.330 -0.000 -2.033) 2.060 2.325 ( -3.255 0.000 -2.585) 4.157 2.376 ( -0.488 0.000 0.741) 0.887 2.482 ( -0.250 0.000 -0.005) 0.251 2.501 ( -1.494 0.000 1.318) 1.992 2.635 ( 1.042 -0.000 4.423) 4.544 2.719 ( 0.287 -0.000 -5.374) 5.382 2.746 ( 0.367 -0.000 -0.030) 0.368 2.944 ( 0.235 -0.000 1.054) 1.080 3.049 ( -6.420 0.000 0.665) 6.455 3.172 ( 1.660 -0.000 1.998) 2.598 3.219 ( 1.821 -0.000 -3.768) 4.185 3.224 ( -0.184 0.000 -0.114) 0.217 3.249 ( -0.499 0.000 0.133) 0.516 3.282 ( -0.166 0.000 0.405) 0.438 3.454 ( -2.352 0.000 1.130) 2.609 3.729 ( 2.418 -0.000 1.509) 2.850 3.862 ( 0.035 -0.000 -0.004) 0.035 4.024 ( -0.211 0.000 0.084) 0.227 4.033 ( 0.081 -0.000 -0.114) 0.140 4.104 ( 3.634 -0.000 3.045) 4.741 4.304 ( -0.608 0.000 0.065) 0.611 4.322 ( -1.999 0.000 0.052) 1.999 4.387 ( -0.086 0.000 -0.039) 0.094 4.608 ( -4.946 0.000 -0.535) 4.975 4.708 ( 1.157 -0.000 -0.777) 1.394 4.800 ( 2.473 -0.000 -1.825) 3.073 4.915 ( 1.225 -0.000 -1.480) 1.922 4.981 ( 2.350 -0.000 -1.912) 3.030 5.138 ( -0.697 0.000 1.655) 1.796 5.231 ( -0.422 0.000 -2.750) 2.783 5.276 ( 0.367 -0.000 -0.196) 0.416 5.313 ( 1.761 -0.000 -2.352) 2.938 5.422 ( 1.518 -0.000 -0.080) 1.520 5.520 ( 0.950 -0.000 3.311) 3.445 5.640 ( -1.552 0.000 1.353) 2.059 5.648 ( 0.185 -0.000 -0.035) 0.188 5.652 ( 0.206 -0.000 0.032) 0.209 5.698 ( -0.126 0.000 -0.593) 0.606 5.822 ( -1.124 0.000 0.832) 1.398 5.858 ( -0.487 0.000 -0.003) 0.487 5.898 ( 0.490 -0.000 0.005) 0.490 6.036 ( -1.804 0.000 1.628) 2.430 6.237 ( 0.022 -0.000 -1.522) 1.522 6.365 ( -6.797 0.000 4.010) 7.891 ======================= Grid point 191 (64/140) ======================= q-point: ( 0.15 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.664 ( 3.670 -10.849 14.042) 18.120 0.779 ( 5.719 -9.656 14.471) 18.313 0.896 ( 5.507 -8.272 -12.534) 15.995 1.004 ( 9.665 -15.295 -9.390) 20.384 1.319 ( 11.451 -15.845 13.792) 23.925 1.387 ( 1.744 -6.317 0.020) 6.553 1.593 ( 3.778 -0.368 -2.734) 4.678 1.774 ( -1.535 -8.064 -3.633) 8.977 1.820 ( 1.781 -10.063 -0.553) 10.234 2.005 ( -1.225 -1.233 1.871) 2.554 2.026 ( -1.948 -5.345 -0.120) 5.690 2.094 ( -0.978 -6.973 0.608) 7.067 2.161 ( 0.228 -0.053 -7.139) 7.143 2.272 ( -2.739 2.146 -1.974) 4.000 2.373 ( -0.434 0.284 3.776) 3.811 2.481 ( -0.940 0.332 1.486) 1.789 2.499 ( -0.190 -1.375 -0.253) 1.411 2.655 ( -0.999 -1.686 1.789) 2.654 2.723 ( 1.512 -1.085 -2.309) 2.965 2.853 ( -0.287 -8.271 -0.329) 8.283 2.894 ( -3.112 3.782 -1.266) 5.059 2.990 ( -1.953 1.039 1.610) 2.737 3.155 ( -0.090 4.155 -4.510) 6.133 3.198 ( 3.805 -0.519 1.392) 4.084 3.239 ( -0.113 0.676 0.725) 0.997 3.301 ( -1.794 -4.158 -0.334) 4.541 3.349 ( -1.069 -7.498 0.457) 7.588 3.438 ( -0.133 -0.428 0.756) 0.879 3.711 ( 1.282 1.873 0.948) 2.460 4.040 ( -0.071 -7.808 0.604) 7.832 4.059 ( -0.917 -2.091 -0.404) 2.319 4.104 ( -0.818 -5.699 2.016) 6.100 4.149 ( 5.035 -1.936 3.253) 6.300 4.226 ( -3.458 -1.733 -3.709) 5.359 4.402 ( 0.259 -2.407 0.779) 2.543 4.461 ( -1.617 -9.035 -0.598) 9.198 4.589 ( -4.329 -0.955 0.254) 4.440 4.710 ( -0.787 -0.148 -1.699) 1.879 4.795 ( 3.154 1.734 -2.042) 4.138 4.908 ( 1.202 1.078 -1.418) 2.149 4.979 ( 2.157 1.137 -1.870) 3.073 5.104 ( -1.369 3.107 -0.561) 3.441 5.220 ( -0.605 0.334 -1.240) 1.420 5.277 ( 0.418 0.012 -0.095) 0.429 5.307 ( 1.192 0.889 -1.302) 1.976 5.421 ( 1.425 0.925 -0.243) 1.716 5.515 ( 0.511 2.263 5.055) 5.562 5.562 ( 0.206 6.897 1.931) 7.165 5.614 ( 0.306 2.317 0.289) 2.355 5.630 ( -0.912 2.888 0.990) 3.186 5.691 ( 0.176 0.567 0.062) 0.596 5.775 ( -0.942 1.650 1.603) 2.486 5.821 ( 0.040 0.421 -1.631) 1.685 5.983 ( 0.314 -5.677 -0.599) 5.717 6.047 ( -1.090 -0.007 1.147) 1.582 6.196 ( 0.170 3.451 -2.033) 4.009 6.347 ( -5.799 -0.896 2.475) 6.368 ======================= Grid point 192 (65/140) ======================= q-point: ( 0.23 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.966 ( 3.348 -15.172 8.681) 17.798 1.038 ( 4.083 -12.367 11.762) 17.549 1.103 ( 2.727 -12.773 -8.785) 15.740 1.276 ( 1.926 -10.787 -7.672) 13.376 1.581 ( 4.078 -9.129 0.202) 10.000 1.670 ( 0.294 -12.503 2.229) 12.704 1.735 ( 4.515 -13.456 1.666) 14.291 1.924 ( -0.102 -5.696 2.328) 6.154 2.005 ( -2.485 -8.881 4.542) 10.280 2.075 ( -1.230 -6.579 -3.865) 7.729 2.132 ( -2.867 -1.980 -2.792) 4.465 2.153 ( -1.264 -5.735 -0.346) 5.882 2.208 ( 2.314 -4.056 -7.859) 9.142 2.309 ( 2.767 -7.589 -0.403) 8.088 2.391 ( -0.364 -2.283 4.155) 4.755 2.497 ( 0.099 -2.283 1.164) 2.565 2.547 ( 0.208 -4.308 -0.209) 4.319 2.695 ( -1.968 -2.914 0.941) 3.640 2.768 ( 0.622 -2.960 0.658) 3.095 2.828 ( 0.337 0.879 -2.083) 2.286 2.972 ( -0.708 -1.082 3.321) 3.564 2.987 ( -2.795 -3.959 -1.112) 4.972 3.074 ( 0.300 2.586 -6.366) 6.877 3.232 ( 1.087 0.367 0.336) 1.196 3.259 ( 3.392 -2.940 3.022) 5.411 3.372 ( -1.667 -4.109 -1.346) 4.634 3.469 ( -1.503 -2.942 1.126) 3.490 3.489 ( -0.479 -6.840 0.295) 6.863 3.689 ( 1.560 0.730 -0.440) 1.778 4.017 ( -0.862 3.504 -0.159) 3.612 4.091 ( 1.281 -0.272 -0.214) 1.327 4.201 ( 4.792 -1.813 4.198) 6.624 4.234 ( -1.155 -6.003 0.643) 6.147 4.340 ( -2.531 -7.083 -2.743) 8.006 4.473 ( 3.041 -3.896 1.480) 5.160 4.600 ( -2.894 -3.040 1.431) 4.434 4.625 ( -2.219 -7.367 -0.516) 7.711 4.693 ( -2.125 0.589 -2.249) 3.150 4.765 ( 3.344 2.697 -1.796) 4.656 4.886 ( 0.691 1.160 -1.513) 2.028 4.961 ( 0.218 0.895 -0.464) 1.032 5.013 ( -0.656 5.167 -1.725) 5.487 5.210 ( -0.945 0.296 0.588) 1.152 5.283 ( 0.210 -0.494 -0.268) 0.600 5.292 ( -0.055 0.839 -0.846) 1.193 5.405 ( 0.223 1.265 -0.663) 1.445 5.425 ( -1.811 5.057 5.742) 7.863 5.492 ( 1.242 3.119 2.207) 4.018 5.541 ( -1.668 4.813 0.422) 5.112 5.578 ( 1.247 1.622 -0.634) 2.141 5.676 ( -0.116 0.900 -0.412) 0.997 5.783 ( -0.535 -1.623 0.726) 1.857 5.831 ( 0.306 -1.104 -1.252) 1.697 6.009 ( -1.621 2.717 0.692) 3.239 6.091 ( 0.505 -4.784 -1.174) 4.952 6.117 ( -0.296 3.931 -1.336) 4.162 6.340 ( -4.491 -0.811 1.033) 4.680 ======================= Grid point 193 (66/140) ======================= q-point: ( 0.31 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.261 ( 3.474 -12.145 3.944) 13.234 1.331 ( 0.800 -13.830 8.623) 16.318 1.350 ( 1.421 -13.062 -4.245) 13.808 1.472 ( -1.437 -12.107 -4.010) 12.835 1.736 ( 2.408 -6.799 -1.288) 7.327 1.876 ( -2.359 -8.400 -0.605) 8.746 1.916 ( -0.677 -3.876 -0.542) 3.972 2.012 ( -3.862 -4.148 4.156) 7.028 2.091 ( -5.200 -1.895 -3.426) 6.509 2.126 ( -2.240 -2.566 0.783) 3.495 2.181 ( -3.621 -4.450 -0.573) 5.765 2.246 ( -4.457 -4.018 -5.351) 8.040 2.329 ( 3.582 -6.132 1.124) 7.190 2.451 ( 3.992 -4.585 0.579) 6.107 2.515 ( 3.517 -6.718 3.808) 8.485 2.566 ( 0.170 -3.940 0.786) 4.022 2.665 ( 1.017 -4.609 -1.102) 4.847 2.738 ( -1.798 -3.862 -0.069) 4.260 2.830 ( 3.395 -4.313 -0.646) 5.527 2.915 ( 1.033 -9.205 -0.998) 9.317 2.978 ( -0.898 0.200 3.642) 3.757 3.017 ( -1.014 -1.916 -2.883) 3.607 3.070 ( 0.799 -2.341 -2.878) 3.795 3.243 ( 0.156 -1.464 -0.275) 1.497 3.317 ( 1.129 -0.264 3.369) 3.563 3.398 ( -0.215 0.865 -1.574) 1.808 3.550 ( -2.335 -5.440 0.127) 5.921 3.594 ( 3.707 -4.682 4.187) 7.293 3.736 ( 1.949 -5.199 -2.923) 6.275 3.970 ( 0.553 1.038 0.388) 1.238 4.082 ( 2.246 2.089 -1.089) 3.255 4.283 ( 3.753 -3.413 2.156) 5.512 4.318 ( -1.301 -3.966 -1.665) 4.493 4.417 ( 1.419 -2.033 -0.300) 2.497 4.544 ( 1.097 -1.002 -0.918) 1.746 4.632 ( -1.702 -1.532 0.390) 2.323 4.667 ( 0.981 3.142 0.345) 3.310 4.686 ( -0.510 -1.131 0.191) 1.255 4.764 ( 0.119 -2.129 -0.671) 2.235 4.889 ( 0.115 -0.024 0.463) 0.478 4.914 ( -1.221 1.552 -0.962) 2.196 4.967 ( -0.581 -1.503 -0.859) 1.826 5.189 ( -1.520 1.395 0.537) 2.131 5.275 ( -2.090 -0.050 0.053) 2.091 5.296 ( -0.206 -0.605 -0.063) 0.642 5.365 ( -0.584 0.758 2.251) 2.446 5.388 ( -0.425 0.542 -0.617) 0.925 5.441 ( -1.218 2.483 3.702) 4.621 5.462 ( -1.392 2.189 -0.641) 2.672 5.563 ( 1.187 0.658 -0.511) 1.450 5.655 ( -0.191 1.159 -0.821) 1.433 5.803 ( -1.009 -0.370 0.148) 1.085 5.853 ( 0.199 -0.987 -0.640) 1.193 5.938 ( -2.292 3.120 -0.449) 3.897 6.031 ( -1.112 3.943 -1.194) 4.267 6.177 ( 0.280 -3.469 0.051) 3.480 6.330 ( -3.133 -0.208 0.557) 3.189 ======================= Grid point 194 (67/140) ======================= q-point: ( 0.38 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.485 ( 1.123 -9.742 1.536) 9.926 1.538 ( 1.246 -8.331 0.933) 8.476 1.618 ( -1.017 -12.750 2.849) 13.104 1.696 ( -2.459 -11.912 -1.814) 12.298 1.838 ( -0.371 -2.531 -1.857) 3.162 1.957 ( -1.517 -4.838 -4.284) 6.638 1.998 ( -5.516 -1.572 1.089) 5.838 2.013 ( -1.317 -3.277 1.232) 3.741 2.108 ( -3.710 1.944 0.486) 4.217 2.136 ( -2.415 -2.559 1.655) 3.888 2.209 ( -4.369 -2.202 -1.106) 5.016 2.250 ( -3.318 -0.643 -4.167) 5.365 2.460 ( 1.087 -5.399 0.899) 5.581 2.540 ( -0.964 -1.956 2.650) 3.432 2.589 ( 2.165 -0.062 3.417) 4.046 2.616 ( -0.404 -2.417 1.210) 2.733 2.675 ( 4.510 1.742 -1.334) 5.015 2.821 ( 0.199 -3.557 -2.656) 4.444 2.904 ( 0.852 1.321 -4.919) 5.164 3.005 ( -1.472 0.879 2.226) 2.810 3.053 ( 2.888 -8.008 2.765) 8.951 3.085 ( 1.130 -0.742 0.274) 1.379 3.171 ( 0.960 -7.175 -0.061) 7.239 3.270 ( -0.762 -0.284 -1.939) 2.103 3.316 ( 0.408 -1.254 2.052) 2.439 3.397 ( -0.724 -4.732 0.028) 4.787 3.613 ( 0.757 -2.310 0.365) 2.458 3.780 ( 2.967 -10.775 2.410) 11.433 3.855 ( 3.742 -4.915 -1.250) 6.302 3.987 ( 1.864 -1.652 0.442) 2.530 4.038 ( 1.509 2.163 -3.804) 4.629 4.364 ( 2.142 -2.580 0.820) 3.452 4.382 ( 0.581 -3.504 -1.820) 3.991 4.432 ( 2.415 1.337 0.176) 2.766 4.547 ( 0.157 -0.320 0.551) 0.656 4.595 ( -0.161 2.474 0.155) 2.484 4.656 ( -1.757 -1.298 -1.120) 2.455 4.710 ( 0.549 -0.607 1.473) 1.686 4.791 ( 0.770 -0.209 -0.328) 0.863 4.847 ( -0.930 0.412 -0.862) 1.333 4.943 ( 0.090 -0.687 2.158) 2.266 5.024 ( -0.546 -4.295 -0.822) 4.407 5.156 ( -1.839 0.771 0.221) 2.007 5.268 ( -3.202 -0.210 -0.252) 3.218 5.308 ( -1.484 -1.510 0.931) 2.313 5.351 ( -1.762 -0.053 0.361) 1.800 5.411 ( 0.533 -1.799 -1.136) 2.194 5.418 ( -1.457 -0.469 2.704) 3.107 5.441 ( -0.113 -0.880 0.149) 0.900 5.562 ( 0.372 -0.043 0.313) 0.488 5.625 ( 0.073 1.681 -1.313) 2.134 5.783 ( -1.538 1.402 -0.227) 2.093 5.860 ( -0.349 0.297 -0.204) 0.501 5.874 ( -2.082 2.293 -1.458) 3.423 5.952 ( -1.307 3.448 0.122) 3.690 6.220 ( -0.329 -0.930 0.128) 0.994 6.318 ( -1.601 0.168 0.372) 1.652 ======================= Grid point 196 (68/140) ======================= q-point: ( 0.46 0.08 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.655 ( -0.026 -7.658 0.427) 7.670 1.674 ( 0.878 -4.919 0.803) 5.061 1.781 ( -3.939 -4.627 0.788) 6.127 1.844 ( -1.600 -1.279 -2.528) 3.254 1.867 ( -2.230 -7.095 -0.687) 7.469 1.965 ( -1.672 2.667 0.683) 3.221 2.001 ( -2.115 -0.297 -4.273) 4.777 2.066 ( -2.617 -2.358 0.827) 3.618 2.096 ( -3.706 -1.948 0.274) 4.196 2.151 ( 0.370 -3.320 2.756) 4.331 2.248 ( -0.546 -0.689 -0.793) 1.184 2.268 ( -1.371 -5.083 -0.597) 5.298 2.507 ( 0.539 1.326 0.933) 1.709 2.534 ( 1.184 1.176 6.948) 7.145 2.625 ( -2.376 -1.712 1.784) 3.429 2.644 ( 0.790 -2.384 -1.605) 2.980 2.684 ( 1.914 0.543 -2.761) 3.403 2.846 ( 1.981 3.102 -5.189) 6.362 2.877 ( -0.003 -1.736 -3.388) 3.807 2.945 ( -0.939 4.320 2.809) 5.238 3.065 ( 1.072 3.057 0.752) 3.326 3.154 ( -0.349 1.445 -0.759) 1.670 3.168 ( -0.715 -2.141 3.128) 3.857 3.289 ( 0.563 -0.955 2.560) 2.790 3.461 ( 1.243 -8.393 -1.470) 8.611 3.527 ( -1.253 -7.110 -0.302) 7.226 3.645 ( 0.142 -0.678 -0.361) 0.781 3.903 ( 3.299 1.871 0.823) 3.881 3.948 ( 2.489 2.708 -0.970) 3.804 3.992 ( 2.455 -7.190 0.280) 7.603 4.153 ( 1.065 -10.942 -2.429) 11.259 4.396 ( 0.711 -0.122 0.283) 0.775 4.413 ( 0.233 0.521 -0.274) 0.633 4.445 ( 1.737 -2.229 -0.862) 2.954 4.552 ( 2.092 0.937 1.909) 2.983 4.602 ( -0.708 -1.735 -1.120) 2.183 4.669 ( -1.517 -2.569 -0.215) 2.991 4.726 ( 0.765 -0.637 1.644) 1.921 4.781 ( 0.016 0.497 -0.946) 1.069 4.872 ( 0.655 -2.147 0.594) 2.322 4.936 ( -2.108 1.027 0.399) 2.379 5.075 ( 1.152 -0.158 -0.066) 1.164 5.150 ( -1.509 -1.024 0.139) 1.829 5.244 ( -3.536 -0.189 -0.198) 3.547 5.329 ( -2.239 -1.231 -0.453) 2.595 5.389 ( -0.620 -4.280 1.457) 4.563 5.429 ( -0.657 -0.944 -0.356) 1.204 5.434 ( 0.127 -1.381 1.165) 1.811 5.493 ( 1.122 -2.286 0.024) 2.546 5.569 ( -0.349 -0.488 0.693) 0.917 5.591 ( -0.088 1.425 -1.359) 1.971 5.749 ( -0.558 1.292 0.243) 1.428 5.812 ( -1.951 2.452 -1.738) 3.583 5.838 ( -0.447 1.764 -0.586) 1.912 5.893 ( -0.848 2.154 0.601) 2.392 6.215 ( -0.769 0.772 0.253) 1.118 6.306 ( -0.421 0.579 0.208) 0.745 ======================= Grid point 197 (69/140) ======================= q-point: ( 0.54 0.08 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( 0.398 -0.878 -0.430) 1.056 1.768 ( -1.040 -4.288 0.322) 4.424 1.824 ( 0.665 -2.618 0.218) 2.710 1.861 ( 0.495 -1.422 -2.890) 3.258 1.875 ( -1.172 3.405 -0.658) 3.660 1.965 ( -2.692 -4.132 0.256) 4.938 2.004 ( -0.132 -0.026 0.120) 0.180 2.054 ( -0.232 1.042 -0.240) 1.094 2.123 ( -0.572 -1.421 1.407) 2.080 2.255 ( -1.442 -1.933 0.728) 2.520 2.278 ( -0.099 -5.849 -1.187) 5.969 2.318 ( 0.753 1.042 2.387) 2.712 2.492 ( 2.313 0.699 2.582) 3.537 2.541 ( -0.058 -0.313 4.450) 4.461 2.631 ( 0.740 1.895 -0.427) 2.078 2.675 ( -4.883 -2.528 -2.734) 6.141 2.682 ( 0.261 -1.745 -0.873) 1.969 2.777 ( 3.197 3.902 -4.699) 6.893 2.850 ( -2.656 3.043 2.025) 4.518 2.896 ( -0.189 0.016 -3.855) 3.860 3.005 ( 0.082 2.084 -1.399) 2.511 3.179 ( -1.258 -2.248 2.391) 3.515 3.210 ( 0.411 -2.479 4.269) 4.954 3.294 ( 0.340 1.268 0.815) 1.545 3.569 ( 1.138 -2.715 -1.411) 3.264 3.608 ( -0.349 -1.244 -1.163) 1.738 3.640 ( -0.206 0.424 -0.549) 0.724 3.872 ( 2.482 2.198 1.079) 3.487 3.912 ( 0.864 1.247 -0.864) 1.746 4.106 ( 1.843 -2.320 0.050) 2.964 4.324 ( -0.155 -5.194 0.350) 5.208 4.383 ( -1.192 0.796 -1.652) 2.187 4.422 ( -0.475 -0.677 0.364) 0.904 4.478 ( 1.296 -0.083 -0.370) 1.351 4.545 ( 0.451 0.913 0.405) 1.096 4.596 ( -0.032 0.090 -0.190) 0.213 4.739 ( 0.060 -1.332 -0.067) 1.335 4.763 ( 0.909 -3.560 1.200) 3.865 4.776 ( 0.554 0.075 0.047) 0.561 4.884 ( -2.729 1.322 -0.361) 3.054 4.927 ( 0.240 -2.064 0.454) 2.127 5.048 ( 1.151 3.105 0.125) 3.314 5.155 ( -0.997 -0.469 -0.080) 1.104 5.267 ( -1.070 -3.034 -0.122) 3.220 5.326 ( -0.730 0.485 -0.138) 0.887 5.446 ( -0.450 -1.023 0.631) 1.284 5.468 ( 0.166 -1.755 0.193) 1.773 5.481 ( -0.125 -4.253 0.572) 4.293 5.509 ( 0.714 0.827 -0.025) 1.093 5.562 ( 0.018 0.103 -1.256) 1.260 5.574 ( -0.787 1.630 1.035) 2.085 5.733 ( -0.036 -0.120 0.590) 0.603 5.774 ( 0.087 0.769 -1.622) 1.797 5.797 ( -0.678 1.241 -0.225) 1.432 5.866 ( -0.141 0.332 -0.231) 0.428 6.198 ( -0.404 0.333 0.344) 0.626 6.294 ( -0.076 0.444 0.114) 0.465 ======================= Grid point 198 (70/140) ======================= q-point: (-0.38 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.729 ( -0.196 0.805 -0.908) 1.229 1.785 ( 0.139 5.099 -1.487) 5.313 1.827 ( 1.205 -1.079 1.646) 2.307 1.892 ( 2.274 -2.356 1.220) 3.495 1.902 ( 2.761 -2.234 -2.179) 4.167 1.984 ( -0.363 0.890 1.218) 1.552 2.020 ( 0.246 2.124 -0.779) 2.276 2.053 ( 1.245 -3.873 1.890) 4.486 2.138 ( 0.033 -0.741 -0.727) 1.038 2.252 ( 0.850 3.542 1.915) 4.115 2.269 ( 1.442 2.105 0.707) 2.648 2.384 ( -0.036 -4.341 -1.972) 4.768 2.465 ( 0.096 3.587 1.818) 4.022 2.534 ( -1.632 0.872 0.314) 1.877 2.604 ( -1.287 0.840 2.192) 2.677 2.690 ( -2.150 -1.662 -1.847) 3.286 2.717 ( 2.719 0.709 -1.646) 3.257 2.761 ( 1.290 -3.293 -3.964) 5.313 2.807 ( -3.897 0.164 2.489) 4.626 2.902 ( -1.078 -2.291 -3.098) 4.001 3.011 ( 1.084 -2.711 -0.044) 2.920 3.197 ( -0.759 0.590 0.778) 1.237 3.220 ( 1.060 4.762 1.937) 5.249 3.285 ( -0.843 -2.171 2.334) 3.298 3.561 ( -0.536 3.150 -2.775) 4.232 3.601 ( 0.360 0.880 -0.459) 1.055 3.641 ( 0.207 -0.024 0.123) 0.242 3.856 ( 0.452 0.695 -0.071) 0.832 3.892 ( 0.298 1.322 1.059) 1.720 4.100 ( 0.759 3.409 -0.458) 3.522 4.289 ( -2.420 7.950 1.279) 8.408 4.377 ( -0.179 -0.573 0.412) 0.728 4.418 ( -1.260 0.449 -0.352) 1.383 4.450 ( -0.641 2.850 0.211) 2.929 4.535 ( -0.787 -0.543 -0.944) 1.344 4.622 ( 2.305 -0.773 0.872) 2.583 4.732 ( -0.799 1.521 -0.751) 1.875 4.764 ( -1.216 0.437 -1.916) 2.311 4.779 ( 0.829 1.493 0.040) 1.708 4.895 ( -0.497 0.292 1.400) 1.514 4.944 ( 1.886 -0.291 1.008) 2.159 5.021 ( -1.436 -1.628 -0.314) 2.194 5.173 ( 0.799 -1.083 0.307) 1.380 5.298 ( 1.478 0.541 -0.260) 1.596 5.331 ( 0.128 -1.839 0.087) 1.845 5.452 ( -0.225 0.728 0.235) 0.797 5.474 ( -0.148 1.873 0.926) 2.094 5.486 ( 0.456 2.565 -0.410) 2.637 5.509 ( -0.524 0.737 -0.857) 1.246 5.535 ( -0.003 -0.600 0.285) 0.664 5.589 ( -0.061 -1.476 0.702) 1.636 5.749 ( -0.250 0.153 -1.499) 1.528 5.759 ( 0.651 -1.789 1.002) 2.152 5.816 ( 1.063 -2.088 -0.125) 2.346 5.881 ( 0.540 -1.870 -1.036) 2.205 6.205 ( 0.197 -0.962 0.359) 1.045 6.295 ( -0.000 -0.628 0.096) 0.635 ======================= Grid point 199 (71/140) ======================= q-point: (-0.31 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.645 ( -0.556 9.204 0.358) 9.228 1.686 ( -0.585 3.691 -2.493) 4.493 1.823 ( 2.532 4.532 2.304) 5.680 1.873 ( 0.963 5.962 0.961) 6.116 1.913 ( 1.273 2.982 0.161) 3.246 1.955 ( -0.270 2.826 2.216) 3.601 2.025 ( 2.575 -3.325 -0.858) 4.292 2.108 ( -1.026 -0.882 0.654) 1.502 2.163 ( 2.502 5.561 0.966) 6.174 2.201 ( 3.558 -3.955 -2.326) 5.806 2.268 ( 3.511 -0.733 1.464) 3.874 2.359 ( 3.155 4.583 -2.520) 6.108 2.474 ( -2.041 -2.848 -0.676) 3.568 2.522 ( -2.241 -0.476 3.691) 4.344 2.567 ( -3.162 2.240 0.798) 3.956 2.666 ( -0.844 2.116 -2.046) 3.062 2.732 ( 3.195 -0.147 -5.417) 6.291 2.799 ( -0.731 0.161 4.388) 4.452 2.828 ( 0.859 -2.723 -0.535) 2.905 2.969 ( -1.372 -4.946 -1.448) 5.333 3.094 ( -0.015 2.749 -3.042) 4.100 3.107 ( -0.716 -2.416 1.839) 3.120 3.184 ( -1.039 0.551 1.544) 1.941 3.318 ( -0.213 -0.784 -1.488) 1.695 3.431 ( -1.002 9.960 -1.317) 10.097 3.542 ( 0.848 5.860 0.155) 5.923 3.634 ( -0.358 1.144 -0.022) 1.199 3.848 ( -2.687 -0.108 -1.226) 2.955 3.881 ( 0.387 0.178 3.867) 3.890 3.980 ( -0.701 9.311 -1.842) 9.517 4.081 ( -1.177 10.414 3.418) 11.023 4.373 ( -1.136 1.662 0.158) 2.020 4.397 ( -1.175 1.264 0.549) 1.811 4.402 ( -0.879 0.509 -0.357) 1.076 4.542 ( -0.565 -0.526 -0.749) 1.075 4.617 ( 1.204 1.798 -0.082) 2.165 4.698 ( 0.655 1.516 -0.296) 1.678 4.745 ( -0.486 0.347 -2.497) 2.568 4.777 ( 0.593 -0.257 0.370) 0.745 4.843 ( -1.086 2.303 1.633) 3.025 4.972 ( 0.324 -0.285 -0.319) 0.537 5.057 ( 0.002 -1.355 0.382) 1.408 5.184 ( 1.151 0.441 0.067) 1.234 5.305 ( 2.160 -0.233 0.119) 2.175 5.357 ( 0.735 0.052 -0.073) 0.741 5.398 ( -0.157 2.941 1.543) 3.324 5.439 ( 0.814 2.152 0.065) 2.302 5.447 ( -0.506 1.757 -1.001) 2.085 5.480 ( -0.598 1.034 -0.226) 1.215 5.567 ( -0.262 -0.581 1.168) 1.331 5.590 ( 0.515 -0.290 -0.891) 1.069 5.771 ( 0.310 -2.129 -1.086) 2.410 5.813 ( 1.246 -2.814 1.941) 3.639 5.862 ( 1.038 -1.752 -0.560) 2.112 5.931 ( 0.908 -3.024 -1.520) 3.504 6.227 ( 0.320 -0.709 0.268) 0.822 6.316 ( 0.279 -1.366 0.145) 1.401 ======================= Grid point 200 (72/140) ======================= q-point: (-0.23 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.435 ( -1.607 12.331 3.178) 12.835 1.557 ( -0.042 10.014 -2.624) 10.353 1.649 ( 0.022 12.270 -0.342) 12.275 1.721 ( 1.458 10.741 -1.027) 10.888 1.855 ( 0.220 4.445 -0.112) 4.452 1.908 ( 0.913 3.177 5.832) 6.704 2.050 ( 0.453 4.121 -1.825) 4.530 2.082 ( 1.175 0.297 -0.904) 1.512 2.132 ( 0.827 -0.425 2.560) 2.723 2.246 ( 3.898 0.162 -1.242) 4.094 2.292 ( 4.520 3.399 0.713) 5.700 2.345 ( 4.751 0.237 -0.534) 4.787 2.434 ( -3.958 5.503 -0.894) 6.838 2.486 ( -2.453 5.069 0.970) 5.715 2.530 ( -2.680 -0.297 1.121) 2.921 2.632 ( -0.801 0.243 -2.201) 2.355 2.730 ( 3.301 0.720 -3.249) 4.687 2.796 ( 1.447 1.706 3.974) 4.560 2.835 ( -1.197 4.252 1.043) 4.538 2.968 ( -2.153 3.562 0.850) 4.248 3.078 ( -0.869 -3.021 -1.653) 3.552 3.095 ( -1.142 2.736 -3.820) 4.835 3.170 ( -0.204 12.170 -4.034) 12.823 3.240 ( 0.629 -2.543 3.389) 4.284 3.351 ( -0.049 -0.676 -2.449) 2.541 3.410 ( 0.147 5.846 -0.219) 5.852 3.596 ( -0.895 1.884 -0.218) 2.097 3.759 ( -1.973 6.404 0.621) 6.730 3.779 ( -3.582 8.585 -5.076) 10.597 3.923 ( -0.391 -2.355 4.093) 4.739 3.975 ( 2.254 2.281 6.560) 7.302 4.315 ( -1.892 3.067 -0.320) 3.618 4.366 ( 0.778 2.331 1.302) 2.781 4.395 ( -1.325 -0.505 -0.407) 1.476 4.536 ( -0.442 1.420 0.683) 1.636 4.615 ( 0.994 -1.390 -0.188) 1.719 4.672 ( -0.174 1.048 -1.100) 1.529 4.734 ( -0.120 0.470 -2.419) 2.467 4.769 ( -1.040 0.255 -0.437) 1.157 4.848 ( 1.161 -2.014 2.344) 3.301 4.955 ( -1.171 1.418 -1.717) 2.515 5.046 ( 1.389 2.745 -0.584) 3.132 5.193 ( 0.905 -1.020 -0.233) 1.383 5.304 ( 0.835 1.417 0.829) 1.842 5.338 ( 0.260 0.978 -0.016) 1.012 5.379 ( 0.492 1.235 -0.004) 1.330 5.404 ( -0.595 0.968 1.825) 2.150 5.412 ( 0.687 1.026 0.420) 1.304 5.478 ( 0.203 -0.812 -1.309) 1.554 5.550 ( -0.651 0.794 1.257) 1.623 5.626 ( 0.657 -2.132 -1.264) 2.564 5.807 ( 0.576 -1.126 -0.186) 1.279 5.871 ( 0.753 -1.521 0.104) 1.700 5.889 ( 1.073 -1.386 1.063) 2.050 5.995 ( 0.950 -3.358 -1.713) 3.888 6.224 ( 0.011 1.343 0.030) 1.343 6.347 ( 0.686 -1.423 0.315) 1.611 ======================= Grid point 201 (73/140) ======================= q-point: (-0.15 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.179 ( -2.717 14.131 6.172) 15.658 1.284 ( 0.097 17.560 2.412) 17.725 1.411 ( -1.194 12.717 -4.087) 13.411 1.499 ( 2.173 12.076 -4.900) 13.212 1.729 ( -0.356 7.777 -1.003) 7.850 1.857 ( 0.442 5.959 4.563) 7.519 1.934 ( 0.278 8.160 1.417) 8.287 2.057 ( 0.360 7.772 3.275) 8.442 2.134 ( 2.645 2.973 2.333) 4.613 2.168 ( -0.749 8.750 1.344) 8.884 2.241 ( 5.636 4.352 -0.128) 7.122 2.260 ( -0.643 6.240 -1.978) 6.578 2.293 ( -3.527 5.013 0.625) 6.161 2.388 ( 0.186 4.832 -3.455) 5.943 2.501 ( -1.981 2.010 -1.656) 3.272 2.590 ( 0.382 5.089 -2.416) 5.646 2.653 ( -0.641 5.730 -1.344) 5.920 2.718 ( -1.107 3.589 3.397) 5.064 2.787 ( 0.617 1.404 1.524) 2.162 2.911 ( 0.737 5.017 1.309) 5.237 2.952 ( -1.297 3.842 -0.843) 4.142 3.083 ( 2.033 -0.585 -7.459) 7.754 3.106 ( 0.100 0.569 -1.912) 1.997 3.216 ( 0.706 4.302 2.036) 4.811 3.308 ( -2.645 1.455 -0.161) 3.023 3.412 ( 0.824 -1.164 -2.048) 2.495 3.564 ( -3.195 3.305 -2.490) 5.228 3.612 ( 1.725 3.547 -0.058) 3.944 3.668 ( -0.474 4.145 1.463) 4.421 3.942 ( -0.366 -1.797 1.871) 2.619 4.020 ( 1.140 -2.374 5.669) 6.250 4.235 ( -2.633 3.826 -1.464) 4.870 4.325 ( 1.225 3.210 1.062) 3.597 4.398 ( 0.274 0.066 0.709) 0.763 4.482 ( -0.848 4.137 3.246) 5.326 4.651 ( -0.075 -1.755 0.213) 1.769 4.671 ( 0.122 -1.081 -1.177) 1.603 4.710 ( 0.068 1.263 -1.918) 2.298 4.765 ( -0.255 0.484 -1.352) 1.458 4.900 ( -0.131 0.793 -1.535) 1.733 4.934 ( 0.715 -3.539 -0.399) 3.632 4.988 ( 0.998 3.027 -1.937) 3.730 5.217 ( 0.109 -0.933 -0.642) 1.137 5.286 ( 0.254 0.825 1.033) 1.346 5.321 ( 0.040 0.950 -1.207) 1.536 5.361 ( -0.136 -0.580 1.691) 1.792 5.405 ( -0.183 -0.484 -0.806) 0.958 5.421 ( -0.580 -1.148 4.876) 5.043 5.502 ( 0.823 -1.696 -1.775) 2.589 5.549 ( -1.042 -1.130 1.121) 1.902 5.661 ( 0.432 -1.373 -1.087) 1.803 5.812 ( 0.310 0.773 0.326) 0.895 5.865 ( 0.012 1.211 -1.915) 2.266 5.949 ( 1.048 -3.042 2.495) 4.072 6.060 ( 0.931 -3.272 -1.569) 3.746 6.176 ( -0.207 3.555 -0.309) 3.574 6.375 ( 0.628 -0.967 0.680) 1.339 ======================= Grid point 202 (74/140) ======================= q-point: (-0.08 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.899 ( -3.594 15.169 7.372) 17.245 0.945 ( -1.180 17.623 9.206) 19.918 1.135 ( 0.505 14.218 -5.887) 15.397 1.273 ( 2.833 12.862 -9.144) 16.033 1.556 ( 2.284 23.872 6.481) 24.842 1.591 ( -3.025 10.954 1.487) 11.461 1.660 ( -0.846 12.366 3.341) 12.837 1.924 ( -0.906 3.442 2.816) 4.539 2.036 ( 0.253 10.512 -3.443) 11.064 2.069 ( 0.599 5.954 0.641) 6.018 2.139 ( 1.690 4.055 -0.870) 4.478 2.189 ( 0.628 5.706 -0.976) 5.823 2.227 ( 3.447 0.246 -0.371) 3.476 2.263 ( -1.981 5.778 -1.724) 6.347 2.428 ( -1.674 2.781 -3.014) 4.430 2.516 ( -1.552 1.750 -2.344) 3.311 2.550 ( -0.111 3.510 -0.723) 3.585 2.662 ( 1.199 3.804 5.270) 6.609 2.803 ( -0.660 -0.175 1.374) 1.534 2.811 ( 0.532 0.525 -2.286) 2.405 2.960 ( -0.908 -1.081 2.566) 2.929 3.039 ( 0.200 6.245 -1.412) 6.406 3.108 ( 2.774 -1.976 -6.302) 7.163 3.165 ( -0.031 1.340 1.295) 1.864 3.259 ( -2.681 0.936 -1.649) 3.284 3.414 ( 2.393 3.058 -0.313) 3.895 3.437 ( -2.372 3.776 -1.868) 4.835 3.551 ( 0.461 8.283 1.311) 8.399 3.647 ( 0.217 -2.729 1.606) 3.174 4.021 ( 0.319 -5.078 0.823) 5.154 4.066 ( 0.677 -0.989 3.253) 3.466 4.144 ( -2.668 3.663 -1.413) 4.747 4.241 ( -0.187 6.413 0.984) 6.491 4.373 ( 3.139 5.484 3.410) 7.180 4.416 ( -1.555 0.915 0.220) 1.818 4.656 ( -1.658 3.260 -1.208) 3.852 4.671 ( -1.312 0.697 -1.773) 2.313 4.704 ( 0.955 1.711 -1.515) 2.476 4.731 ( 1.821 -0.746 -2.738) 3.372 4.874 ( 2.063 0.552 -0.155) 2.141 4.957 ( -0.404 -0.113 -2.203) 2.243 5.035 ( 0.458 -5.152 -0.676) 5.216 5.227 ( -0.602 -0.656 -0.896) 1.263 5.278 ( 0.303 0.404 0.259) 0.568 5.301 ( 0.261 0.700 -1.328) 1.524 5.394 ( 0.173 -0.919 1.192) 1.516 5.432 ( -1.791 -4.154 3.144) 5.509 5.459 ( -0.846 -2.239 4.083) 4.733 5.546 ( 1.237 -2.868 -1.873) 3.642 5.587 ( -1.603 -3.100 1.509) 3.802 5.679 ( 0.114 -0.635 -0.527) 0.833 5.789 ( -0.158 1.425 0.090) 1.437 5.836 ( 0.154 1.090 -1.745) 2.063 6.014 ( 0.298 -2.714 2.059) 3.420 6.088 ( 0.471 4.882 -0.817) 4.972 6.127 ( 0.416 -3.193 -1.258) 3.457 6.391 ( -0.360 -0.470 1.341) 1.466 ======================= Grid point 205 (75/140) ======================= q-point: ( 0.15 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.632 ( 4.527 -0.000 15.077) 15.742 0.713 ( 10.691 -0.000 8.581) 13.709 0.853 ( 12.682 -0.000 -7.992) 14.990 0.910 ( 14.314 -0.000 -11.326) 18.253 1.255 ( 13.249 -0.000 9.496) 16.301 1.363 ( 7.921 -0.000 9.346) 12.252 1.629 ( 3.116 -0.000 -10.571) 11.021 1.663 ( -2.224 0.000 -4.904) 5.385 1.711 ( 2.390 -0.000 6.504) 6.930 1.950 ( -2.945 0.000 -2.001) 3.561 2.005 ( -1.539 0.000 2.856) 3.244 2.009 ( -0.694 0.000 0.844) 1.092 2.141 ( -1.396 0.000 -9.989) 10.086 2.278 ( -3.429 0.000 -1.525) 3.753 2.385 ( -1.548 0.000 7.339) 7.501 2.478 ( -0.512 0.000 -0.009) 0.512 2.493 ( -1.217 0.000 2.168) 2.487 2.641 ( -0.387 0.000 -0.742) 0.837 2.728 ( 2.524 -0.000 -0.959) 2.700 2.751 ( 0.538 -0.000 -0.040) 0.540 2.900 ( -7.362 0.000 -5.663) 9.288 2.993 ( -2.492 0.000 1.728) 3.032 3.195 ( -0.617 0.000 2.369) 2.448 3.221 ( -0.278 0.000 0.091) 0.293 3.230 ( 3.469 -0.000 -4.114) 5.381 3.241 ( -0.884 0.000 -0.068) 0.886 3.302 ( 0.833 -0.000 5.368) 5.433 3.437 ( -1.200 0.000 0.957) 1.535 3.759 ( 1.959 -0.000 0.882) 2.149 3.862 ( 0.053 -0.000 0.003) 0.053 4.021 ( -0.273 0.000 0.107) 0.294 4.033 ( 0.038 -0.000 -0.140) 0.145 4.172 ( 4.070 -0.000 3.428) 5.321 4.278 ( -3.144 0.000 -1.559) 3.510 4.296 ( -0.877 0.000 0.063) 0.879 4.384 ( -0.347 0.000 -0.037) 0.349 4.556 ( -4.375 0.000 0.798) 4.447 4.695 ( -2.273 0.000 -1.957) 2.999 4.827 ( 4.033 -0.000 -1.745) 4.394 4.925 ( 1.556 -0.000 -1.269) 2.007 4.998 ( 1.710 -0.000 -2.459) 2.995 5.124 ( -1.604 0.000 -1.359) 2.102 5.218 ( -0.463 0.000 -1.275) 1.357 5.282 ( 0.813 -0.000 0.052) 0.815 5.323 ( 1.417 -0.000 -1.061) 1.771 5.442 ( 1.928 -0.000 -0.616) 2.024 5.555 ( 2.310 -0.000 4.218) 4.809 5.628 ( -1.618 0.000 2.052) 2.613 5.650 ( 0.326 -0.000 -0.029) 0.328 5.655 ( 0.361 -0.000 0.026) 0.362 5.698 ( 0.298 -0.000 -0.023) 0.299 5.815 ( -0.943 0.000 1.183) 1.513 5.852 ( -0.656 0.000 -0.002) 0.656 5.904 ( 0.662 -0.000 0.005) 0.662 6.018 ( -2.842 0.000 1.955) 3.449 6.226 ( -0.500 0.000 -1.361) 1.450 6.310 ( -5.561 0.000 1.592) 5.784 ======================= Grid point 206 (76/140) ======================= q-point: ( 0.23 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.763 ( 4.787 -9.009 12.694) 16.285 0.903 ( 9.012 -8.842 -0.179) 12.626 0.953 ( 11.578 -4.675 0.014) 12.486 1.072 ( 8.202 -10.199 -7.659) 15.164 1.415 ( 8.181 -8.799 0.358) 12.020 1.517 ( 9.888 -7.133 9.243) 15.300 1.615 ( 2.472 -1.409 -4.062) 4.959 1.758 ( 0.637 -10.051 -0.362) 10.078 1.837 ( 0.349 -8.448 3.689) 9.225 1.985 ( -2.525 -4.239 -2.397) 5.486 2.008 ( -1.909 -2.595 1.846) 3.713 2.080 ( -2.089 -5.639 -0.380) 6.025 2.125 ( 1.544 -2.041 -13.080) 13.328 2.236 ( -2.430 0.866 -0.745) 2.685 2.389 ( -1.346 -0.116 8.221) 8.332 2.480 ( -0.601 -0.138 2.033) 2.124 2.498 ( 0.216 -1.267 -0.420) 1.352 2.641 ( -0.432 -1.236 -0.688) 1.479 2.742 ( 0.803 -0.971 1.639) 2.067 2.819 ( -6.136 -0.979 -4.194) 7.496 2.858 ( 0.286 -5.060 -1.601) 5.315 2.982 ( -0.719 0.368 0.996) 1.282 3.134 ( -1.016 4.387 -3.592) 5.760 3.236 ( -0.840 -0.428 5.301) 5.384 3.250 ( 3.467 -0.874 -2.154) 4.174 3.280 ( -1.471 -3.667 -0.443) 3.976 3.346 ( -0.124 -5.042 1.757) 5.341 3.443 ( 0.408 -0.984 1.010) 1.468 3.727 ( 1.251 2.093 0.248) 2.450 4.034 ( -1.146 -7.050 -0.211) 7.146 4.053 ( 0.041 -3.125 -0.148) 3.129 4.094 ( -2.383 -5.772 1.402) 6.400 4.160 ( -3.642 -3.493 -3.905) 6.381 4.238 ( 5.622 1.056 4.697) 7.402 4.407 ( -0.008 -5.218 1.007) 5.314 4.438 ( -1.707 -7.392 -0.624) 7.612 4.549 ( -3.286 -1.416 1.566) 3.906 4.679 ( -2.505 -0.005 -2.130) 3.289 4.831 ( 4.478 1.781 -2.034) 5.231 4.916 ( 0.544 1.335 -1.609) 2.160 4.985 ( 0.118 1.369 -1.640) 2.140 5.087 ( -0.364 2.844 -2.297) 3.674 5.211 ( -0.691 0.246 0.485) 0.879 5.283 ( 0.682 0.293 -0.050) 0.744 5.317 ( 1.309 1.204 -0.780) 1.942 5.434 ( 1.102 1.424 -0.846) 1.989 5.536 ( -1.282 4.774 6.965) 8.541 5.574 ( 1.427 4.132 -0.118) 4.373 5.618 ( -0.854 3.320 2.709) 4.369 5.632 ( 1.616 2.568 -1.108) 3.230 5.694 ( 0.241 0.830 0.217) 0.891 5.772 ( -0.560 1.609 1.575) 2.321 5.815 ( 0.004 0.174 -1.685) 1.694 5.985 ( 0.190 -5.340 -0.248) 5.349 6.035 ( -1.754 -0.676 0.657) 1.992 6.190 ( 0.403 3.449 -1.891) 3.953 6.288 ( -5.761 -1.182 0.409) 5.895 ======================= Grid point 207 (77/140) ======================= q-point: ( 0.31 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.038 ( 2.885 -14.299 9.799) 17.573 1.105 ( 5.462 -10.361 -8.186) 14.290 1.157 ( 9.382 -8.592 5.607) 13.903 1.276 ( 2.123 -9.307 -1.642) 9.687 1.633 ( 4.165 -5.566 -1.529) 7.117 1.676 ( 0.519 -10.451 1.584) 10.583 1.770 ( 1.761 -10.556 -0.830) 10.734 1.925 ( -1.289 -4.145 -0.299) 4.351 1.998 ( -2.453 -7.855 5.785) 10.059 2.030 ( -4.596 -4.050 -0.878) 6.188 2.082 ( -2.791 -3.243 -6.359) 7.665 2.122 ( -2.811 -4.692 -2.004) 5.825 2.235 ( 5.535 -6.070 -5.227) 9.736 2.330 ( 1.907 -11.576 -0.855) 11.763 2.418 ( 1.286 -1.822 6.391) 6.769 2.508 ( 0.707 -2.568 2.216) 3.464 2.551 ( 0.885 -4.797 -0.380) 4.893 2.684 ( -0.073 -2.714 1.788) 3.251 2.776 ( -1.231 -2.464 1.684) 3.228 2.807 ( -1.715 -2.759 -4.067) 5.205 2.952 ( -1.775 -3.485 -1.389) 4.150 2.980 ( -0.030 -0.414 1.748) 1.796 3.058 ( 0.514 1.747 -4.680) 5.022 3.243 ( -0.399 -0.023 2.751) 2.780 3.302 ( 2.652 -2.354 1.416) 3.819 3.363 ( 1.014 -4.561 -0.340) 4.685 3.431 ( -3.618 -3.685 0.901) 5.242 3.518 ( 2.807 -6.556 1.035) 7.207 3.700 ( 0.929 1.162 -0.717) 1.651 4.002 ( -1.798 2.009 -0.641) 2.771 4.108 ( 1.702 -1.007 -0.599) 2.066 4.220 ( -1.358 -5.536 -0.196) 5.703 4.255 ( 2.280 -2.284 0.877) 3.344 4.317 ( 0.359 -7.768 -0.451) 7.789 4.507 ( 1.987 -3.902 0.368) 4.395 4.577 ( -2.926 -3.508 2.839) 5.379 4.595 ( -2.305 -8.528 -0.467) 8.846 4.662 ( -1.730 -0.295 -1.177) 2.113 4.792 ( 2.305 3.965 -1.729) 4.902 4.885 ( -0.019 1.144 -1.914) 2.230 4.954 ( -0.475 1.450 -0.541) 1.619 5.008 ( 0.554 4.765 -1.063) 4.913 5.201 ( -1.418 0.575 1.303) 2.010 5.285 ( 0.362 -0.324 -0.241) 0.543 5.290 ( 0.475 1.948 -0.881) 2.190 5.400 ( -0.647 2.224 -0.672) 2.412 5.430 ( -1.338 4.396 5.608) 7.250 5.512 ( 0.855 4.224 1.913) 4.716 5.525 ( -1.680 4.932 1.401) 5.396 5.595 ( 2.500 2.072 -1.735) 3.681 5.672 ( -0.249 1.129 -0.295) 1.193 5.781 ( -0.397 -1.310 0.840) 1.606 5.829 ( 0.072 -1.327 -1.032) 1.683 5.988 ( -2.249 3.164 -0.417) 3.904 6.085 ( 0.046 -1.960 -3.180) 3.736 6.117 ( 0.323 1.466 1.080) 1.849 6.291 ( -4.765 -1.702 0.387) 5.074 ======================= Grid point 209 (78/140) ======================= q-point: ( 0.38 0.15 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.312 ( 3.442 -10.124 1.313) 10.773 1.348 ( 0.954 -13.454 -0.001) 13.488 1.379 ( 2.520 -11.497 0.870) 11.802 1.468 ( 2.185 -9.733 3.743) 10.655 1.750 ( 0.935 -6.120 -2.690) 6.750 1.841 ( -2.268 -6.703 -2.580) 7.532 1.905 ( -1.406 -2.658 -0.359) 3.028 1.972 ( -6.060 -3.795 2.139) 7.463 2.015 ( -6.186 -3.181 -3.074) 7.605 2.112 ( -0.734 -1.625 -0.039) 1.784 2.148 ( -3.086 -4.138 3.028) 5.985 2.183 ( -2.822 -3.624 -4.532) 6.453 2.347 ( 0.337 -4.978 -4.170) 6.503 2.498 ( 3.680 -3.554 3.824) 6.388 2.566 ( 2.217 -4.437 1.885) 5.306 2.587 ( 2.401 -6.758 4.690) 8.569 2.673 ( 1.496 -3.244 -0.751) 3.650 2.719 ( -0.493 -4.092 -2.215) 4.679 2.856 ( 0.688 -7.646 -0.904) 7.730 2.915 ( -1.025 -7.577 -0.610) 7.670 2.974 ( -0.307 -0.760 1.560) 1.762 3.012 ( 0.387 -3.577 1.047) 3.747 3.071 ( 1.568 -2.830 -3.803) 4.993 3.249 ( 0.587 -0.361 1.267) 1.442 3.337 ( 0.267 0.420 3.166) 3.205 3.391 ( -0.330 1.244 -0.907) 1.574 3.537 ( 0.369 -7.128 -0.299) 7.144 3.652 ( 3.527 -4.045 4.593) 7.064 3.740 ( 1.103 -6.816 -3.399) 7.696 3.974 ( 0.311 0.409 -0.336) 0.614 4.104 ( 2.064 1.945 -2.217) 3.600 4.304 ( 0.467 -4.260 -1.633) 4.586 4.322 ( 2.349 -3.061 0.442) 3.883 4.440 ( 2.308 -3.836 0.625) 4.520 4.538 ( -0.619 0.180 -2.450) 2.534 4.615 ( -2.080 -1.820 1.751) 3.272 4.671 ( -0.367 2.420 -1.142) 2.701 4.693 ( 1.093 -0.531 1.503) 1.933 4.760 ( -0.886 -3.490 0.435) 3.627 4.885 ( -0.631 4.004 -0.666) 4.108 4.904 ( -0.274 -3.744 -0.056) 3.754 4.962 ( 0.182 0.179 -0.134) 0.289 5.174 ( -1.729 1.575 0.608) 2.417 5.251 ( -2.145 1.052 -0.121) 2.393 5.293 ( -0.452 -0.113 0.345) 0.579 5.369 ( -0.295 1.055 2.038) 2.314 5.379 ( -0.562 0.798 -1.120) 1.485 5.437 ( -1.922 2.546 3.179) 4.504 5.453 ( -0.344 2.441 0.956) 2.644 5.574 ( 1.502 0.975 -1.356) 2.246 5.649 ( -0.334 1.136 -0.636) 1.344 5.791 ( -1.184 0.231 0.013) 1.206 5.852 ( 0.034 -0.964 -0.360) 1.030 5.907 ( -2.514 3.090 -1.792) 4.368 6.016 ( -1.070 4.048 -0.535) 4.221 6.181 ( 0.301 -3.151 0.189) 3.171 6.297 ( -3.151 -1.146 0.419) 3.379 ======================= Grid point 210 (79/140) ======================= q-point: ( 0.46 0.15 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( 0.637 -8.569 0.832) 8.633 1.551 ( 1.299 -8.476 -1.172) 8.655 1.621 ( -2.099 -10.931 2.853) 11.490 1.673 ( 0.176 -10.186 0.702) 10.212 1.820 ( -1.469 -1.143 -2.175) 2.863 1.919 ( -2.319 -5.459 -4.489) 7.439 1.938 ( -6.093 -2.106 0.643) 6.478 1.978 ( -4.437 -3.966 1.108) 6.053 2.074 ( -2.192 2.876 -1.032) 3.760 2.125 ( -1.120 -7.717 -1.020) 7.864 2.179 ( -1.137 0.456 3.231) 3.456 2.222 ( 0.037 -1.953 -1.567) 2.504 2.428 ( -4.330 -5.417 -4.362) 8.193 2.571 ( 2.874 -0.974 3.165) 4.385 2.608 ( -1.965 0.486 8.588) 8.823 2.632 ( 2.492 0.077 1.047) 2.704 2.712 ( 3.380 -0.650 -4.575) 5.725 2.817 ( 1.297 -4.090 -3.834) 5.754 2.909 ( 2.467 3.077 -2.005) 4.424 2.996 ( -2.069 -0.151 2.780) 3.469 3.085 ( 1.414 -8.713 1.114) 8.897 3.096 ( 0.655 -1.445 0.702) 1.735 3.179 ( 0.397 -3.544 0.304) 3.579 3.263 ( 0.529 -2.430 -0.631) 2.566 3.325 ( -0.284 -0.766 2.383) 2.519 3.387 ( -1.015 -4.380 0.066) 4.497 3.621 ( 0.648 -1.952 0.026) 2.057 3.813 ( 2.181 -9.833 0.271) 10.076 3.885 ( 2.459 -6.197 -0.683) 6.702 3.999 ( 1.291 -3.479 -2.070) 4.249 4.063 ( 3.733 3.539 -1.446) 5.343 4.383 ( 1.273 -1.939 -0.192) 2.327 4.388 ( 1.945 -3.984 -0.894) 4.523 4.458 ( 1.712 2.690 0.062) 3.190 4.548 ( -0.225 -1.861 -0.363) 1.909 4.597 ( 0.090 2.004 -1.379) 2.434 4.634 ( -1.139 -0.906 2.146) 2.594 4.721 ( 0.230 -0.863 0.867) 1.245 4.792 ( -0.385 0.472 0.422) 0.741 4.836 ( -0.845 -0.986 -0.791) 1.520 4.947 ( -0.092 0.848 0.613) 1.051 5.024 ( 0.592 -5.376 0.128) 5.410 5.138 ( -1.440 0.754 0.070) 1.627 5.231 ( -3.457 0.271 -0.100) 3.469 5.286 ( -2.956 -0.506 0.233) 3.008 5.337 ( -1.073 -0.578 0.997) 1.575 5.407 ( -0.545 -1.231 -0.781) 1.557 5.418 ( -0.223 -0.511 1.814) 1.898 5.447 ( 0.488 -2.054 1.179) 2.418 5.566 ( 0.320 0.334 -0.192) 0.501 5.620 ( -0.081 1.622 -1.191) 2.014 5.763 ( -1.706 1.182 -0.559) 2.149 5.845 ( -1.919 2.222 -1.429) 3.265 5.857 ( -0.160 0.454 -0.545) 0.727 5.940 ( -1.173 3.198 0.550) 3.451 6.216 ( -0.495 -0.561 0.160) 0.765 6.303 ( -1.276 -0.655 0.337) 1.473 ======================= Grid point 211 (80/140) ======================= q-point: ( 0.54 0.15 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( -1.477 -7.065 0.500) 7.235 1.682 ( 0.209 -4.967 0.268) 4.979 1.753 ( -1.293 -4.908 -0.013) 5.076 1.816 ( -1.938 -1.698 -1.953) 3.233 1.840 ( -1.702 -6.670 -1.474) 7.040 1.944 ( -2.660 2.895 0.563) 3.972 1.965 ( -1.449 -3.216 -2.159) 4.135 2.047 ( -1.536 -1.324 -1.148) 2.330 2.064 ( -1.778 -6.386 1.980) 6.918 2.164 ( -0.709 -0.458 2.779) 2.904 2.242 ( 0.226 -2.011 -0.798) 2.175 2.272 ( 2.202 -5.387 0.424) 5.835 2.480 ( -5.140 -3.595 -0.586) 6.300 2.568 ( 0.764 2.349 -0.446) 2.510 2.612 ( -0.172 -0.182 8.487) 8.491 2.656 ( 0.968 -1.176 -0.424) 1.581 2.696 ( 1.277 2.590 -3.942) 4.886 2.852 ( 2.091 3.328 -3.671) 5.378 2.869 ( 1.868 -0.941 -4.536) 4.995 2.938 ( -2.261 4.647 2.437) 5.714 3.070 ( 0.036 4.609 -1.156) 4.752 3.165 ( 1.720 -0.438 3.137) 3.604 3.172 ( -0.933 -1.602 3.413) 3.884 3.297 ( -0.546 -0.694 1.948) 2.139 3.465 ( 0.781 -8.361 -1.673) 8.563 3.514 ( -1.091 -7.342 0.031) 7.423 3.643 ( -0.126 -0.387 -0.758) 0.860 3.922 ( 1.524 0.853 -1.435) 2.260 3.985 ( 2.338 2.147 0.906) 3.301 4.032 ( 4.782 -4.776 0.149) 6.760 4.150 ( 0.175 -10.657 -2.282) 10.900 4.393 ( -0.379 0.842 -1.191) 1.507 4.422 ( 0.340 0.874 1.052) 1.410 4.463 ( 2.290 -2.265 -0.067) 3.221 4.560 ( -1.851 0.137 -1.508) 2.392 4.598 ( 0.931 -0.477 -1.355) 1.712 4.674 ( 1.502 -3.601 3.894) 5.513 4.735 ( -0.104 -0.629 0.255) 0.687 4.781 ( 0.376 0.222 0.318) 0.540 4.871 ( -1.419 -2.027 -0.334) 2.496 4.916 ( -0.675 1.425 -0.394) 1.625 5.089 ( 1.178 -0.416 0.206) 1.266 5.137 ( -1.046 -0.761 0.182) 1.307 5.205 ( -3.390 -1.264 -0.164) 3.622 5.302 ( -2.339 -2.017 -0.289) 3.102 5.388 ( -0.537 -4.453 1.215) 4.646 5.421 ( -0.474 -1.203 -0.268) 1.320 5.441 ( 0.231 -1.423 1.326) 1.959 5.506 ( 1.217 -2.048 0.102) 2.384 5.566 ( -0.702 -0.607 0.661) 1.139 5.584 ( -0.105 1.741 -1.463) 2.277 5.744 ( -0.554 0.158 -0.013) 0.576 5.786 ( -1.482 2.312 -1.278) 3.029 5.831 ( -0.211 1.913 -0.891) 2.121 5.887 ( -0.699 1.934 0.661) 2.160 6.208 ( -0.700 0.705 0.283) 1.033 6.303 ( -0.287 0.305 0.175) 0.454 ======================= Grid point 212 (81/140) ======================= q-point: ( 0.62 0.15 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.735 ( 0.463 -0.632 0.480) 0.919 1.761 ( -0.476 -5.504 0.702) 5.569 1.840 ( 1.956 -3.967 -0.370) 4.438 1.852 ( -0.071 -0.545 -2.762) 2.817 1.870 ( 0.486 0.331 -0.241) 0.635 1.934 ( -2.767 -4.439 -0.515) 5.256 2.001 ( -0.480 -1.048 0.073) 1.155 2.050 ( -0.217 -0.202 -0.790) 0.844 2.122 ( -0.294 -0.582 1.257) 1.416 2.242 ( -1.454 -4.504 2.675) 5.436 2.281 ( 0.705 -3.855 -0.484) 3.949 2.347 ( 2.893 0.901 1.963) 3.610 2.521 ( -0.952 1.978 0.418) 2.234 2.527 ( -2.692 -3.002 1.660) 4.360 2.614 ( -1.274 0.372 -1.863) 2.287 2.641 ( -0.849 1.791 -0.126) 1.986 2.687 ( 0.524 -1.888 0.067) 1.960 2.790 ( 2.024 3.090 -4.659) 5.945 2.825 ( -2.484 4.090 1.265) 4.950 2.877 ( -0.392 0.395 -3.704) 3.745 3.001 ( 0.180 1.378 -1.170) 1.816 3.192 ( 0.671 -0.874 5.799) 5.902 3.228 ( -0.548 -2.517 4.744) 5.398 3.296 ( 0.496 0.594 -1.016) 1.277 3.572 ( 0.471 -2.421 -1.691) 2.990 3.601 ( -0.143 -1.225 -1.038) 1.612 3.633 ( -0.388 0.020 -0.884) 0.966 3.899 ( 1.536 1.696 0.165) 2.294 3.923 ( 1.434 2.813 -0.363) 3.178 4.135 ( 3.495 -0.996 0.126) 3.636 4.310 ( -2.479 -4.935 -0.060) 5.523 4.373 ( 0.011 0.416 -0.030) 0.417 4.417 ( -0.548 -0.002 0.469) 0.721 4.490 ( 1.175 0.759 -0.490) 1.482 4.532 ( -1.462 1.061 -1.021) 2.075 4.610 ( 1.155 -1.073 -0.126) 1.582 4.738 ( -0.599 -0.353 -0.157) 0.713 4.762 ( 0.574 -0.640 0.169) 0.876 4.797 ( 1.380 -1.838 1.423) 2.703 4.853 ( -2.266 -0.407 -0.348) 2.328 4.932 ( 0.079 -1.636 0.270) 1.660 5.057 ( 0.559 3.767 -0.056) 3.809 5.146 ( -0.532 -1.487 0.178) 1.590 5.257 ( -0.600 -4.120 -0.090) 4.164 5.318 ( -0.698 -0.480 -0.038) 0.848 5.445 ( -0.231 -1.207 0.683) 1.406 5.470 ( 0.273 -1.779 -0.031) 1.800 5.481 ( -0.343 -3.542 0.632) 3.614 5.517 ( 0.680 0.712 -0.122) 0.992 5.556 ( -0.303 0.149 -0.947) 1.006 5.570 ( -0.598 1.360 0.775) 1.676 5.736 ( -0.052 -0.044 0.833) 0.836 5.771 ( 0.206 -0.264 -1.333) 1.374 5.789 ( -0.427 0.925 -0.846) 1.324 5.864 ( 0.021 0.155 -0.091) 0.181 6.196 ( -0.310 0.029 0.369) 0.482 6.293 ( -0.066 0.402 0.085) 0.416 ======================= Grid point 213 (82/140) ======================= q-point: (-0.31 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( 0.175 1.522 -0.244) 1.552 1.779 ( -0.006 5.050 -2.049) 5.450 1.849 ( 1.256 -2.267 2.150) 3.367 1.910 ( 0.780 -1.329 1.366) 2.059 1.938 ( 3.798 -3.614 -0.634) 5.281 1.974 ( -1.563 -0.341 0.159) 1.608 2.015 ( -0.490 0.711 -0.729) 1.130 2.077 ( 1.599 -3.307 1.080) 3.829 2.128 ( -1.107 -1.806 -1.534) 2.616 2.269 ( 0.903 1.379 2.093) 2.665 2.298 ( 2.568 4.067 1.627) 5.078 2.385 ( 1.613 -4.279 -0.983) 4.677 2.466 ( -1.058 3.521 0.975) 3.804 2.512 ( -2.398 0.872 -0.656) 2.635 2.593 ( -1.022 1.766 0.337) 2.068 2.652 ( -3.093 -2.344 -0.922) 3.989 2.737 ( 0.733 -1.297 -0.378) 1.537 2.757 ( 0.343 -1.376 -3.402) 3.685 2.785 ( -0.853 -1.105 0.665) 1.547 2.878 ( -0.728 -2.387 -2.798) 3.749 3.022 ( 1.111 -3.164 -0.150) 3.357 3.193 ( -1.172 1.241 3.276) 3.694 3.240 ( 1.140 6.608 1.132) 6.801 3.284 ( -0.557 -2.460 1.480) 2.924 3.544 ( -0.362 3.158 -3.018) 4.383 3.605 ( 0.462 0.758 -0.130) 0.897 3.642 ( -0.017 -0.219 -0.169) 0.277 3.867 ( 1.142 2.577 -0.074) 2.820 3.899 ( 0.106 0.687 1.305) 1.479 4.115 ( 2.205 4.295 0.330) 4.839 4.262 ( -3.416 7.590 0.391) 8.333 4.375 ( -0.261 -0.188 0.310) 0.447 4.409 ( -0.267 0.844 0.467) 1.001 4.443 ( -0.604 3.305 -0.113) 3.361 4.527 ( -0.187 -0.689 -0.945) 1.184 4.637 ( 0.075 -0.590 -0.277) 0.656 4.728 ( 0.350 1.129 0.071) 1.185 4.751 ( 0.148 0.920 -1.148) 1.478 4.787 ( 0.637 0.941 -0.163) 1.148 4.892 ( -0.808 1.182 1.250) 1.900 4.956 ( -0.455 -1.127 -0.640) 1.373 5.013 ( 0.221 -1.373 0.791) 1.600 5.182 ( 0.509 -1.462 0.463) 1.616 5.312 ( 1.241 -0.254 -0.200) 1.282 5.330 ( -0.235 -2.407 -0.060) 2.420 5.452 ( -0.020 0.883 0.314) 0.937 5.475 ( -0.362 1.754 0.821) 1.970 5.489 ( 0.026 2.734 0.116) 2.737 5.500 ( -0.446 0.838 -1.198) 1.529 5.538 ( 0.453 -0.738 0.094) 0.871 5.591 ( -0.251 -1.669 0.772) 1.856 5.740 ( -0.255 0.056 -1.223) 1.251 5.771 ( 0.828 -2.250 1.118) 2.645 5.824 ( 0.417 -2.570 -0.506) 2.652 5.883 ( 0.450 -1.930 -1.048) 2.241 6.208 ( 0.077 -1.179 0.377) 1.240 6.295 ( -0.031 -0.692 0.072) 0.696 ======================= Grid point 214 (83/140) ======================= q-point: (-0.23 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.640 ( -0.441 9.049 0.360) 9.067 1.672 ( -0.293 4.442 -2.216) 4.973 1.852 ( 1.330 4.929 1.922) 5.455 1.885 ( 0.435 5.885 0.923) 5.972 1.922 ( 0.292 3.486 -0.010) 3.498 1.962 ( -0.196 1.799 2.842) 3.369 2.045 ( 1.460 -3.304 -0.661) 3.672 2.094 ( -0.921 0.195 -0.924) 1.319 2.191 ( 1.072 5.174 2.982) 6.067 2.216 ( 0.713 -4.230 -2.519) 4.974 2.316 ( 2.884 -2.808 0.903) 4.125 2.376 ( 1.726 2.661 -2.734) 4.188 2.448 ( -1.570 0.081 -1.428) 2.124 2.522 ( -1.015 -1.571 4.379) 4.762 2.542 ( -1.381 3.418 0.561) 3.729 2.636 ( -2.394 0.588 -2.076) 3.223 2.755 ( 2.956 0.024 -4.657) 5.517 2.804 ( -0.745 -2.635 3.972) 4.825 2.839 ( 1.912 -3.327 -1.258) 4.038 2.955 ( -0.267 -4.846 -0.299) 4.862 3.072 ( -1.368 5.482 -3.930) 6.883 3.108 ( -0.406 0.155 1.874) 1.924 3.184 ( -0.773 -1.691 3.174) 3.679 3.307 ( -0.508 -0.628 -2.612) 2.734 3.417 ( -0.337 10.254 -1.805) 10.417 3.554 ( 0.918 5.741 0.645) 5.849 3.629 ( -0.315 1.590 -0.206) 1.634 3.819 ( -1.627 2.419 -1.695) 3.372 3.908 ( 1.312 -0.843 4.678) 4.931 3.976 ( 0.480 12.549 -0.575) 12.571 4.079 ( -0.921 6.398 2.044) 6.779 4.360 ( -0.832 2.516 -0.471) 2.691 4.389 ( -0.526 0.220 0.454) 0.729 4.399 ( 0.172 1.109 0.379) 1.185 4.532 ( -0.485 -0.336 -1.342) 1.466 4.627 ( 0.658 1.197 0.165) 1.376 4.700 ( -0.161 1.837 -0.218) 1.857 4.736 ( 0.187 0.310 -1.620) 1.660 4.784 ( 0.480 1.041 -0.109) 1.151 4.845 ( 0.137 1.059 2.186) 2.433 4.958 ( -1.670 -0.007 -1.719) 2.396 5.065 ( 0.726 -1.439 0.833) 1.814 5.193 ( 0.438 0.324 0.115) 0.557 5.323 ( 0.968 -0.311 0.150) 1.028 5.360 ( 0.134 0.248 -0.179) 0.334 5.402 ( -0.355 2.350 1.520) 2.821 5.436 ( -0.371 1.690 -1.263) 2.142 5.450 ( 0.708 2.351 0.588) 2.525 5.473 ( -0.603 0.712 -0.273) 0.972 5.568 ( -0.334 -0.219 1.145) 1.213 5.592 ( 0.570 -0.518 -0.964) 1.234 5.769 ( -0.008 -2.592 -0.792) 2.711 5.832 ( 0.821 -2.914 1.710) 3.477 5.868 ( 0.492 -1.779 -0.298) 1.869 5.931 ( 0.302 -3.124 -1.833) 3.635 6.230 ( 0.066 -0.640 0.269) 0.697 6.318 ( 0.040 -1.597 0.140) 1.603 ======================= Grid point 215 (84/140) ======================= q-point: (-0.15 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.435 ( -0.753 12.375 3.445) 12.868 1.540 ( -0.524 8.979 -3.266) 9.569 1.649 ( -0.315 14.195 0.364) 14.203 1.731 ( 1.052 10.618 -1.109) 10.728 1.854 ( -0.529 4.883 0.543) 4.942 1.938 ( 0.881 2.548 5.097) 5.766 2.042 ( -0.032 4.515 -3.737) 5.861 2.082 ( -0.481 -0.775 -0.124) 0.920 2.158 ( 0.968 -0.568 4.249) 4.394 2.265 ( -0.534 -0.913 -1.731) 2.029 2.331 ( 1.791 2.219 -0.546) 2.904 2.369 ( 0.105 3.465 1.200) 3.668 2.409 ( 0.387 3.957 -0.996) 4.099 2.452 ( -2.359 3.700 -1.917) 4.788 2.514 ( -1.006 1.343 2.412) 2.938 2.624 ( -0.134 -0.126 -0.022) 0.185 2.733 ( -0.662 3.833 -5.465) 6.708 2.818 ( 0.416 3.123 2.855) 4.251 2.861 ( 3.826 3.901 4.908) 7.345 2.953 ( -0.674 0.036 -1.032) 1.233 3.060 ( -1.309 -2.835 -1.554) 3.488 3.071 ( -0.484 2.746 -3.713) 4.644 3.156 ( 0.243 11.768 -3.118) 12.176 3.261 ( 0.581 -1.318 3.555) 3.836 3.338 ( -0.352 -2.118 -3.102) 3.773 3.411 ( 0.045 7.235 0.008) 7.235 3.586 ( -0.393 2.159 -0.297) 2.214 3.722 ( -2.495 6.040 -1.210) 6.646 3.754 ( 0.342 7.801 -1.672) 7.986 3.945 ( 1.032 -0.273 3.442) 3.604 4.023 ( 2.060 1.012 5.168) 5.654 4.295 ( -0.941 3.639 -0.788) 3.840 4.380 ( 0.822 1.652 0.569) 1.930 4.389 ( 0.102 -0.423 0.648) 0.781 4.531 ( -0.529 0.388 -0.093) 0.663 4.622 ( 0.333 -0.661 0.003) 0.740 4.664 ( -0.460 1.074 -1.025) 1.554 4.726 ( 0.032 0.779 -1.619) 1.797 4.762 ( -0.040 0.280 -0.164) 0.327 4.870 ( 1.198 -1.963 2.035) 3.071 4.931 ( -1.573 1.352 -1.925) 2.830 5.055 ( 0.551 2.709 -0.685) 2.848 5.196 ( -0.165 -0.807 -0.223) 0.853 5.312 ( 0.070 1.748 1.166) 2.102 5.336 ( -0.425 0.787 -0.470) 1.011 5.381 ( -0.137 1.729 0.045) 1.735 5.405 ( -0.003 0.518 0.468) 0.698 5.420 ( -0.255 0.806 2.046) 2.214 5.474 ( -0.105 -1.000 -1.374) 1.703 5.549 ( -0.399 0.910 1.177) 1.540 5.628 ( 0.584 -2.048 -1.262) 2.475 5.810 ( 0.005 -1.381 0.069) 1.382 5.873 ( 0.116 -0.361 -1.052) 1.118 5.905 ( 0.361 -2.295 2.034) 3.088 5.994 ( 0.159 -3.602 -1.908) 4.080 6.224 ( -0.057 1.478 0.053) 1.480 6.351 ( -0.151 -1.641 0.321) 1.679 ======================= Grid point 216 (85/140) ======================= q-point: (-0.08 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.184 ( -0.490 14.388 5.862) 15.544 1.289 ( -0.992 16.812 3.734) 17.251 1.382 ( -0.741 12.804 -4.672) 13.649 1.507 ( 2.133 12.451 -4.647) 13.460 1.720 ( -0.674 7.997 -0.175) 8.028 1.878 ( 0.351 7.306 3.900) 8.289 1.936 ( -0.312 5.886 -0.518) 5.917 2.058 ( -2.432 7.966 3.533) 9.047 2.153 ( -1.195 9.059 2.055) 9.366 2.181 ( 1.248 0.562 2.653) 2.985 2.237 ( -1.500 3.484 -4.018) 5.526 2.259 ( -1.045 9.101 1.618) 9.303 2.316 ( 6.480 4.895 0.384) 8.131 2.362 ( -2.025 4.822 -5.028) 7.254 2.483 ( -0.931 2.717 0.112) 2.874 2.580 ( -0.108 6.060 -3.010) 6.767 2.646 ( 0.037 3.230 0.132) 3.233 2.729 ( 0.550 3.581 2.997) 4.702 2.801 ( 0.512 3.967 1.092) 4.147 2.917 ( 0.950 8.690 -3.715) 9.499 2.949 ( -0.483 -0.089 4.590) 4.616 3.067 ( 0.821 -1.556 -8.294) 8.479 3.091 ( -1.305 0.593 -1.098) 1.805 3.242 ( 2.059 4.732 1.488) 5.371 3.282 ( -1.902 2.074 0.546) 2.867 3.412 ( 0.407 -2.134 -1.698) 2.757 3.535 ( -0.696 4.669 -0.406) 4.738 3.610 ( -2.112 1.983 0.175) 2.902 3.684 ( 2.805 3.153 0.046) 4.220 3.949 ( 0.434 -1.456 1.266) 1.977 4.055 ( 1.160 -1.297 4.288) 4.627 4.210 ( -0.327 4.396 -0.617) 4.451 4.336 ( 0.418 3.666 -0.009) 3.690 4.408 ( 0.518 -0.834 0.675) 1.191 4.493 ( 0.814 4.035 3.005) 5.096 4.653 ( 0.293 -2.249 0.158) 2.274 4.664 ( -0.531 -0.435 -1.153) 1.342 4.701 ( -0.254 0.697 -1.848) 1.992 4.762 ( 0.482 0.778 -1.106) 1.435 4.891 ( -0.429 1.100 -1.082) 1.602 4.937 ( -0.065 -4.199 -0.215) 4.205 4.987 ( 0.233 3.499 -2.056) 4.065 5.213 ( -0.610 -0.837 -0.297) 1.077 5.291 ( -0.093 0.760 0.950) 1.220 5.314 ( -0.506 0.987 -1.120) 1.576 5.365 ( -0.629 -0.886 2.206) 2.459 5.399 ( -0.315 -0.097 -0.676) 0.752 5.431 ( -0.654 -1.292 4.163) 4.407 5.499 ( -0.341 -2.097 -1.811) 2.792 5.546 ( -0.165 -0.705 1.076) 1.297 5.661 ( 0.253 -1.300 -1.022) 1.673 5.814 ( -0.177 0.825 0.566) 1.016 5.858 ( 0.080 1.227 -1.818) 2.195 5.961 ( -0.307 -3.047 1.947) 3.629 6.059 ( 0.057 -3.562 -1.765) 3.976 6.174 ( 0.015 3.683 -0.189) 3.688 6.375 ( -1.026 -1.020 0.669) 1.594 ======================= Grid point 220 (86/140) ======================= q-point: ( 0.23 0.23 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.741 ( 6.644 -0.000 10.674) 12.573 0.843 ( 10.256 -0.000 0.795) 10.286 0.997 ( 15.079 -0.000 -0.156) 15.080 1.020 ( 11.286 -0.000 -6.013) 12.788 1.386 ( 12.151 -0.000 -0.091) 12.151 1.567 ( 14.478 -0.000 11.883) 18.730 1.614 ( 0.582 -0.000 -5.588) 5.618 1.624 ( -1.536 0.000 -4.319) 4.584 1.759 ( 1.831 -0.000 5.980) 6.254 1.906 ( -3.404 0.000 -2.395) 4.162 1.995 ( -2.812 0.000 2.352) 3.666 1.999 ( -1.586 0.000 0.305) 1.615 2.089 ( 1.862 -0.000 -16.340) 16.445 2.242 ( -2.350 0.000 0.162) 2.356 2.389 ( -3.732 0.000 10.117) 10.783 2.471 ( -0.745 0.000 -0.007) 0.745 2.491 ( -0.665 0.000 2.497) 2.584 2.645 ( 1.950 -0.000 -0.075) 1.951 2.734 ( -2.732 0.000 -0.738) 2.830 2.757 ( 0.470 -0.000 -0.039) 0.472 2.799 ( -4.148 0.000 -5.622) 6.987 2.984 ( -0.508 0.000 0.415) 0.656 3.172 ( -3.212 0.000 -0.843) 3.320 3.219 ( -0.367 0.000 0.276) 0.459 3.230 ( -0.953 0.000 -0.256) 0.987 3.262 ( 3.206 -0.000 -1.246) 3.439 3.318 ( -1.764 0.000 4.589) 4.916 3.444 ( 1.348 -0.000 2.525) 2.863 3.778 ( 1.209 -0.000 0.045) 1.210 3.863 ( 0.043 -0.000 0.006) 0.043 4.019 ( -0.278 0.000 0.143) 0.313 4.032 ( 0.005 -0.000 -0.172) 0.172 4.134 ( -7.925 0.000 -4.636) 9.181 4.287 ( -0.791 0.000 0.057) 0.793 4.315 ( 5.421 -0.000 4.526) 7.062 4.378 ( -0.689 0.000 -0.033) 0.690 4.526 ( -1.828 0.000 2.801) 3.345 4.665 ( -1.324 0.000 -1.317) 1.868 4.867 ( 3.865 -0.000 -3.036) 4.915 4.924 ( -1.019 0.000 -1.186) 1.563 4.997 ( 0.259 -0.000 -2.356) 2.370 5.107 ( 0.363 -0.000 -2.332) 2.360 5.213 ( -0.372 0.000 0.887) 0.962 5.292 ( 0.885 -0.000 0.026) 0.886 5.336 ( 1.426 -0.000 -0.314) 1.460 5.454 ( 0.919 -0.000 -1.424) 1.694 5.593 ( 1.035 -0.000 4.907) 5.015 5.623 ( -0.914 0.000 2.736) 2.884 5.654 ( 0.395 -0.000 -0.026) 0.396 5.660 ( 0.427 -0.000 0.023) 0.427 5.704 ( 0.568 -0.000 0.208) 0.605 5.811 ( -0.519 0.000 1.326) 1.424 5.844 ( -0.631 0.000 -0.002) 0.631 5.912 ( 0.639 -0.000 0.006) 0.639 5.989 ( -3.272 0.000 1.336) 3.534 6.223 ( 0.692 -0.000 -0.224) 0.727 6.253 ( -4.063 0.000 -3.270) 5.216 ======================= Grid point 222 (87/140) ======================= q-point: ( 0.31 0.23 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.862 ( 5.961 -7.289 8.491) 12.679 0.993 ( 10.915 -6.557 -5.510) 13.874 1.106 ( 9.576 -5.911 7.121) 13.317 1.134 ( 9.422 -4.737 -3.732) 11.187 1.523 ( 9.042 -7.470 1.498) 11.824 1.589 ( 0.901 -0.744 -2.690) 2.933 1.629 ( 3.151 -3.963 -1.326) 5.234 1.787 ( 2.959 -8.587 1.083) 9.147 1.856 ( -0.020 -7.075 5.201) 8.781 1.947 ( -2.614 -5.057 -1.664) 5.931 1.976 ( -4.270 -1.139 -0.336) 4.432 2.046 ( -2.265 -2.925 -3.516) 5.104 2.116 ( 4.338 -6.619 -11.266) 13.768 2.219 ( -0.366 0.141 0.470) 0.612 2.403 ( -1.895 -1.466 10.084) 10.365 2.483 ( -0.311 -1.162 2.060) 2.386 2.504 ( 1.388 -1.285 -0.429) 1.939 2.656 ( 2.651 -0.727 2.112) 3.466 2.717 ( -6.023 -1.291 -2.971) 6.839 2.758 ( -1.521 -0.944 -0.564) 1.877 2.860 ( 0.912 -5.558 -1.744) 5.896 2.978 ( -0.230 0.200 -0.142) 0.337 3.105 ( -1.886 3.668 -3.486) 5.400 3.229 ( -2.780 -0.735 3.717) 4.700 3.267 ( -0.042 -3.674 -0.225) 3.682 3.285 ( 2.495 -2.046 -0.450) 3.258 3.356 ( 0.420 -4.131 1.687) 4.482 3.454 ( 0.592 -0.498 2.029) 2.172 3.742 ( 1.559 2.215 -0.001) 2.709 4.010 ( -3.421 -0.999 -1.428) 3.839 4.043 ( -2.805 -10.157 -0.468) 10.547 4.067 ( -0.593 -3.003 -0.460) 3.096 4.122 ( -1.451 -6.241 -1.259) 6.530 4.297 ( 2.410 0.467 1.997) 3.165 4.393 ( -2.609 -6.605 -1.283) 7.216 4.436 ( 0.426 -5.285 1.490) 5.508 4.539 ( 0.427 -1.139 3.648) 3.845 4.654 ( -0.942 0.334 -0.610) 1.171 4.850 ( -1.030 1.801 -4.488) 4.944 4.912 ( 1.833 1.352 -0.658) 2.371 4.980 ( 0.633 1.317 -1.517) 2.107 5.084 ( 0.922 2.629 -1.438) 3.135 5.208 ( -0.751 0.502 1.706) 1.931 5.290 ( 0.646 0.507 -0.248) 0.858 5.330 ( 1.490 1.390 -0.250) 2.053 5.435 ( -0.174 1.804 -1.695) 2.481 5.540 ( -2.622 5.973 7.208) 9.722 5.591 ( 1.467 2.799 0.088) 3.162 5.618 ( -0.530 4.416 1.822) 4.806 5.653 ( 2.197 1.524 -0.124) 2.677 5.696 ( 0.003 1.215 0.035) 1.215 5.778 ( 0.497 1.639 1.800) 2.484 5.809 ( 0.102 0.177 -2.080) 2.090 5.984 ( -0.471 -4.574 0.391) 4.615 6.015 ( -1.758 -1.648 -0.425) 2.447 6.189 ( 0.253 3.693 -2.325) 4.371 6.231 ( -3.642 -1.081 -0.998) 3.928 ======================= Grid point 223 (88/140) ======================= q-point: ( 0.38 0.23 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.091 ( 2.837 -12.243 2.847) 12.885 1.163 ( 8.283 -7.578 -1.219) 11.292 1.266 ( 7.699 -5.175 -2.377) 9.577 1.327 ( 5.849 -9.483 7.327) 13.335 1.632 ( -1.399 -4.625 -2.899) 5.635 1.710 ( 3.139 -6.797 0.928) 7.544 1.774 ( 0.067 -9.398 -1.506) 9.518 1.881 ( -4.823 -1.699 -5.472) 7.489 1.967 ( -6.146 -0.109 2.692) 6.710 2.004 ( -1.306 -7.974 5.249) 9.635 2.039 ( -0.342 -5.801 -5.839) 8.238 2.087 ( -1.857 -4.252 -2.220) 5.143 2.260 ( 2.014 -4.002 -4.050) 6.039 2.350 ( 2.443 -14.614 -1.655) 14.909 2.463 ( 2.351 -3.048 6.485) 7.541 2.528 ( 0.559 -2.803 4.757) 5.549 2.567 ( 2.735 -4.919 -0.979) 5.713 2.708 ( 0.944 -1.742 1.907) 2.750 2.720 ( -4.991 -3.519 -2.639) 6.653 2.794 ( -0.753 -3.987 1.022) 4.185 2.934 ( -0.528 -2.371 -1.984) 3.136 2.990 ( 0.864 -1.389 0.730) 1.791 3.047 ( 0.466 0.631 -4.143) 4.216 3.242 ( -1.679 -1.230 3.482) 4.056 3.327 ( 1.521 -2.156 0.378) 2.665 3.393 ( 3.734 -5.609 1.194) 6.843 3.406 ( -1.577 -1.405 1.082) 2.373 3.546 ( 1.381 -8.629 0.741) 8.770 3.708 ( 0.943 2.125 -0.211) 2.334 3.972 ( -2.935 -0.154 -0.866) 3.063 4.115 ( 0.194 -0.965 -1.564) 1.848 4.212 ( 0.479 -6.059 -1.030) 6.164 4.261 ( 0.235 -6.363 -1.090) 6.460 4.338 ( 2.010 -4.913 0.675) 5.351 4.492 ( -3.637 -4.807 -2.493) 6.523 4.554 ( -3.198 -5.095 2.509) 6.518 4.605 ( 2.998 -5.826 2.673) 7.077 4.650 ( -0.324 -0.988 0.262) 1.072 4.788 ( -1.836 3.172 -2.238) 4.294 4.878 ( 0.820 2.178 -2.012) 3.077 4.956 ( 1.319 2.051 -0.687) 2.533 5.012 ( 0.337 4.457 0.251) 4.477 5.189 ( -1.871 1.105 1.614) 2.707 5.288 ( 0.267 0.347 -0.075) 0.444 5.296 ( 1.190 2.591 -0.936) 3.001 5.387 ( -1.259 2.051 -0.624) 2.486 5.437 ( -1.215 4.111 5.324) 6.835 5.512 ( -1.353 5.685 2.148) 6.226 5.530 ( 0.650 4.398 1.334) 4.642 5.618 ( 3.054 2.847 -2.141) 4.692 5.669 ( -0.199 1.352 -0.165) 1.376 5.780 ( -0.354 -0.684 0.735) 1.065 5.825 ( -0.216 -1.588 -1.053) 1.917 5.959 ( -2.304 3.667 -1.299) 4.522 6.072 ( -0.157 -0.300 -3.260) 3.278 6.127 ( 0.542 -0.054 1.581) 1.673 6.243 ( -3.863 -2.204 -0.075) 4.448 ======================= Grid point 224 (89/140) ======================= q-point: ( 0.46 0.23 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.329 ( 1.516 -10.909 -4.411) 11.864 1.378 ( 1.645 -11.006 7.019) 13.157 1.411 ( 4.757 -7.225 -2.989) 9.152 1.532 ( 4.604 -7.769 5.506) 10.577 1.729 ( -2.829 -6.640 -2.123) 7.523 1.821 ( 0.616 -3.825 -3.212) 5.033 1.854 ( -8.137 -1.851 -3.932) 9.225 1.915 ( -4.466 -0.734 4.190) 6.168 1.949 ( -3.031 -8.253 -2.801) 9.227 2.093 ( -1.798 -0.220 -3.118) 3.606 2.143 ( -1.353 -4.889 5.589) 7.548 2.163 ( 1.315 -4.444 -1.093) 4.761 2.313 ( -2.351 -2.958 -5.776) 6.902 2.555 ( 4.130 -3.377 1.597) 5.569 2.587 ( -0.198 -2.135 5.562) 5.961 2.630 ( 2.840 -8.718 1.219) 9.250 2.698 ( 2.482 -3.692 1.149) 4.594 2.714 ( 0.802 -1.004 -0.685) 1.456 2.823 ( -3.968 -12.622 -3.666) 13.729 2.905 ( -1.087 -6.019 1.030) 6.202 2.987 ( 0.777 -2.111 1.801) 2.881 3.024 ( 0.726 -4.134 1.412) 4.428 3.075 ( 1.889 -3.158 -4.289) 5.651 3.262 ( 0.290 -0.343 2.394) 2.436 3.345 ( -0.493 0.987 1.557) 1.908 3.385 ( -0.534 1.617 1.049) 2.000 3.561 ( 4.256 -6.730 -0.393) 7.972 3.691 ( 1.003 -2.288 1.229) 2.784 3.741 ( 0.975 -9.217 -0.881) 9.310 3.978 ( 0.552 -0.914 -0.087) 1.071 4.098 ( -0.618 0.856 -4.394) 4.519 4.318 ( 2.175 -4.596 -1.302) 5.249 4.348 ( 3.003 -3.026 0.881) 4.353 4.460 ( 0.661 -4.941 -0.578) 5.019 4.519 ( -1.193 -0.375 -1.832) 2.218 4.604 ( -1.282 -1.805 2.903) 3.651 4.661 ( -0.401 1.448 -0.955) 1.781 4.704 ( -0.030 1.670 0.697) 1.810 4.750 ( -0.976 -4.026 0.706) 4.202 4.878 ( -0.309 4.885 -0.130) 4.896 4.898 ( -0.714 -6.083 -1.139) 6.230 4.971 ( 1.275 1.162 0.651) 1.844 5.158 ( -1.512 1.293 0.638) 2.089 5.229 ( -1.746 2.638 -0.083) 3.165 5.288 ( -0.624 0.844 0.445) 1.140 5.368 ( -0.705 2.591 -0.255) 2.698 5.374 ( 0.122 -0.085 0.674) 0.690 5.428 ( -1.657 2.096 2.775) 3.852 5.457 ( -0.212 2.680 2.363) 3.579 5.585 ( 1.763 1.539 -2.291) 3.275 5.643 ( -0.282 1.184 -0.404) 1.283 5.777 ( -1.342 0.919 0.025) 1.627 5.848 ( -0.516 -0.894 -1.230) 1.606 5.876 ( -1.519 2.694 -1.470) 3.424 6.004 ( -0.865 4.058 -0.340) 4.163 6.185 ( 0.275 -2.644 0.280) 2.673 6.267 ( -2.498 -2.087 0.356) 3.275 ======================= Grid point 225 (90/140) ======================= q-point: ( 0.54 0.23 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.504 ( 0.058 -7.780 -0.230) 7.783 1.563 ( 1.590 -6.901 -2.005) 7.361 1.590 ( -3.239 -10.245 0.483) 10.756 1.695 ( 1.224 -6.938 1.757) 7.261 1.792 ( -2.435 -1.478 -1.354) 3.154 1.862 ( -5.358 -4.835 -1.621) 7.397 1.892 ( -1.834 -5.016 0.668) 5.382 1.957 ( -0.357 -4.415 1.792) 4.778 2.048 ( -1.540 2.296 -2.118) 3.482 2.105 ( -0.793 -7.824 -1.937) 8.100 2.189 ( 0.089 -0.806 1.513) 1.717 2.235 ( 1.685 -1.987 1.556) 3.035 2.357 ( -5.006 -4.791 -3.381) 7.710 2.596 ( 0.819 0.457 0.593) 1.110 2.626 ( -0.245 -1.094 5.329) 5.446 2.678 ( 3.016 2.117 7.136) 8.031 2.710 ( 0.400 -0.590 -6.402) 6.442 2.818 ( 1.503 -4.034 -4.660) 6.344 2.935 ( 2.856 1.500 -1.948) 3.768 2.982 ( -2.450 0.184 3.190) 4.027 3.093 ( 0.688 -8.658 -1.205) 8.768 3.109 ( 0.459 -2.961 2.181) 3.706 3.183 ( 0.037 -0.308 0.436) 0.535 3.272 ( 1.267 -5.137 -0.523) 5.316 3.329 ( -1.031 0.266 3.924) 4.066 3.377 ( -0.852 -4.006 -0.006) 4.095 3.627 ( 0.451 -0.922 -0.423) 1.110 3.834 ( 1.858 -8.880 -0.459) 9.084 3.906 ( 1.852 -7.619 -0.050) 7.840 4.009 ( 1.768 -2.003 -2.090) 3.392 4.084 ( 1.060 0.560 -2.350) 2.638 4.386 ( 0.431 -1.796 -0.995) 2.098 4.428 ( 4.150 -2.762 1.279) 5.147 4.471 ( 1.402 2.954 0.076) 3.270 4.526 ( -2.963 -1.584 -2.153) 3.991 4.583 ( -0.851 1.173 -1.445) 2.046 4.662 ( 2.892 -1.600 4.733) 5.773 4.717 ( -1.054 -1.019 -0.318) 1.500 4.788 ( -1.192 -0.723 1.062) 1.752 4.821 ( -0.855 -0.463 -0.883) 1.314 4.948 ( 0.117 1.709 -1.060) 2.014 5.034 ( 0.926 -5.765 0.705) 5.881 5.127 ( -0.418 0.737 0.015) 0.847 5.194 ( -3.059 0.959 0.007) 3.206 5.251 ( -3.059 0.070 0.027) 3.059 5.333 ( -0.577 -0.873 1.314) 1.680 5.398 ( -0.639 -0.880 -0.306) 1.130 5.423 ( 0.052 -0.927 1.322) 1.615 5.459 ( 0.669 -2.421 1.614) 2.986 5.567 ( 0.181 0.756 -0.839) 1.143 5.615 ( -0.067 1.631 -0.958) 1.893 5.743 ( -1.368 0.971 -0.888) 1.898 5.821 ( -1.286 1.862 -1.350) 2.635 5.855 ( 0.004 0.694 -0.339) 0.772 5.931 ( -0.773 3.028 0.516) 3.168 6.211 ( -0.505 -0.283 0.197) 0.612 6.293 ( -0.757 -1.281 0.301) 1.518 ======================= Grid point 226 (91/140) ======================= q-point: ( 0.62 0.23 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( -1.856 -6.698 0.541) 6.972 1.684 ( 0.237 -5.831 -0.250) 5.841 1.744 ( -0.311 -7.300 -1.015) 7.377 1.789 ( -1.654 -2.350 -1.544) 3.262 1.823 ( -0.117 -4.461 -1.750) 4.794 1.920 ( -1.863 1.370 1.277) 2.642 1.950 ( -0.600 -3.798 -0.480) 3.875 2.025 ( -1.125 -1.962 -1.765) 2.869 2.071 ( 1.044 -6.061 2.433) 6.614 2.159 ( -1.569 -0.725 2.670) 3.180 2.246 ( 0.762 -2.186 -0.721) 2.425 2.305 ( 2.679 -5.634 -0.180) 6.241 2.413 ( -5.409 -4.206 -0.165) 6.853 2.570 ( 0.123 2.368 0.850) 2.519 2.646 ( -0.503 0.545 6.034) 6.079 2.668 ( 0.734 1.727 -8.347) 8.556 2.680 ( 0.410 1.036 3.891) 4.048 2.850 ( 1.077 1.053 -5.543) 5.744 2.894 ( 4.116 2.969 -2.189) 5.527 2.914 ( -3.161 4.823 1.580) 5.979 3.064 ( -0.074 5.281 -1.002) 5.376 3.171 ( -1.860 -2.021 3.889) 4.761 3.209 ( 3.537 -2.110 3.245) 5.244 3.295 ( -1.215 0.601 2.845) 3.151 3.468 ( 0.994 -8.226 -1.311) 8.389 3.501 ( -1.130 -7.722 -0.227) 7.808 3.636 ( -0.393 -0.125 -1.325) 1.388 3.935 ( 1.578 1.103 -0.823) 2.093 3.996 ( -0.054 1.619 -0.708) 1.767 4.084 ( 3.920 -6.923 -0.337) 7.962 4.142 ( -0.217 -8.010 -0.883) 8.062 4.386 ( 0.007 1.083 -0.820) 1.358 4.426 ( -0.081 1.014 0.934) 1.381 4.498 ( 3.527 -0.791 0.715) 3.685 4.525 ( -2.642 -0.647 -1.632) 3.172 4.590 ( -0.716 -1.463 -2.186) 2.726 4.709 ( -0.850 -1.526 2.307) 2.894 4.738 ( 2.668 -1.705 1.563) 3.531 4.789 ( 0.267 0.042 1.273) 1.301 4.848 ( -1.432 -1.080 -0.779) 1.955 4.913 ( -0.242 0.637 -0.997) 1.208 5.100 ( 0.648 -0.355 0.145) 0.753 5.128 ( -0.694 0.202 0.090) 0.729 5.174 ( -1.958 -3.042 0.026) 3.618 5.279 ( -1.572 -2.737 -0.141) 3.159 5.386 ( -0.478 -4.452 1.005) 4.589 5.416 ( -0.338 -1.487 -0.023) 1.525 5.449 ( 0.341 -1.393 1.133) 1.828 5.520 ( 1.214 -1.676 0.239) 2.083 5.558 ( -1.187 -0.690 0.376) 1.423 5.579 ( 0.138 1.863 -1.271) 2.259 5.737 ( -0.440 -0.894 -0.664) 1.198 5.771 ( -0.692 2.386 -0.385) 2.514 5.827 ( 0.062 2.047 -0.998) 2.278 5.883 ( -0.328 1.760 0.506) 1.861 6.202 ( -0.465 0.617 0.311) 0.833 6.301 ( -0.154 0.160 0.147) 0.266 ======================= Grid point 227 (92/140) ======================= q-point: ( 0.69 0.23 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.744 ( 0.567 -0.868 1.262) 1.634 1.762 ( 0.025 -6.325 1.003) 6.404 1.835 ( -0.060 -0.414 -3.928) 3.950 1.865 ( 1.537 -3.753 0.816) 4.137 1.881 ( 1.538 -2.748 -0.450) 3.181 1.904 ( -2.172 -4.633 -0.542) 5.145 1.995 ( -0.548 -1.006 -0.006) 1.146 2.041 ( -0.416 -0.857 -2.235) 2.430 2.125 ( -0.220 0.227 1.637) 1.667 2.250 ( 0.189 -5.669 4.953) 7.531 2.285 ( 0.202 -3.411 -0.255) 3.426 2.387 ( 2.342 1.081 0.592) 2.646 2.451 ( -5.575 -2.455 -0.673) 6.128 2.549 ( 1.753 0.385 2.171) 2.817 2.591 ( -2.104 0.797 -3.626) 4.267 2.636 ( -0.142 2.381 1.087) 2.621 2.688 ( -0.162 -1.316 -0.165) 1.336 2.784 ( 1.166 3.771 -5.453) 6.732 2.812 ( -1.607 3.632 1.703) 4.322 2.869 ( 1.677 1.527 -3.535) 4.200 3.003 ( 0.672 0.715 -0.409) 1.063 3.223 ( -0.396 -3.460 4.452) 5.653 3.236 ( -0.765 1.967 7.554) 7.843 3.301 ( 1.295 -0.787 -1.685) 2.266 3.567 ( -0.047 -1.320 -2.233) 2.595 3.597 ( 0.272 -1.872 -1.071) 2.174 3.625 ( -0.376 -0.517 -0.973) 1.164 3.909 ( 0.384 1.115 -0.273) 1.210 3.930 ( 0.008 3.065 -0.604) 3.124 4.179 ( 3.465 0.567 0.636) 3.568 4.279 ( -2.565 -4.613 0.059) 5.279 4.376 ( 0.268 0.218 0.293) 0.453 4.419 ( 0.446 -0.086 1.149) 1.236 4.498 ( 0.635 2.020 -1.273) 2.470 4.515 ( -0.928 0.144 -0.976) 1.355 4.607 ( -1.003 -1.414 -0.567) 1.824 4.730 ( -0.288 -1.159 -0.894) 1.492 4.779 ( 1.371 1.187 0.936) 2.041 4.812 ( 0.493 0.269 0.458) 0.725 4.838 ( -0.554 -3.175 1.326) 3.485 4.926 ( -0.984 -1.439 -0.664) 1.865 5.062 ( 0.369 3.919 0.109) 3.938 5.144 ( -0.112 -2.221 0.266) 2.239 5.253 ( -0.104 -4.650 -0.098) 4.652 5.312 ( -0.386 -1.097 0.057) 1.164 5.446 ( -0.013 -1.441 0.744) 1.621 5.473 ( 0.327 -2.520 -0.571) 2.605 5.479 ( -0.538 -1.888 0.971) 2.190 5.522 ( 0.323 0.284 -0.187) 0.469 5.550 ( -0.104 0.282 -0.815) 0.869 5.567 ( -0.382 1.156 0.728) 1.419 5.739 ( 0.018 -0.093 1.019) 1.023 5.768 ( 0.061 -1.270 -1.050) 1.649 5.782 ( -0.013 1.246 -1.272) 1.780 5.865 ( 0.223 0.052 -0.121) 0.259 6.194 ( -0.199 -0.155 0.389) 0.463 6.293 ( -0.045 0.390 0.068) 0.399 ======================= Grid point 228 (93/140) ======================= q-point: (-0.23 0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( 0.385 2.162 0.220) 2.207 1.771 ( -0.009 4.881 -2.263) 5.380 1.867 ( 0.787 -3.027 1.551) 3.492 1.920 ( -0.900 -0.969 2.499) 2.827 1.955 ( -0.580 -2.780 -0.165) 2.845 1.977 ( 2.497 -1.450 -0.072) 2.888 2.003 ( -1.022 -0.385 -1.173) 1.603 2.090 ( 0.553 -4.833 -1.613) 5.125 2.108 ( -1.369 0.223 0.338) 1.428 2.285 ( 0.333 1.094 2.147) 2.433 2.318 ( -0.018 3.696 0.589) 3.743 2.410 ( 2.035 -3.586 0.770) 4.194 2.448 ( -3.007 -0.172 2.402) 3.853 2.482 ( -1.857 2.087 -2.404) 3.686 2.592 ( 0.004 2.044 0.071) 2.045 2.630 ( 0.606 0.210 0.659) 0.920 2.734 ( 0.253 -3.951 -1.647) 4.288 2.744 ( -0.086 -0.119 -3.291) 3.295 2.789 ( 0.935 -2.202 -0.202) 2.401 2.871 ( 1.111 -2.324 -2.391) 3.515 3.032 ( 0.737 -2.876 -0.470) 3.006 3.195 ( -1.408 2.477 4.532) 5.353 3.249 ( -0.393 6.772 0.996) 6.856 3.283 ( -0.512 -1.622 0.984) 1.965 3.533 ( 0.509 3.148 -2.946) 4.342 3.610 ( 0.541 0.295 -0.183) 0.642 3.641 ( 0.001 -0.422 -0.307) 0.522 3.872 ( -0.080 3.453 -0.535) 3.495 3.905 ( -0.007 -0.479 1.625) 1.694 4.148 ( 2.160 3.702 1.272) 4.471 4.223 ( -2.342 8.528 -0.668) 8.869 4.379 ( 0.518 -0.405 0.432) 0.787 4.412 ( 0.344 2.400 0.535) 2.483 4.437 ( -0.331 2.619 -0.313) 2.658 4.522 ( 0.005 -0.608 -1.079) 1.239 4.629 ( -0.730 -1.173 -0.092) 1.385 4.733 ( 0.006 1.341 0.264) 1.367 4.754 ( 0.771 1.683 -0.621) 1.952 4.793 ( 0.621 -0.030 -0.922) 1.112 4.889 ( -0.624 1.110 1.962) 2.339 4.940 ( -1.106 -0.217 -1.188) 1.637 5.023 ( 0.591 -1.879 0.799) 2.126 5.187 ( 0.031 -1.516 0.438) 1.578 5.319 ( -0.244 -0.219 0.021) 0.328 5.329 ( 0.499 -3.024 -0.373) 3.087 5.454 ( 0.124 1.213 0.340) 1.266 5.472 ( -0.616 1.497 0.745) 1.782 5.486 ( -0.616 2.630 0.547) 2.756 5.493 ( 0.068 0.993 -1.097) 1.482 5.545 ( 0.905 -0.636 -0.368) 1.166 5.590 ( -0.425 -1.839 0.843) 2.067 5.734 ( -0.152 0.118 -0.845) 0.867 5.784 ( 0.727 -2.591 1.003) 2.872 5.822 ( -0.226 -2.888 -0.836) 3.015 5.882 ( 0.220 -1.698 -0.968) 1.967 6.210 ( -0.118 -1.264 0.380) 1.325 6.295 ( -0.051 -0.708 0.071) 0.713 ======================= Grid point 229 (94/140) ======================= q-point: (-0.15 0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.639 ( -0.188 8.661 0.595) 8.684 1.663 ( 0.024 5.183 -1.666) 5.444 1.865 ( -0.399 5.769 1.804) 6.058 1.889 ( -0.039 5.578 -0.100) 5.579 1.920 ( -0.603 3.651 -0.138) 3.703 1.972 ( -0.107 0.172 2.757) 2.764 2.053 ( 0.570 -2.498 -0.553) 2.621 2.083 ( -0.384 0.674 -1.305) 1.519 2.197 ( -2.173 -0.797 -0.344) 2.340 2.210 ( -0.036 0.749 1.932) 2.073 2.323 ( -1.266 -2.421 -0.471) 2.772 2.374 ( -0.737 1.511 -2.425) 2.951 2.435 ( -0.248 1.666 -0.578) 1.781 2.519 ( -2.351 -2.001 4.284) 5.281 2.541 ( 0.092 3.366 0.404) 3.391 2.623 ( 2.056 0.480 -1.043) 2.355 2.747 ( -1.359 -0.465 -2.535) 2.914 2.824 ( 2.403 -3.566 -0.071) 4.301 2.859 ( 2.487 -3.406 -1.304) 4.414 2.960 ( 0.815 -5.474 -0.220) 5.538 3.038 ( -1.983 4.997 -2.865) 6.092 3.118 ( 0.757 4.077 2.583) 4.885 3.187 ( -1.049 -2.848 3.431) 4.581 3.287 ( -1.140 -0.510 -2.483) 2.779 3.415 ( 1.250 9.949 -1.835) 10.193 3.563 ( 0.065 5.941 0.246) 5.947 3.628 ( 0.398 1.777 -0.158) 1.828 3.803 ( -0.169 3.271 -0.726) 3.355 3.936 ( 0.814 -1.562 3.100) 3.566 3.979 ( 0.133 14.202 -0.326) 14.206 4.084 ( 1.166 3.759 1.172) 4.106 4.353 ( -0.136 2.861 -0.183) 2.870 4.391 ( 0.765 -0.093 0.375) 0.857 4.405 ( 0.732 1.238 0.058) 1.440 4.523 ( -0.198 -0.004 -1.142) 1.159 4.631 ( -0.285 0.741 0.427) 0.901 4.694 ( -0.685 2.064 -0.124) 2.178 4.735 ( 0.454 0.527 -1.249) 1.429 4.786 ( 0.250 1.618 -0.447) 1.697 4.858 ( 0.530 0.187 1.512) 1.613 4.935 ( -1.244 0.081 -0.425) 1.317 5.073 ( 0.223 -1.125 0.226) 1.169 5.193 ( -0.461 0.387 0.097) 0.610 5.325 ( -0.744 -0.538 0.083) 0.922 5.361 ( 0.191 0.793 -0.205) 0.841 5.401 ( -0.708 2.062 1.289) 2.533 5.429 ( -0.241 1.865 -0.432) 1.930 5.459 ( 0.103 1.524 0.316) 1.560 5.466 ( -0.205 1.220 -0.296) 1.272 5.568 ( -0.312 0.170 1.028) 1.087 5.595 ( 0.569 -0.787 -1.034) 1.419 5.765 ( -0.262 -2.754 -0.448) 2.802 5.843 ( 0.316 -2.578 1.035) 2.796 5.869 ( -0.261 -2.213 -0.071) 2.229 5.924 ( -0.380 -2.979 -1.774) 3.488 6.230 ( -0.217 -0.630 0.258) 0.714 6.318 ( -0.231 -1.588 0.168) 1.614 ======================= Grid point 230 (95/140) ======================= q-point: (-0.08 0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( 0.195 11.888 3.574) 12.416 1.526 ( -0.141 8.934 -2.128) 9.185 1.642 ( -1.288 14.663 0.637) 14.733 1.734 ( 0.425 10.576 -1.573) 10.701 1.849 ( -0.666 4.890 0.560) 4.967 1.965 ( 0.754 2.623 4.304) 5.097 2.023 ( -0.376 4.301 -4.290) 6.087 2.071 ( -1.588 -0.573 0.241) 1.706 2.172 ( -1.499 -0.849 3.377) 3.792 2.223 ( -4.845 0.528 -1.190) 5.017 2.319 ( -2.536 1.595 -2.942) 4.199 2.374 ( -1.784 2.198 2.015) 3.475 2.390 ( -1.065 2.333 -1.774) 3.118 2.469 ( 5.062 5.078 0.805) 7.215 2.526 ( 1.100 1.473 2.813) 3.361 2.627 ( -0.019 -1.193 1.720) 2.094 2.687 ( -3.254 4.854 -5.085) 7.747 2.830 ( 0.081 2.946 1.549) 3.329 2.931 ( 4.762 2.727 4.612) 7.169 2.941 ( 0.399 1.193 -4.643) 4.811 3.038 ( -1.586 -1.251 -1.436) 2.478 3.062 ( 0.570 1.466 -1.367) 2.083 3.153 ( 0.920 10.989 -1.762) 11.167 3.280 ( 0.575 -0.155 3.151) 3.207 3.319 ( -0.873 -2.356 -3.277) 4.129 3.409 ( -0.383 7.072 -0.068) 7.083 3.588 ( 0.790 2.410 0.264) 2.550 3.711 ( 0.507 7.859 0.973) 7.935 3.768 ( 2.967 5.699 -0.627) 6.456 3.963 ( 0.523 0.665 1.265) 1.522 4.051 ( 0.535 0.186 1.502) 1.606 4.296 ( 1.441 3.874 0.492) 4.162 4.388 ( 0.715 1.638 -0.468) 1.848 4.397 ( 0.688 -0.481 0.382) 0.922 4.529 ( 0.252 -0.623 0.280) 0.728 4.620 ( -0.896 -0.619 -0.173) 1.103 4.659 ( 0.148 1.085 -0.107) 1.101 4.719 ( -0.343 1.102 -1.356) 1.780 4.767 ( 0.965 0.338 -0.071) 1.025 4.881 ( -0.366 -1.882 -0.399) 1.958 4.916 ( -0.178 1.412 0.816) 1.641 5.052 ( -0.497 2.959 -0.973) 3.154 5.189 ( -1.063 -0.662 0.027) 1.252 5.315 ( -0.423 2.012 1.411) 2.493 5.324 ( -1.336 0.443 -0.696) 1.570 5.377 ( -0.659 1.343 0.269) 1.520 5.407 ( 0.278 0.912 -0.313) 1.003 5.422 ( -0.880 0.845 2.764) 3.021 5.464 ( -0.739 -0.892 -1.383) 1.804 5.551 ( 0.019 0.748 0.983) 1.235 5.629 ( 0.462 -1.924 -1.294) 2.364 5.807 ( -0.578 -1.569 0.111) 1.676 5.869 ( -0.075 -0.016 -0.931) 0.934 5.910 ( -0.757 -2.359 1.448) 2.870 5.984 ( -0.706 -3.791 -1.754) 4.236 6.223 ( -0.109 1.448 0.080) 1.455 6.346 ( -0.958 -1.465 0.358) 1.787 ======================= Grid point 236 (96/140) ======================= q-point: ( 0.31 0.31 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.858 ( 8.317 -0.000 7.405) 11.136 0.949 ( 8.925 -0.000 -0.545) 8.941 1.111 ( 7.211 -0.000 0.880) 7.264 1.159 ( 13.525 -0.000 1.459) 13.604 1.518 ( 8.340 -0.000 -1.146) 8.419 1.585 ( 1.207 -0.000 -2.669) 2.929 1.599 ( -0.477 0.000 -3.155) 3.191 1.735 ( 9.084 -0.000 1.676) 9.238 1.793 ( 0.650 -0.000 4.611) 4.656 1.861 ( -3.360 0.000 -2.085) 3.955 1.957 ( -4.696 0.000 1.394) 4.898 1.979 ( -1.878 0.000 -0.229) 1.892 2.064 ( 4.777 -0.000 -17.004) 17.662 2.232 ( -0.862 0.000 0.910) 1.253 2.398 ( -0.589 0.000 11.812) 11.826 2.462 ( -0.859 0.000 -0.004) 0.859 2.500 ( 0.607 -0.000 2.382) 2.458 2.668 ( -4.588 0.000 -1.356) 4.785 2.687 ( 3.107 -0.000 3.056) 4.359 2.761 ( 0.249 -0.000 -0.038) 0.252 2.771 ( -0.035 0.000 -3.453) 3.453 2.979 ( -0.488 0.000 -0.428) 0.649 3.127 ( -3.811 0.000 -2.840) 4.752 3.215 ( -0.572 0.000 0.388) 0.691 3.220 ( -0.573 0.000 -0.376) 0.686 3.272 ( -1.997 0.000 1.794) 2.684 3.313 ( 0.095 -0.000 0.206) 0.227 3.476 ( 1.752 -0.000 4.326) 4.667 3.791 ( 1.466 -0.000 -0.427) 1.527 3.863 ( 0.013 -0.000 0.003) 0.014 4.017 ( -0.233 0.000 0.184) 0.297 4.023 ( -8.237 0.000 -3.983) 9.149 4.032 ( -0.009 0.000 -0.204) 0.204 4.280 ( -0.479 0.000 0.047) 0.481 4.362 ( 0.940 -0.000 0.286) 0.983 4.369 ( -0.920 0.000 -0.029) 0.921 4.547 ( 2.421 -0.000 4.645) 5.238 4.654 ( -0.756 0.000 -0.056) 0.758 4.839 ( -4.129 0.000 -4.938) 6.437 4.945 ( 4.661 -0.000 -0.330) 4.672 4.995 ( 0.868 -0.000 -1.800) 1.998 5.112 ( 1.028 -0.000 -0.716) 1.253 5.215 ( -0.342 0.000 1.863) 1.894 5.300 ( 0.462 -0.000 -0.325) 0.565 5.352 ( 1.311 -0.000 0.415) 1.375 5.449 ( -0.697 0.000 -2.235) 2.341 5.609 ( -2.207 0.000 7.244) 7.573 5.632 ( 1.175 -0.000 1.526) 1.926 5.658 ( 0.375 -0.000 -0.026) 0.376 5.664 ( 0.391 -0.000 0.024) 0.392 5.706 ( -0.221 0.000 -0.431) 0.484 5.817 ( 0.600 -0.000 1.517) 1.632 5.838 ( -0.508 0.000 -0.003) 0.508 5.918 ( 0.516 -0.000 0.007) 0.516 5.961 ( -2.292 0.000 0.389) 2.325 6.199 ( -2.608 0.000 -5.863) 6.417 6.237 ( 1.708 -0.000 0.085) 1.711 ======================= Grid point 237 (97/140) ======================= q-point: ( 0.38 0.31 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.959 ( 6.938 -5.173 5.771) 10.402 1.096 ( 9.953 -7.473 -2.631) 12.721 1.175 ( 2.826 -4.101 5.064) 7.103 1.274 ( 12.724 -3.174 1.178) 13.167 1.553 ( -1.892 -3.733 -4.981) 6.506 1.590 ( 0.703 -3.450 -0.557) 3.565 1.673 ( 4.246 -3.442 0.441) 5.484 1.798 ( 0.317 -2.744 -5.236) 5.920 1.869 ( -1.347 -5.757 3.864) 7.063 1.921 ( -1.461 -6.032 -0.151) 6.209 1.935 ( -1.529 -1.692 -1.612) 2.792 2.015 ( -1.101 -1.174 -1.580) 2.255 2.115 ( 2.065 -8.698 -7.323) 11.556 2.220 ( -0.254 -0.450 -1.527) 1.612 2.438 ( 1.383 -1.595 9.359) 9.594 2.491 ( 0.556 -2.283 2.587) 3.495 2.523 ( 2.253 -1.676 -0.528) 2.857 2.643 ( -4.156 -0.618 -1.746) 4.550 2.714 ( 4.358 -0.312 4.956) 6.607 2.737 ( -2.253 -1.104 -0.492) 2.557 2.862 ( 0.551 -5.126 -1.734) 5.440 2.976 ( 0.154 -0.258 -0.960) 1.006 3.066 ( -2.619 2.302 -4.357) 5.581 3.214 ( -2.138 -0.606 3.431) 4.088 3.267 ( 0.287 -4.499 -0.117) 4.509 3.308 ( 1.858 -3.258 0.078) 3.752 3.358 ( -1.120 -5.409 0.730) 5.572 3.470 ( 0.604 1.206 2.873) 3.173 3.761 ( 1.737 2.349 0.041) 2.922 3.950 ( -4.849 0.891 -1.251) 5.087 4.019 ( -1.434 -11.848 -0.205) 11.936 4.069 ( 0.622 -3.872 -0.243) 3.929 4.109 ( -0.556 -7.262 -0.271) 7.289 4.315 ( 0.744 -0.403 -0.203) 0.870 4.354 ( -2.889 -4.539 -2.659) 6.002 4.432 ( -1.622 -4.775 0.739) 5.097 4.578 ( 2.419 -1.491 1.828) 3.379 4.643 ( -1.519 0.440 0.904) 1.822 4.802 ( -2.464 1.159 -2.508) 3.702 4.945 ( 3.453 2.488 -2.132) 4.760 4.991 ( 2.228 0.836 0.093) 2.381 5.089 ( 0.383 2.849 -0.063) 2.875 5.205 ( -1.045 1.046 1.923) 2.426 5.295 ( 0.398 0.457 -0.467) 0.765 5.347 ( 1.367 1.430 0.251) 1.994 5.418 ( -1.509 1.951 -1.969) 3.156 5.537 ( -2.686 5.718 6.924) 9.373 5.608 ( 1.396 3.068 0.627) 3.429 5.620 ( -0.100 4.676 1.176) 4.823 5.671 ( 0.881 0.609 0.361) 1.131 5.696 ( 0.064 0.866 -0.164) 0.884 5.793 ( 0.301 0.803 1.387) 1.630 5.805 ( 1.516 1.954 -2.199) 3.309 5.972 ( -2.449 -2.537 1.388) 3.789 6.001 ( 0.084 -3.576 -1.814) 4.011 6.159 ( -2.319 1.169 -4.636) 5.314 6.221 ( 0.850 1.992 0.405) 2.203 ======================= Grid point 238 (98/140) ======================= q-point: ( 0.46 0.31 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.136 ( 4.096 -8.923 1.767) 9.976 1.258 ( 6.499 -5.821 4.858) 9.986 1.319 ( 4.674 -6.545 -1.791) 8.239 1.424 ( 7.224 -7.000 1.357) 10.150 1.602 ( -1.676 -4.335 -2.498) 5.276 1.727 ( -0.375 -7.006 -0.307) 7.023 1.762 ( -3.240 -4.577 -2.242) 6.039 1.788 ( -4.889 -1.765 -6.942) 8.672 1.924 ( -3.601 1.406 4.811) 6.171 2.014 ( -0.095 -8.020 -0.583) 8.042 2.019 ( -0.289 -5.506 -1.595) 5.740 2.075 ( 1.052 -5.066 -0.069) 5.174 2.255 ( -0.177 -2.615 -3.184) 4.124 2.365 ( 1.193 -15.550 -1.397) 15.658 2.507 ( 1.195 -5.206 1.987) 5.699 2.550 ( -0.672 -2.831 5.051) 5.829 2.597 ( 2.417 -4.266 0.072) 4.904 2.643 ( -2.111 -2.088 -1.709) 3.426 2.757 ( 1.715 -0.686 5.536) 5.836 2.785 ( -0.680 -4.651 0.250) 4.707 2.923 ( -0.264 -2.574 -1.983) 3.260 3.000 ( -0.010 -1.587 1.088) 1.924 3.037 ( 1.216 -0.998 -5.697) 5.910 3.238 ( -1.352 -2.048 3.626) 4.379 3.343 ( 1.143 -2.174 0.781) 2.578 3.399 ( -0.341 -1.290 0.748) 1.530 3.446 ( 4.458 -5.452 1.497) 7.199 3.549 ( -1.159 -10.187 -0.274) 10.256 3.717 ( 0.536 2.838 0.110) 2.890 3.940 ( -2.215 -1.738 0.370) 2.840 4.105 ( -0.453 0.010 -2.333) 2.376 4.218 ( 1.184 -7.172 -1.242) 7.375 4.265 ( 0.978 -8.117 -0.488) 8.190 4.352 ( 0.264 -4.899 -1.386) 5.098 4.442 ( -2.979 -5.301 -1.625) 6.295 4.528 ( -2.661 -5.924 1.601) 6.689 4.638 ( -0.556 -0.641 1.818) 2.006 4.656 ( 1.506 -5.675 -0.135) 5.873 4.757 ( -1.175 2.333 -0.344) 2.635 4.883 ( 1.024 4.385 -2.283) 5.049 4.973 ( 1.810 3.416 -0.439) 3.890 5.019 ( 0.488 3.517 1.330) 3.792 5.173 ( -1.929 1.549 1.486) 2.886 5.290 ( 0.177 1.016 0.107) 1.037 5.307 ( 1.289 2.904 -0.876) 3.295 5.370 ( -1.272 1.281 -0.869) 2.003 5.442 ( -1.641 3.909 5.594) 7.019 5.509 ( -0.538 6.214 1.809) 6.494 5.539 ( 0.143 4.711 1.497) 4.945 5.642 ( 2.425 2.967 -2.158) 4.398 5.669 ( 0.690 1.950 -0.388) 2.105 5.777 ( -0.601 0.144 0.510) 0.801 5.816 ( -0.399 -1.666 -1.446) 2.242 5.931 ( -1.817 3.770 -1.162) 4.343 6.058 ( -0.141 0.233 -3.346) 3.357 6.138 ( 0.370 -1.280 1.569) 2.059 6.209 ( -2.232 -1.644 -0.108) 2.775 ======================= Grid point 239 (99/140) ======================= q-point: ( 0.54 0.31 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.332 ( 1.354 -9.801 -1.684) 10.036 1.419 ( -0.034 -7.418 6.987) 10.191 1.458 ( 6.323 -5.483 -3.715) 9.157 1.586 ( 2.974 -6.107 -1.049) 6.873 1.685 ( -3.804 -5.605 -0.376) 6.785 1.730 ( -10.504 -4.140 -1.866) 11.443 1.824 ( 1.593 -3.427 -2.756) 4.677 1.902 ( -0.390 -2.682 2.273) 3.538 1.931 ( 0.368 -7.394 0.895) 7.457 2.061 ( -1.070 -0.991 -4.637) 4.861 2.144 ( -0.819 -4.360 1.902) 4.827 2.189 ( 1.059 -4.197 2.746) 5.126 2.267 ( -1.650 -1.362 -4.066) 4.595 2.580 ( -0.014 -3.846 0.302) 3.858 2.614 ( 1.084 -2.355 4.670) 5.341 2.647 ( -0.448 -4.123 -3.456) 5.398 2.712 ( 2.727 -8.312 -1.476) 8.871 2.746 ( 0.403 -3.035 5.704) 6.474 2.783 ( 0.451 -8.621 -0.640) 8.657 2.889 ( -2.576 -7.763 0.632) 8.204 2.995 ( -0.401 -1.715 0.963) 2.007 3.037 ( 0.897 -5.530 0.500) 5.624 3.080 ( 2.053 -3.340 -4.150) 5.709 3.273 ( 0.043 -0.691 3.107) 3.183 3.339 ( -0.819 2.183 -0.373) 2.361 3.388 ( -0.412 1.215 2.988) 3.251 3.618 ( 5.587 -3.402 -0.021) 6.541 3.691 ( 0.214 -5.228 -1.830) 5.543 3.744 ( -1.324 -9.203 0.850) 9.336 3.977 ( -1.116 -2.558 -0.371) 2.815 4.077 ( 0.666 0.810 -3.916) 4.054 4.330 ( 1.141 -4.292 -1.014) 4.556 4.394 ( 3.299 -4.395 0.441) 5.513 4.446 ( -1.344 -4.141 -1.025) 4.473 4.502 ( -0.976 -1.981 -0.812) 2.353 4.605 ( -1.049 -1.769 1.943) 2.829 4.659 ( 0.779 -0.551 -0.120) 0.961 4.704 ( -0.219 1.560 1.625) 2.263 4.746 ( -0.124 -0.621 0.098) 0.641 4.871 ( -1.787 -2.860 -1.417) 3.658 4.883 ( -0.068 1.009 -0.975) 1.405 4.992 ( 1.508 0.884 1.097) 2.064 5.148 ( -0.781 0.295 0.761) 1.130 5.214 ( -1.076 4.431 -0.090) 4.561 5.284 ( -0.439 2.092 0.415) 2.177 5.361 ( -0.254 1.586 -0.504) 1.683 5.378 ( -0.105 1.197 0.795) 1.441 5.421 ( -1.555 1.821 2.824) 3.702 5.465 ( -0.132 2.396 2.894) 3.760 5.595 ( 1.795 2.275 -3.140) 4.273 5.641 ( 0.016 1.320 -0.274) 1.348 5.763 ( -1.263 1.422 0.191) 1.912 5.830 ( -1.060 -0.018 -2.629) 2.835 5.866 ( -0.084 1.263 -0.030) 1.266 5.995 ( -0.348 3.927 -0.481) 3.972 6.189 ( 0.263 -1.954 0.285) 1.992 6.246 ( -1.483 -2.938 0.388) 3.314 ======================= Grid point 240 (100/140) ======================= q-point: ( 0.62 0.31 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.503 ( -0.098 -6.811 -0.088) 6.813 1.537 ( -3.300 -7.427 -2.238) 8.430 1.591 ( 1.481 -7.232 0.235) 7.386 1.705 ( 0.788 -5.526 -0.551) 5.609 1.755 ( -3.025 -4.000 -1.656) 5.281 1.824 ( -1.684 -7.298 2.422) 7.872 1.890 ( 0.857 -3.686 -0.438) 3.810 1.981 ( 2.342 -4.143 3.411) 5.855 2.028 ( -0.269 1.528 -1.951) 2.492 2.097 ( 0.519 -6.910 -1.726) 7.141 2.185 ( -1.564 -1.645 -0.733) 2.385 2.234 ( -2.225 -3.006 -2.196) 4.336 2.327 ( 0.514 -3.622 3.050) 4.763 2.605 ( 0.188 0.597 1.617) 1.734 2.637 ( -0.014 -0.844 1.379) 1.616 2.679 ( -1.844 0.735 -4.731) 5.131 2.741 ( 3.003 2.085 7.051) 7.942 2.813 ( 0.991 -3.449 -4.267) 5.576 2.943 ( -1.377 -2.711 -0.127) 3.043 2.971 ( 0.230 2.643 -0.562) 2.712 3.094 ( -0.173 -9.012 -0.135) 9.014 3.123 ( 1.438 -3.039 0.599) 3.415 3.184 ( -0.124 1.165 0.472) 1.263 3.283 ( 1.247 -7.700 -1.863) 8.020 3.335 ( -1.254 0.193 5.944) 6.078 3.371 ( -0.215 -2.455 0.200) 2.472 3.627 ( 0.000 -0.018 -0.774) 0.774 3.848 ( 0.709 -8.022 -0.147) 8.054 3.930 ( 2.465 -8.995 0.658) 9.350 4.009 ( -0.678 -1.840 -2.113) 2.883 4.075 ( -0.110 -0.355 -3.086) 3.109 4.389 ( 0.455 -1.456 -0.430) 1.586 4.457 ( 0.499 0.124 0.069) 0.518 4.482 ( -2.963 -0.482 -1.386) 3.307 4.508 ( 3.721 -0.763 0.655) 3.855 4.573 ( 0.278 1.227 -0.020) 1.259 4.690 ( -3.184 0.079 -0.076) 3.186 4.717 ( 2.989 -2.855 2.487) 4.824 4.778 ( -0.351 -2.465 1.046) 2.700 4.820 ( 0.483 0.783 0.185) 0.938 4.934 ( -1.482 0.711 -2.458) 2.957 5.047 ( 0.714 -4.938 0.780) 5.050 5.129 ( 0.442 1.114 0.079) 1.201 5.167 ( -1.681 1.229 0.084) 2.084 5.226 ( -1.316 0.301 0.027) 1.351 5.333 ( -0.348 -0.842 1.395) 1.666 5.390 ( -0.645 -0.857 0.122) 1.079 5.428 ( 0.102 -1.400 0.816) 1.623 5.472 ( 0.529 -2.387 1.922) 3.110 5.564 ( 0.038 1.203 -1.391) 1.839 5.612 ( 0.151 1.690 -0.780) 1.867 5.729 ( -0.502 0.804 -1.020) 1.392 5.806 ( -0.697 1.415 -0.876) 1.804 5.855 ( 0.273 0.907 -0.388) 1.023 5.927 ( -0.113 2.943 0.297) 2.960 6.207 ( -0.245 -0.145 0.218) 0.359 6.288 ( -0.295 -1.591 0.280) 1.642 ======================= Grid point 241 (101/140) ======================= q-point: (-0.31 -0.69 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( -0.214 -7.261 0.652) 7.294 1.684 ( -0.059 -7.386 -0.399) 7.397 1.738 ( -0.074 -7.939 -0.819) 7.981 1.772 ( -0.301 -2.383 -1.402) 2.781 1.820 ( 0.727 -3.694 -2.229) 4.375 1.916 ( -0.095 1.881 2.194) 2.892 1.947 ( 0.012 -4.105 0.431) 4.128 2.008 ( -0.506 -2.171 -2.777) 3.561 2.096 ( 1.811 -4.406 0.703) 4.815 2.159 ( -0.687 -2.122 4.588) 5.102 2.251 ( 0.524 -2.125 -0.049) 2.189 2.298 ( -2.374 -7.209 -3.100) 8.198 2.397 ( 1.150 -2.731 3.441) 4.541 2.575 ( -0.400 2.670 0.978) 2.871 2.615 ( -2.545 2.314 -5.858) 6.794 2.660 ( 0.037 -0.874 2.417) 2.570 2.720 ( 2.426 3.282 3.336) 5.271 2.839 ( 0.910 0.790 -5.577) 5.706 2.879 ( -3.657 4.194 1.455) 5.751 2.934 ( 4.051 3.603 -2.491) 5.966 3.062 ( 0.243 5.311 -0.656) 5.357 3.161 ( -2.880 -2.646 4.408) 5.893 3.251 ( 2.741 -3.840 -1.578) 4.975 3.301 ( -0.538 2.464 6.674) 7.135 3.478 ( 1.194 -7.343 -0.479) 7.455 3.487 ( -0.793 -8.597 -1.006) 8.692 3.626 ( -0.387 0.149 -1.618) 1.670 3.946 ( 0.330 1.097 -0.375) 1.206 3.984 ( -0.857 2.872 -1.420) 3.316 4.098 ( -1.294 -10.612 0.326) 10.696 4.148 ( 1.726 -5.932 -0.924) 6.247 4.385 ( -0.060 0.931 -0.502) 1.059 4.430 ( 0.213 0.895 0.937) 1.313 4.495 ( -1.241 -0.982 -1.124) 1.941 4.527 ( 0.314 0.181 -1.187) 1.242 4.588 ( 1.646 -0.537 1.081) 2.041 4.682 ( -2.372 -1.894 -1.209) 3.267 4.776 ( 0.516 -2.064 2.357) 3.175 4.801 ( 1.740 -0.035 1.409) 2.240 4.844 ( 0.677 -0.287 0.766) 1.061 4.896 ( -1.817 0.163 -2.202) 2.859 5.104 ( -0.031 -0.360 0.109) 0.377 5.124 ( -0.042 0.748 0.034) 0.750 5.164 ( 0.098 -3.985 0.103) 3.987 5.269 ( -0.083 -3.019 -0.049) 3.020 5.385 ( -0.401 -4.319 0.935) 4.437 5.414 ( -0.181 -1.799 0.237) 1.824 5.457 ( 0.416 -1.323 0.668) 1.539 5.533 ( 0.942 -0.518 0.328) 1.124 5.545 ( -1.265 -1.569 0.238) 2.029 5.577 ( 0.314 1.873 -1.093) 2.191 5.731 ( 0.087 -1.207 -0.984) 1.560 5.767 ( -0.136 2.177 0.191) 2.190 5.825 ( 0.307 2.204 -1.017) 2.447 5.884 ( 0.216 1.692 0.276) 1.728 6.200 ( -0.122 0.580 0.326) 0.676 6.301 ( -0.042 0.121 0.136) 0.187 ======================= Grid point 242 (102/140) ======================= q-point: (-0.23 -0.69 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.755 ( 0.435 -0.840 1.467) 1.746 1.767 ( 0.099 -6.366 0.761) 6.412 1.820 ( 0.056 -0.689 -3.763) 3.826 1.877 ( -0.858 -5.430 -0.820) 5.558 1.882 ( 0.187 -0.989 0.787) 1.278 1.901 ( 1.626 -5.555 -0.426) 5.803 1.992 ( 0.159 -0.694 0.202) 0.740 2.027 ( -0.284 -0.768 -2.249) 2.394 2.128 ( -0.420 0.199 1.624) 1.689 2.274 ( -0.363 -4.947 4.815) 6.913 2.282 ( -0.615 -3.885 0.037) 3.934 2.371 ( -1.676 -0.165 -0.972) 1.945 2.444 ( 0.597 -0.015 3.973) 4.017 2.537 ( -3.262 1.934 -4.855) 6.161 2.587 ( 2.612 -3.464 0.552) 4.373 2.648 ( 1.709 3.557 2.379) 4.608 2.688 ( 0.585 -0.466 -0.837) 1.122 2.779 ( 1.799 3.706 -6.293) 7.522 2.797 ( -2.286 2.779 2.162) 4.198 2.883 ( 2.762 2.628 -3.097) 4.912 3.009 ( 0.670 0.345 -0.756) 1.067 3.219 ( -2.434 -2.831 5.330) 6.507 3.265 ( 0.340 1.847 5.595) 5.902 3.303 ( -0.314 -0.474 -1.911) 1.994 3.559 ( 0.545 -0.806 -2.315) 2.511 3.598 ( 0.597 -2.325 -1.054) 2.622 3.619 ( -0.089 -0.851 -0.614) 1.053 3.902 ( -1.413 1.221 0.094) 1.870 3.927 ( 0.056 2.410 -0.412) 2.446 4.185 ( -3.135 -0.318 0.303) 3.166 4.277 ( 2.494 -3.278 0.164) 4.122 4.382 ( 0.661 0.014 -0.075) 0.665 4.432 ( 0.595 -0.505 1.293) 1.510 4.487 ( -1.220 1.512 -2.507) 3.172 4.507 ( -0.174 0.484 -0.027) 0.515 4.603 ( 0.824 -0.737 0.638) 1.276 4.721 ( -0.861 -2.238 -0.687) 2.495 4.790 ( 0.421 1.123 0.282) 1.232 4.811 ( -0.357 2.094 -0.611) 2.211 4.849 ( 0.552 -3.817 2.018) 4.353 4.914 ( -0.336 -1.603 -0.402) 1.687 5.064 ( -0.257 3.821 0.035) 3.830 5.146 ( 0.263 -2.327 0.165) 2.347 5.254 ( 0.342 -4.629 -0.147) 4.644 5.310 ( 0.066 -1.142 0.137) 1.152 5.450 ( 0.155 -1.686 0.776) 1.863 5.471 ( -0.168 -3.003 -0.672) 3.082 5.479 ( -0.104 -0.520 0.884) 1.031 5.522 ( -0.176 -0.337 0.045) 0.383 5.547 ( 0.127 0.588 -1.019) 1.184 5.568 ( 0.053 0.981 0.829) 1.286 5.743 ( 0.020 -0.100 1.012) 1.017 5.765 ( 0.067 -1.804 -0.745) 1.953 5.779 ( 0.322 1.668 -1.441) 2.228 5.868 ( 0.396 0.153 -0.279) 0.509 6.194 ( -0.079 -0.163 0.391) 0.431 6.293 ( -0.020 0.399 0.074) 0.406 ======================= Grid point 243 (103/140) ======================= q-point: (-0.15 0.31 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.735 ( 0.278 2.479 -0.044) 2.495 1.764 ( 0.235 4.754 -1.666) 5.043 1.876 ( -0.005 -3.607 0.417) 3.631 1.901 ( -3.190 -1.091 1.296) 3.612 1.962 ( 0.764 -1.683 1.728) 2.530 1.972 ( -2.176 -1.307 -2.352) 3.460 2.007 ( 1.519 -0.960 0.157) 1.804 2.077 ( -0.625 -5.357 -2.232) 5.837 2.108 ( -0.102 1.659 1.953) 2.564 2.288 ( -1.159 0.022 0.928) 1.485 2.309 ( -1.645 3.955 1.712) 4.613 2.404 ( -2.925 -2.211 -2.809) 4.618 2.434 ( -0.939 0.297 2.293) 2.495 2.464 ( -0.465 1.301 2.186) 2.586 2.586 ( -0.337 2.286 0.566) 2.379 2.679 ( 5.549 1.250 0.218) 5.692 2.729 ( -0.633 0.932 -1.725) 2.060 2.743 ( 3.201 -5.783 -3.512) 7.484 2.801 ( 1.169 -3.532 0.452) 3.748 2.880 ( 2.239 -1.987 -2.766) 4.076 3.032 ( -0.316 -2.050 -1.078) 2.337 3.194 ( -1.792 3.512 3.980) 5.602 3.242 ( -1.396 4.823 1.631) 5.280 3.278 ( -1.197 -0.116 0.875) 1.487 3.534 ( 1.482 3.091 -2.578) 4.289 3.615 ( 0.573 0.163 -0.378) 0.706 3.641 ( 0.200 -0.716 -0.327) 0.812 3.866 ( -0.711 3.432 -0.276) 3.516 3.909 ( -0.311 -1.348 1.188) 1.824 4.133 ( -3.557 3.842 -0.919) 5.316 4.245 ( 4.716 7.799 1.475) 9.232 4.381 ( -0.204 0.312 -0.255) 0.452 4.423 ( 1.278 3.086 0.097) 3.341 4.435 ( 0.172 0.988 0.103) 1.008 4.518 ( -0.129 -0.652 -0.839) 1.070 4.629 ( 0.502 -0.926 0.979) 1.438 4.726 ( -1.261 1.283 -0.279) 1.821 4.760 ( 0.505 1.954 -0.993) 2.249 4.788 ( -0.570 -0.375 -1.304) 1.472 4.894 ( -0.083 1.103 2.242) 2.500 4.933 ( 0.407 0.335 0.080) 0.533 5.027 ( -0.133 -2.278 -0.074) 2.283 5.186 ( -0.486 -1.301 0.265) 1.414 5.310 ( -1.124 -0.464 -0.087) 1.219 5.335 ( 0.580 -2.518 -0.336) 2.606 5.456 ( 0.073 1.456 0.195) 1.471 5.467 ( -0.854 1.248 0.973) 1.798 5.482 ( -0.399 3.600 0.356) 3.639 5.492 ( 0.288 0.132 -0.548) 0.633 5.554 ( 1.028 -0.404 -0.768) 1.345 5.588 ( -0.589 -1.957 0.926) 2.244 5.731 ( -0.021 0.249 -0.431) 0.498 5.793 ( 0.377 -2.785 0.239) 2.821 5.814 ( -0.593 -2.803 -0.552) 2.918 5.880 ( -0.083 -1.295 -0.881) 1.568 6.209 ( -0.316 -1.196 0.361) 1.289 6.295 ( -0.059 -0.673 0.099) 0.682 ======================= Grid point 244 (104/140) ======================= q-point: (-0.08 0.31 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( 0.195 8.148 0.973) 8.208 1.660 ( 0.323 5.616 -1.031) 5.718 1.855 ( -2.738 6.473 2.145) 7.349 1.883 ( -0.164 3.870 -2.144) 4.427 1.909 ( -1.395 4.348 0.208) 4.571 1.978 ( -0.323 -1.512 1.655) 2.265 2.053 ( -0.003 -1.669 -2.303) 2.844 2.077 ( -0.193 1.512 0.714) 1.683 2.165 ( -3.407 -2.836 0.486) 4.459 2.205 ( -2.544 4.483 1.097) 5.269 2.299 ( -2.506 -2.010 -0.337) 3.230 2.338 ( -3.372 1.789 -3.248) 5.012 2.438 ( 0.940 0.658 1.071) 1.570 2.512 ( -1.748 -3.613 5.073) 6.469 2.553 ( 2.020 1.814 0.880) 2.854 2.655 ( 3.192 3.773 -0.745) 4.998 2.719 ( -1.688 0.542 -2.717) 3.244 2.843 ( 1.860 -2.961 -2.588) 4.351 2.880 ( 1.917 -2.305 -1.180) 3.222 2.956 ( -0.975 -4.352 -1.656) 4.757 3.025 ( 0.497 0.940 1.440) 1.790 3.141 ( 1.837 5.700 1.025) 6.076 3.185 ( -1.431 -3.216 2.345) 4.229 3.268 ( -1.061 -0.410 -0.088) 1.141 3.428 ( 2.238 9.181 -1.593) 9.583 3.557 ( -0.900 6.464 -0.387) 6.538 3.635 ( 0.804 1.548 -0.058) 1.745 3.813 ( 1.909 1.902 1.003) 2.875 3.946 ( -0.018 -0.398 0.499) 0.638 3.975 ( -0.226 9.575 -1.125) 9.643 4.113 ( 2.939 6.846 0.656) 7.479 4.357 ( 0.793 1.624 0.723) 1.947 4.407 ( 1.790 0.763 0.021) 1.946 4.413 ( 0.795 1.021 -0.640) 1.444 4.521 ( 0.251 -0.057 -0.072) 0.267 4.624 ( -1.027 1.438 0.000) 1.767 4.689 ( -0.316 1.582 0.775) 1.790 4.731 ( -0.314 0.838 -1.787) 1.999 4.786 ( 0.089 0.492 -0.652) 0.822 4.861 ( -0.156 0.708 0.047) 0.726 4.935 ( 0.363 0.249 2.235) 2.278 5.072 ( -0.224 -0.825 -0.493) 0.987 5.184 ( -1.252 0.568 0.049) 1.376 5.309 ( -2.080 -0.575 -0.066) 2.159 5.361 ( -0.203 0.956 -0.270) 1.014 5.396 ( -0.993 2.657 1.212) 3.084 5.427 ( -0.068 1.634 0.390) 1.682 5.451 ( -1.013 0.424 -0.249) 1.126 5.471 ( 0.821 2.387 0.020) 2.524 5.569 ( -0.248 0.390 0.870) 0.985 5.596 ( 0.425 -0.996 -1.115) 1.554 5.760 ( -0.443 -2.595 -0.112) 2.635 5.847 ( -0.068 -2.168 0.020) 2.169 5.861 ( -1.226 -2.622 -0.230) 2.904 5.912 ( -0.778 -2.640 -1.014) 2.933 6.227 ( -0.481 -0.688 0.241) 0.874 6.315 ( -0.428 -1.343 0.209) 1.425 ======================= Grid point 251 (105/140) ======================= q-point: ( 0.38 0.38 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.977 ( 8.645 -0.000 6.460) 10.792 1.029 ( 5.871 -0.000 -0.222) 5.875 1.182 ( 3.218 -0.000 5.706) 6.551 1.293 ( 9.651 -0.000 1.140) 9.718 1.499 ( -3.617 0.000 -6.264) 7.233 1.592 ( 1.072 -0.000 -2.064) 2.326 1.641 ( 3.208 -0.000 0.739) 3.292 1.792 ( 3.347 -0.000 -5.294) 6.264 1.806 ( -0.851 0.000 2.657) 2.790 1.818 ( -3.197 0.000 -1.235) 3.427 1.925 ( -0.425 0.000 -1.641) 1.695 1.961 ( -1.067 0.000 -0.220) 1.089 2.073 ( 6.595 -0.000 -9.017) 11.171 2.206 ( -3.520 0.000 -0.789) 3.607 2.453 ( -0.720 0.000 -0.001) 0.720 2.473 ( 5.256 -0.000 9.618) 10.960 2.519 ( 1.076 -0.000 1.508) 1.853 2.623 ( -2.780 0.000 1.331) 3.082 2.733 ( -1.079 0.000 5.435) 5.541 2.762 ( 0.054 -0.000 -0.039) 0.067 2.773 ( 4.826 -0.000 -2.472) 5.422 2.971 ( -0.395 0.000 -1.017) 1.091 3.066 ( -4.617 0.000 -5.345) 7.063 3.209 ( -0.580 0.000 0.029) 0.580 3.216 ( -0.165 0.000 -0.025) 0.167 3.246 ( -3.658 0.000 3.059) 4.769 3.317 ( 0.725 -0.000 -1.272) 1.464 3.508 ( 0.946 -0.000 4.531) 4.628 3.805 ( 1.177 -0.000 -0.680) 1.359 3.863 ( -0.010 0.000 -0.001) 0.010 3.948 ( -3.172 0.000 0.453) 3.204 4.015 ( -0.153 0.000 0.212) 0.262 4.031 ( -0.006 0.000 -0.221) 0.221 4.277 ( -0.150 0.000 0.037) 0.154 4.351 ( -1.634 0.000 -2.832) 3.269 4.359 ( -0.845 0.000 -0.025) 0.846 4.553 ( -3.911 0.000 -5.499) 6.748 4.652 ( 0.427 -0.000 4.272) 4.293 4.808 ( 0.998 -0.000 0.382) 1.069 4.979 ( 1.813 -0.000 -3.443) 3.892 5.018 ( 4.215 -0.000 1.269) 4.402 5.118 ( 0.089 -0.000 0.532) 0.540 5.217 ( -0.569 0.000 1.727) 1.818 5.300 ( 0.049 -0.000 -0.547) 0.549 5.367 ( 1.038 -0.000 0.867) 1.352 5.425 ( -1.809 0.000 -2.176) 2.829 5.605 ( -3.506 0.000 7.517) 8.295 5.655 ( 1.766 -0.000 1.635) 2.407 5.662 ( 0.274 -0.000 -0.028) 0.275 5.668 ( 0.266 -0.000 0.027) 0.267 5.698 ( -0.511 0.000 -1.145) 1.254 5.832 ( 1.008 -0.000 1.033) 1.443 5.834 ( -0.326 0.000 -0.004) 0.326 5.923 ( 0.332 -0.000 0.008) 0.332 5.943 ( -1.154 0.000 -0.064) 1.156 6.153 ( -1.378 0.000 -6.556) 6.699 6.257 ( 1.691 -0.000 0.142) 1.696 ======================= Grid point 252 (106/140) ======================= q-point: ( 0.46 0.38 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.056 ( 6.788 -3.504 5.511) 9.419 1.171 ( 3.336 -9.283 0.254) 9.867 1.221 ( 1.893 -2.220 7.132) 7.706 1.397 ( 8.933 -2.480 -1.911) 9.466 1.509 ( -1.615 -5.802 -4.290) 7.395 1.574 ( -2.452 -1.915 -1.668) 3.531 1.691 ( -0.561 -3.662 -1.533) 4.009 1.766 ( -1.333 2.458 -6.312) 6.903 1.857 ( -2.256 -5.484 2.625) 6.485 1.903 ( -1.619 -5.415 -0.792) 5.707 1.938 ( 2.856 -3.787 -4.288) 6.394 2.017 ( 0.824 -0.757 2.663) 2.889 2.113 ( 0.956 -7.839 -2.305) 8.226 2.199 ( -1.472 -1.903 -2.786) 3.681 2.475 ( 0.457 0.770 1.449) 1.703 2.513 ( 1.374 -1.867 1.139) 2.583 2.553 ( 3.432 -3.069 2.578) 5.277 2.622 ( -0.526 -0.738 3.385) 3.504 2.704 ( -3.121 -0.706 1.111) 3.387 2.784 ( 4.315 -0.111 4.300) 6.093 2.858 ( 0.024 -4.254 -1.599) 4.545 2.975 ( -0.018 -0.859 -0.604) 1.051 3.017 ( -1.982 0.277 -6.730) 7.021 3.209 ( -1.040 -0.615 3.284) 3.499 3.273 ( 0.927 -5.485 0.180) 5.566 3.323 ( 0.119 -6.556 0.147) 6.559 3.338 ( -1.988 -4.094 -0.205) 4.555 3.487 ( 0.412 2.386 2.926) 3.798 3.775 ( 0.628 2.550 -0.371) 2.652 3.924 ( 0.145 0.691 3.056) 3.136 4.006 ( -0.809 -11.359 -0.186) 11.389 4.074 ( 0.246 -4.116 -0.376) 4.141 4.107 ( 0.239 -7.754 0.140) 7.759 4.295 ( -3.008 0.674 -5.585) 6.380 4.334 ( 0.537 -4.759 0.308) 4.799 4.416 ( -1.373 -4.308 0.504) 4.549 4.544 ( -5.461 -3.551 -6.227) 9.012 4.656 ( 1.333 0.810 3.784) 4.093 4.805 ( 2.420 1.755 1.847) 3.514 4.957 ( 0.881 2.445 -3.088) 4.036 5.031 ( 3.951 1.511 0.938) 4.333 5.091 ( -0.294 2.895 0.907) 3.048 5.200 ( -0.951 1.589 1.466) 2.362 5.296 ( 0.273 0.187 -0.336) 0.471 5.360 ( 0.920 1.475 0.280) 1.760 5.392 ( -1.924 1.832 -1.494) 3.048 5.533 ( -2.707 5.213 6.618) 8.849 5.622 ( 0.960 3.830 -1.095) 4.098 5.627 ( 0.179 4.436 3.001) 5.359 5.676 ( 0.111 0.633 -0.124) 0.654 5.698 ( 0.279 -0.442 0.340) 0.624 5.790 ( 0.198 0.068 -2.069) 2.079 5.825 ( 1.936 4.044 0.189) 4.488 5.946 ( -3.059 -1.996 1.662) 4.013 5.999 ( 0.956 -3.914 -2.514) 4.749 6.121 ( -1.465 0.399 -4.030) 4.306 6.234 ( 1.063 2.941 0.174) 3.132 ======================= Grid point 253 (107/140) ======================= q-point: ( 0.54 0.38 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.192 ( 3.881 -6.235 3.153) 7.993 1.292 ( -4.128 -6.440 8.038) 11.096 1.396 ( 9.662 -7.591 -1.003) 12.328 1.475 ( 2.453 -4.864 -4.908) 7.333 1.566 ( -5.047 -3.933 -3.112) 7.115 1.659 ( -5.924 2.895 -4.730) 8.114 1.725 ( 1.247 -8.788 0.508) 8.890 1.765 ( -0.919 -5.258 -1.386) 5.515 1.923 ( -0.264 0.096 2.694) 2.709 1.994 ( 1.365 -3.736 -6.681) 7.776 2.024 ( -0.717 -7.958 2.909) 8.503 2.105 ( 2.854 -5.997 2.334) 7.040 2.237 ( -1.116 -2.746 -2.535) 3.900 2.366 ( -0.405 -15.109 -0.455) 15.121 2.468 ( -4.521 -5.100 -3.750) 7.779 2.570 ( 1.156 -2.863 3.190) 4.440 2.634 ( 2.486 -1.965 4.304) 5.345 2.659 ( 3.111 -2.450 0.305) 3.972 2.751 ( -2.980 -4.871 1.525) 5.910 2.816 ( 2.423 0.004 4.050) 4.719 2.912 ( -0.543 -3.453 -1.383) 3.759 2.992 ( -1.913 -1.635 0.524) 2.571 3.037 ( 2.971 -2.235 -6.394) 7.396 3.242 ( -0.371 -2.349 3.394) 4.145 3.356 ( 0.409 -1.339 0.638) 1.538 3.403 ( 0.073 -0.804 2.412) 2.544 3.495 ( 3.980 -7.652 -0.166) 8.627 3.518 ( -3.953 -10.870 -0.935) 11.604 3.717 ( -0.245 3.360 -0.448) 3.398 3.937 ( 0.642 -0.826 2.810) 2.999 4.091 ( -0.365 0.217 -2.959) 2.989 4.227 ( 1.245 -7.720 -0.768) 7.857 4.266 ( -0.958 -8.459 -1.575) 8.657 4.335 ( -1.054 -7.439 -1.909) 7.752 4.424 ( -0.093 -3.973 -0.239) 3.981 4.515 ( -0.488 -6.205 1.580) 6.422 4.611 ( -3.207 -5.846 -1.674) 6.875 4.666 ( 0.496 -2.269 0.343) 2.348 4.772 ( 2.230 3.281 1.927) 4.411 4.878 ( -0.307 5.220 -2.462) 5.780 4.990 ( 1.619 5.105 -0.284) 5.363 5.032 ( 0.719 2.577 1.486) 3.060 5.161 ( -1.010 1.750 1.214) 2.357 5.292 ( -0.084 1.764 0.341) 1.798 5.317 ( 1.033 2.568 -0.568) 2.826 5.353 ( -0.963 0.571 -1.381) 1.778 5.443 ( -2.297 3.813 6.199) 7.632 5.513 ( 0.105 6.609 1.141) 6.707 5.544 ( -0.363 4.904 1.765) 5.225 5.652 ( 0.856 1.938 -1.256) 2.463 5.683 ( 2.361 3.390 -1.819) 4.514 5.770 ( -1.200 0.594 0.463) 1.417 5.806 ( -0.255 -1.254 -1.848) 2.247 5.912 ( -1.215 3.255 -0.347) 3.492 6.046 ( 0.505 0.290 -3.398) 3.448 6.147 ( 0.170 -3.139 1.516) 3.490 6.192 ( -0.809 0.067 -0.106) 0.819 ======================= Grid point 254 (108/140) ======================= q-point: (-0.38 -0.62 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( 0.056 -8.154 0.299) 8.160 1.417 ( -4.772 -5.782 5.552) 9.329 1.505 ( 1.897 -2.010 -4.110) 4.953 1.571 ( -0.642 -7.508 -4.212) 8.633 1.649 ( -3.373 -6.933 2.417) 8.080 1.677 ( 2.608 -5.874 0.014) 6.427 1.829 ( 1.592 -3.692 -3.427) 5.283 1.916 ( 1.265 -7.102 2.319) 7.577 1.956 ( 1.821 -3.905 2.055) 4.773 2.037 ( 0.423 -1.985 -6.403) 6.717 2.141 ( -1.095 -3.973 1.730) 4.470 2.179 ( -2.161 0.826 -0.111) 2.316 2.271 ( 2.376 -3.909 0.688) 4.626 2.570 ( -2.218 -5.294 1.123) 5.848 2.611 ( -1.534 -5.157 -3.838) 6.609 2.635 ( 0.223 -3.950 2.682) 4.779 2.729 ( 0.215 -3.649 -2.654) 4.518 2.766 ( 2.045 -8.715 2.112) 9.197 2.824 ( 1.716 -1.602 6.578) 6.985 2.859 ( -1.296 -9.227 -0.483) 9.330 2.987 ( -1.276 -2.036 -0.439) 2.442 3.045 ( 0.519 -6.580 -0.445) 6.616 3.088 ( 2.167 -3.192 -3.794) 5.411 3.288 ( 0.358 -0.801 3.353) 3.466 3.328 ( -0.772 2.837 -1.110) 3.142 3.396 ( -0.445 1.092 3.542) 3.733 3.647 ( -0.366 1.943 -0.464) 2.031 3.704 ( -2.604 -8.791 0.276) 9.172 3.724 ( 3.237 -11.972 -1.376) 12.478 3.957 ( -1.452 -1.311 -0.634) 2.057 4.079 ( 1.059 0.185 -2.614) 2.826 4.337 ( 0.385 -4.106 -0.616) 4.170 4.384 ( -2.290 -4.979 -0.927) 5.558 4.468 ( 3.078 -4.279 0.801) 5.332 4.485 ( -1.566 -2.790 -0.829) 3.305 4.597 ( -0.520 -1.005 0.718) 1.340 4.669 ( 0.322 -2.306 -0.347) 2.354 4.719 ( 0.852 3.031 2.694) 4.144 4.751 ( 1.509 -0.249 0.391) 1.579 4.834 ( -2.537 -6.095 -2.984) 7.245 4.886 ( 0.683 4.572 -0.129) 4.624 5.006 ( 0.238 0.440 0.771) 0.919 5.147 ( 0.039 -0.534 0.746) 0.918 5.206 ( -0.124 5.456 -0.081) 5.458 5.284 ( 0.163 2.854 0.341) 2.879 5.358 ( -0.007 0.479 -0.489) 0.684 5.378 ( -0.385 2.081 0.971) 2.328 5.416 ( -1.451 1.874 2.854) 3.710 5.475 ( -0.102 1.893 2.845) 3.418 5.600 ( 1.322 2.904 -3.492) 4.730 5.642 ( 0.446 1.534 -0.475) 1.666 5.754 ( -0.511 1.566 0.473) 1.714 5.811 ( -0.587 -0.096 -2.228) 2.306 5.868 ( 0.317 0.756 0.000) 0.820 5.994 ( 0.476 3.758 -0.667) 3.846 6.192 ( 0.266 -1.316 0.144) 1.350 6.238 ( -0.384 -3.543 0.497) 3.598 ======================= Grid point 255 (109/140) ======================= q-point: (-0.31 -0.62 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.490 ( -2.787 -6.349 0.216) 6.937 1.509 ( -0.175 -9.438 -0.306) 9.445 1.602 ( 0.238 -6.257 0.245) 6.266 1.718 ( 1.174 -7.025 -2.252) 7.470 1.731 ( 1.330 -3.031 0.257) 3.320 1.836 ( 1.675 -7.268 2.820) 7.974 1.897 ( 1.050 -3.680 -2.240) 4.434 2.000 ( -0.062 -0.348 0.641) 0.732 2.044 ( 2.490 -1.303 -0.871) 2.942 2.102 ( 1.371 -6.850 -1.206) 7.089 2.148 ( -2.547 -2.567 -0.833) 3.711 2.212 ( -0.626 -3.025 0.002) 3.089 2.359 ( 2.249 -3.159 3.026) 4.919 2.613 ( 0.163 0.035 0.572) 0.596 2.624 ( -2.203 0.526 -3.185) 3.908 2.653 ( -1.141 0.681 1.797) 2.235 2.774 ( 0.030 -0.516 -0.379) 0.641 2.826 ( 2.440 -0.974 2.342) 3.519 2.908 ( -4.310 -0.333 0.224) 4.329 2.986 ( 2.983 -0.904 -1.776) 3.588 3.084 ( -1.671 -6.424 0.304) 6.645 3.143 ( 2.039 -3.716 -0.854) 4.324 3.183 ( -0.340 0.990 0.408) 1.124 3.284 ( 0.527 -8.709 -2.620) 9.109 3.346 ( -0.616 -1.661 5.042) 5.344 3.375 ( 0.437 -0.576 1.436) 1.608 3.621 ( -0.421 0.167 -0.701) 0.835 3.845 ( -1.255 -8.093 0.020) 8.190 3.952 ( -0.224 -10.084 -1.204) 10.158 3.987 ( -0.719 -2.314 0.248) 2.436 4.062 ( -0.515 1.177 -2.880) 3.154 4.385 ( -1.154 -1.282 -0.311) 1.753 4.450 ( -0.246 -3.060 0.448) 3.103 4.473 ( 0.537 3.046 -0.054) 3.093 4.516 ( -1.260 -0.699 -0.924) 1.711 4.595 ( 0.455 -0.133 -0.204) 0.516 4.661 ( 0.359 0.710 0.616) 1.006 4.738 ( 0.009 -2.565 1.142) 2.808 4.797 ( 1.965 -2.724 1.203) 3.567 4.824 ( 0.132 0.775 -0.160) 0.802 4.906 ( -1.575 0.255 -1.461) 2.163 5.051 ( -0.395 -4.271 0.414) 4.309 5.130 ( -0.380 1.097 0.005) 1.161 5.166 ( 1.339 1.167 0.188) 1.786 5.227 ( 1.460 0.434 -0.033) 1.523 5.336 ( -0.199 -0.734 1.335) 1.536 5.385 ( -0.608 -0.970 0.610) 1.297 5.431 ( -0.018 -1.959 0.232) 1.973 5.483 ( 0.170 -2.062 1.867) 2.787 5.558 ( 0.020 1.440 -1.394) 2.004 5.613 ( 0.431 1.792 -0.847) 2.029 5.726 ( 0.655 0.745 -0.961) 1.381 5.799 ( -0.205 1.037 -0.330) 1.108 5.858 ( 0.580 1.059 -0.535) 1.320 5.931 ( 0.658 2.954 0.034) 3.026 6.207 ( 0.145 -0.100 0.203) 0.269 6.288 ( 0.102 -1.614 0.280) 1.641 ======================= Grid point 256 (110/140) ======================= q-point: (-0.23 -0.62 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( 1.187 -7.684 0.836) 7.820 1.684 ( 0.416 -8.372 -0.128) 8.384 1.733 ( -0.532 -7.118 -0.229) 7.141 1.777 ( 2.243 -1.634 -1.147) 3.003 1.822 ( 1.120 -3.935 -2.174) 4.632 1.931 ( 1.245 2.600 1.564) 3.279 1.954 ( 0.585 -3.589 1.035) 3.781 1.994 ( 0.120 -2.617 -2.308) 3.492 2.103 ( 0.072 -2.850 -1.912) 3.433 2.179 ( 0.455 -3.243 4.497) 5.563 2.252 ( -1.263 -1.713 0.788) 2.270 2.275 ( 1.110 -7.767 -1.266) 7.947 2.432 ( 2.386 -2.608 3.159) 4.740 2.542 ( -3.794 3.593 -2.006) 5.597 2.597 ( 0.474 1.120 -1.335) 1.806 2.671 ( 0.534 -1.099 2.104) 2.434 2.751 ( 1.656 3.623 1.479) 4.249 2.831 ( 1.190 1.817 -5.154) 5.593 2.845 ( -3.535 2.823 1.207) 4.682 2.964 ( 3.279 3.945 -2.574) 5.740 3.064 ( 0.467 5.196 -0.679) 5.261 3.144 ( -3.287 -3.550 5.138) 7.057 3.255 ( 0.264 -3.048 -3.256) 4.468 3.326 ( -0.026 2.300 5.382) 5.853 3.472 ( -0.644 -7.819 -1.265) 7.947 3.496 ( 1.861 -8.050 -0.177) 8.264 3.619 ( 0.149 0.162 -0.956) 0.981 3.929 ( -2.711 1.213 -0.577) 3.026 3.979 ( 0.298 2.624 -0.229) 2.651 4.072 ( -3.543 -7.798 1.001) 8.624 4.157 ( 0.450 -9.354 -1.911) 9.558 4.379 ( -0.695 0.496 -0.255) 0.891 4.436 ( 0.227 0.663 0.448) 0.832 4.494 ( 1.304 -0.161 0.213) 1.331 4.510 ( -2.136 -0.212 -0.579) 2.223 4.598 ( -0.952 -1.199 -1.435) 2.098 4.682 ( 2.441 -0.992 1.780) 3.180 4.776 ( -0.919 -1.888 1.138) 2.388 4.816 ( 0.181 -0.260 -0.777) 0.839 4.857 ( -1.087 2.739 -0.568) 3.001 4.872 ( 0.576 -2.997 0.691) 3.129 5.100 ( -0.631 -0.388 0.131) 0.752 5.128 ( 0.727 0.192 0.087) 0.757 5.175 ( 1.907 -3.140 -0.066) 3.674 5.277 ( 1.404 -2.653 -0.011) 3.002 5.385 ( -0.302 -4.144 1.007) 4.275 5.414 ( 0.001 -2.092 0.430) 2.136 5.463 ( 0.411 -1.263 0.046) 1.329 5.528 ( -1.322 0.011 -0.152) 1.331 5.547 ( 0.661 -1.910 0.882) 2.205 5.577 ( 0.511 1.811 -1.074) 2.167 5.733 ( 0.837 -1.017 -0.802) 1.542 5.768 ( 0.161 1.954 0.276) 1.980 5.826 ( 0.581 2.416 -0.997) 2.677 5.890 ( 0.764 1.770 0.027) 1.928 6.202 ( 0.229 0.624 0.322) 0.739 6.301 ( 0.069 0.173 0.140) 0.233 ======================= Grid point 257 (111/140) ======================= q-point: (-0.15 -0.62 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.760 ( -0.270 0.116 0.336) 0.446 1.770 ( 0.263 -6.134 0.254) 6.145 1.811 ( 0.488 -1.355 -2.371) 2.774 1.859 ( -1.146 -4.165 -1.185) 4.480 1.889 ( 0.579 -0.280 -1.096) 1.271 1.917 ( 1.226 -4.452 1.252) 4.784 2.002 ( 1.371 -1.453 0.048) 1.998 2.021 ( 0.244 -0.533 -0.383) 0.700 2.128 ( -0.490 -0.195 1.162) 1.276 2.266 ( -2.103 -2.693 1.106) 3.592 2.271 ( -1.290 -3.334 0.110) 3.576 2.384 ( 2.224 -1.235 2.047) 3.265 2.458 ( -1.210 1.080 4.825) 5.090 2.496 ( -1.164 0.750 -1.191) 1.827 2.598 ( -0.175 -1.838 -0.936) 2.070 2.689 ( 2.192 1.181 -1.976) 3.179 2.703 ( 3.684 0.164 1.533) 3.993 2.772 ( 0.582 2.475 -4.758) 5.395 2.789 ( 0.393 1.848 1.507) 2.417 2.900 ( 2.336 2.903 -3.087) 4.839 3.010 ( 0.239 0.575 -1.419) 1.550 3.215 ( -2.208 -3.107 5.723) 6.876 3.275 ( -2.788 0.202 -2.383) 3.673 3.282 ( -0.477 2.325 2.999) 3.825 3.564 ( 1.602 -1.474 -1.767) 2.804 3.600 ( 0.486 -1.666 -1.169) 2.092 3.620 ( 0.409 -0.979 0.080) 1.064 3.887 ( -1.388 0.191 0.850) 1.639 3.922 ( -0.976 2.936 -0.280) 3.107 4.139 ( -4.232 -1.415 -0.137) 4.465 4.308 ( 2.298 -3.480 0.001) 4.170 4.387 ( 0.293 -1.330 -0.778) 1.568 4.432 ( -0.454 -0.037 -0.542) 0.708 4.470 ( -0.678 1.251 0.306) 1.455 4.510 ( 0.676 0.469 0.654) 1.051 4.620 ( 0.959 -1.085 -0.486) 1.527 4.712 ( -0.142 -0.881 0.998) 1.339 4.791 ( -0.248 0.910 -1.141) 1.480 4.804 ( -0.533 1.898 0.271) 1.990 4.853 ( -0.254 -4.044 0.284) 4.062 4.921 ( 0.995 -1.719 0.856) 2.163 5.057 ( -0.875 3.759 -0.047) 3.860 5.150 ( 0.508 -1.727 -0.037) 1.801 5.259 ( 0.784 -4.092 -0.212) 4.172 5.314 ( 0.437 -0.632 0.185) 0.790 5.455 ( 0.189 -1.806 0.769) 1.972 5.466 ( -0.245 -2.098 -0.424) 2.154 5.481 ( 0.020 -0.928 0.462) 1.037 5.520 ( -0.278 -0.640 0.382) 0.795 5.544 ( 0.002 0.646 -1.057) 1.239 5.574 ( 0.389 0.952 0.741) 1.267 5.745 ( -0.167 -0.070 0.610) 0.636 5.765 ( 0.288 -1.382 -0.473) 1.489 5.779 ( 0.693 1.682 -1.161) 2.158 5.872 ( 0.508 0.507 -0.487) 0.867 6.196 ( 0.044 0.009 0.376) 0.379 6.293 ( 0.005 0.423 0.096) 0.434 ======================= Grid point 258 (112/140) ======================= q-point: (-0.08 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.734 ( -0.041 2.256 -1.073) 2.498 1.766 ( 0.711 4.737 -0.176) 4.793 1.862 ( -3.097 -2.977 0.674) 4.348 1.878 ( -0.657 -0.730 -0.976) 1.384 1.933 ( -2.787 -2.888 -2.551) 4.756 1.977 ( 0.180 -0.076 2.572) 2.579 2.016 ( 0.108 0.038 -0.591) 0.602 2.066 ( -0.415 -3.989 -1.041) 4.143 2.115 ( -0.056 1.527 2.121) 2.614 2.271 ( -1.503 0.006 -0.052) 1.504 2.306 ( -1.145 2.941 3.537) 4.741 2.350 ( -3.246 1.642 -5.114) 6.277 2.439 ( 0.185 0.805 2.374) 2.513 2.482 ( 0.552 0.054 5.893) 5.919 2.594 ( 1.119 1.367 0.914) 1.990 2.703 ( -0.766 -0.221 -0.338) 0.866 2.726 ( 2.597 0.857 -4.827) 5.548 2.770 ( 1.894 -4.288 -2.730) 5.425 2.829 ( 3.432 -2.843 1.919) 4.852 2.895 ( 2.421 -1.710 -3.385) 4.499 3.019 ( -1.056 -1.403 -1.063) 2.052 3.186 ( -1.737 3.760 2.716) 4.953 3.232 ( -1.863 2.243 1.030) 3.092 3.270 ( -0.857 0.495 2.546) 2.732 3.544 ( 1.947 2.999 -2.027) 4.110 3.618 ( 0.369 0.519 -0.732) 0.971 3.642 ( 0.218 -0.893 -0.345) 0.982 3.855 ( -0.967 2.500 -0.113) 2.683 3.909 ( -0.172 -1.606 0.338) 1.650 4.099 ( -1.749 3.798 -0.431) 4.203 4.297 ( 3.197 6.117 0.447) 6.916 4.384 ( 1.295 1.371 0.420) 1.932 4.427 ( -0.084 0.572 -1.154) 1.290 4.446 ( 1.226 1.491 0.725) 2.062 4.515 ( -0.021 -0.592 0.195) 0.623 4.640 ( 0.143 -0.259 -0.199) 0.356 4.712 ( -0.685 0.811 0.999) 1.457 4.753 ( -0.454 2.069 -2.028) 2.933 4.782 ( 0.016 0.350 -0.043) 0.353 4.899 ( -0.177 0.952 1.336) 1.650 4.942 ( 0.211 0.409 0.904) 1.015 5.024 ( 0.150 -2.610 -0.469) 2.657 5.179 ( -0.902 -0.892 0.025) 1.269 5.296 ( -1.357 0.369 -0.152) 1.415 5.337 ( 0.059 -2.190 -0.293) 2.210 5.455 ( -0.467 1.003 0.242) 1.133 5.464 ( -0.329 1.781 0.981) 2.060 5.480 ( -0.207 4.283 0.249) 4.295 5.495 ( 0.538 -0.532 -0.184) 0.779 5.561 ( 0.853 -0.202 -1.067) 1.381 5.584 ( -0.742 -1.975 1.019) 2.343 5.730 ( 0.068 0.346 -0.039) 0.354 5.791 ( -0.212 -2.700 -1.491) 3.091 5.808 ( -0.520 -2.296 0.676) 2.449 5.875 ( -0.260 -0.868 -0.745) 1.173 6.206 ( -0.437 -0.987 0.337) 1.131 6.294 ( -0.066 -0.601 0.129) 0.618 ======================= Grid point 266 (113/140) ======================= q-point: ( 0.46 0.46 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.072 ( 1.765 -0.000 0.103) 1.768 1.093 ( 7.274 -0.000 7.485) 10.437 1.213 ( -2.655 0.000 8.091) 8.515 1.370 ( 3.565 -0.000 0.642) 3.622 1.430 ( -3.228 0.000 -8.530) 9.120 1.604 ( 1.919 -0.000 -1.532) 2.456 1.642 ( -1.202 0.000 -1.663) 2.051 1.783 ( -2.790 0.000 0.564) 2.846 1.785 ( -0.089 0.000 -4.663) 4.663 1.802 ( -0.416 0.000 0.224) 0.473 1.926 ( 2.365 -0.000 -6.027) 6.475 1.955 ( -0.080 0.000 0.072) 0.107 2.125 ( 3.054 -0.000 1.212) 3.286 2.169 ( -1.057 0.000 -2.065) 2.320 2.447 ( -0.282 0.000 0.004) 0.282 2.521 ( -0.783 0.000 -0.474) 0.915 2.552 ( 3.854 -0.000 1.821) 4.263 2.621 ( 0.003 -0.000 6.121) 6.121 2.726 ( -1.406 0.000 3.810) 4.061 2.762 ( -0.000 0.000 -0.040) 0.040 2.834 ( 4.822 -0.000 1.317) 4.999 2.962 ( -2.334 0.000 -0.246) 2.347 2.994 ( -1.637 0.000 -8.556) 8.711 3.204 ( -0.278 0.000 -0.044) 0.282 3.215 ( 0.021 -0.000 0.044) 0.049 3.224 ( -2.391 0.000 3.394) 4.151 3.318 ( 0.317 -0.000 -1.283) 1.322 3.531 ( 0.185 -0.000 4.029) 4.033 3.807 ( -0.126 0.000 -0.904) 0.913 3.863 ( -0.009 0.000 -0.003) 0.010 3.969 ( 4.304 -0.000 6.452) 7.756 4.015 ( -0.054 0.000 0.215) 0.222 4.030 ( 0.002 -0.000 -0.219) 0.219 4.276 ( -0.008 0.000 0.031) 0.032 4.300 ( -4.742 0.000 -7.702) 9.044 4.352 ( -0.355 0.000 -0.022) 0.355 4.463 ( -5.322 0.000 -5.950) 7.983 4.680 ( 1.383 -0.000 3.114) 3.408 4.843 ( 2.988 -0.000 2.289) 3.764 4.974 ( -0.292 0.000 -2.890) 2.905 5.072 ( 4.349 -0.000 0.497) 4.378 5.118 ( -0.497 0.000 1.268) 1.362 5.217 ( -0.125 0.000 0.923) 0.931 5.299 ( 0.034 -0.000 -0.397) 0.398 5.378 ( 0.241 -0.000 0.343) 0.419 5.399 ( -1.449 0.000 -0.810) 1.660 5.593 ( -3.526 0.000 6.800) 7.660 5.664 ( 0.114 -0.000 -0.034) 0.119 5.670 ( 0.080 -0.000 0.032) 0.086 5.682 ( 2.034 -0.000 1.225) 2.374 5.690 ( -0.383 0.000 -0.015) 0.384 5.831 ( -0.111 0.000 -0.005) 0.111 5.842 ( 0.687 -0.000 -0.791) 1.048 5.925 ( 0.113 -0.000 0.008) 0.113 5.933 ( -0.887 0.000 0.429) 0.986 6.119 ( -0.719 0.000 -5.679) 5.724 6.273 ( 1.106 -0.000 -0.287) 1.142 ======================= Grid point 267 (114/140) ======================= q-point: (-0.46 -0.54 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( 0.708 -4.016 3.369) 5.289 1.176 ( -1.917 -4.075 7.837) 9.039 1.262 ( 0.949 -6.722 4.122) 7.942 1.410 ( -1.664 -1.639 -7.500) 7.855 1.512 ( -2.177 -10.536 0.428) 10.767 1.543 ( 2.082 1.634 -2.659) 3.752 1.668 ( -1.268 -1.353 -3.036) 3.558 1.735 ( -0.621 2.939 -3.328) 4.483 1.852 ( -0.308 -6.692 2.635) 7.199 1.886 ( 0.030 -5.169 -2.626) 5.798 1.948 ( 2.099 -3.856 -4.702) 6.432 2.037 ( 0.632 -2.933 2.056) 3.637 2.111 ( -1.337 -5.128 1.505) 5.509 2.178 ( -0.249 -2.408 -2.293) 3.334 2.467 ( -0.993 3.446 -1.031) 3.732 2.531 ( 1.173 -3.279 -0.011) 3.483 2.597 ( 0.632 -5.023 0.787) 5.123 2.631 ( 0.693 0.003 3.439) 3.508 2.698 ( 0.649 0.540 4.729) 4.804 2.819 ( -0.601 -1.957 1.905) 2.796 2.864 ( 2.110 -1.124 0.399) 2.424 2.946 ( -3.691 -1.329 -2.166) 4.481 3.002 ( 3.537 -1.709 -6.475) 7.573 3.215 ( -0.072 -0.831 2.953) 3.068 3.290 ( 1.574 -7.106 0.647) 7.307 3.298 ( -2.908 -7.485 0.007) 8.030 3.333 ( -0.136 -2.398 -0.460) 2.445 3.500 ( -0.114 2.834 2.501) 3.781 3.774 ( -0.292 2.567 -0.425) 2.618 3.971 ( 4.144 1.785 6.036) 7.536 4.000 ( -0.086 -11.312 0.144) 11.314 4.070 ( -0.449 -3.728 -1.116) 3.917 4.116 ( 1.188 -7.415 1.047) 7.582 4.225 ( -4.726 -0.239 -8.026) 9.317 4.344 ( 0.781 -5.115 -0.131) 5.176 4.412 ( 0.223 -4.758 1.052) 4.878 4.468 ( -3.597 -4.195 -4.009) 6.828 4.680 ( 1.114 1.104 1.719) 2.327 4.841 ( 2.279 2.001 1.397) 3.339 4.944 ( -1.320 2.344 -2.265) 3.517 5.072 ( 3.186 2.335 -0.295) 3.960 5.092 ( -0.305 2.589 1.037) 2.806 5.200 ( 0.288 1.896 0.907) 2.121 5.299 ( 0.254 -0.084 -0.087) 0.281 5.364 ( -0.835 1.147 -0.215) 1.435 5.372 ( -0.307 2.192 -0.434) 2.256 5.528 ( -2.811 4.801 6.699) 8.708 5.625 ( 0.428 4.229 -0.909) 4.346 5.639 ( -0.138 4.209 2.614) 4.956 5.678 ( 0.632 1.007 -0.588) 1.326 5.704 ( 0.328 -1.310 1.364) 1.920 5.786 ( 0.913 0.348 -3.479) 3.614 5.839 ( 0.125 5.296 -0.063) 5.297 5.922 ( -2.496 -2.434 2.236) 4.142 6.003 ( 1.752 -3.744 -3.147) 5.195 6.097 ( -0.877 -0.391 -2.270) 2.465 6.243 ( 0.548 3.220 -0.342) 3.284 ======================= Grid point 268 (115/140) ======================= q-point: (-0.38 -0.54 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.206 ( -5.491 -5.693 4.254) 8.982 1.295 ( 1.240 -5.816 7.219) 9.353 1.394 ( -12.378 -4.832 -4.853) 14.146 1.466 ( -1.105 -8.330 0.296) 8.408 1.524 ( 5.051 -1.662 -3.785) 6.527 1.631 ( 1.193 -0.758 -1.616) 2.147 1.749 ( -0.697 -8.192 -0.635) 8.246 1.767 ( 4.709 -6.074 0.194) 7.688 1.922 ( 0.877 -1.192 -3.181) 3.508 1.999 ( 1.885 -1.264 -2.881) 3.667 2.027 ( -0.329 -7.961 2.149) 8.252 2.137 ( 0.960 -7.157 1.291) 7.336 2.213 ( -1.438 -3.376 -1.284) 3.887 2.355 ( -1.250 -12.956 0.603) 13.030 2.432 ( 0.419 -4.981 -1.698) 5.279 2.584 ( -0.678 -2.329 2.316) 3.354 2.655 ( -0.605 -2.759 -0.033) 2.825 2.696 ( 2.111 -3.205 0.411) 3.860 2.735 ( 0.304 -2.964 1.854) 3.509 2.841 ( -0.941 -1.071 2.829) 3.168 2.904 ( -0.553 -2.963 1.354) 3.304 2.972 ( -0.965 -2.687 -1.710) 3.328 3.050 ( 3.401 -2.063 -5.503) 6.791 3.255 ( 0.663 -2.460 2.830) 3.808 3.353 ( -0.955 -0.810 -0.331) 1.295 3.418 ( 0.005 -0.160 4.508) 4.510 3.462 ( -5.010 -9.749 -1.189) 11.025 3.530 ( 2.578 -9.854 -0.871) 10.223 3.715 ( 0.304 3.187 -0.370) 3.223 3.965 ( 1.838 1.734 3.147) 4.036 4.071 ( -0.991 -0.333 -3.807) 3.948 4.234 ( -2.754 -7.475 -2.002) 8.215 4.241 ( 1.397 -8.071 0.052) 8.191 4.322 ( -1.067 -9.632 -0.151) 9.692 4.430 ( 1.459 -3.578 -0.717) 3.930 4.526 ( 0.870 -5.567 1.075) 5.736 4.582 ( -0.207 -9.058 -0.024) 9.060 4.672 ( 0.329 -0.539 0.188) 0.659 4.802 ( 1.914 3.363 0.289) 3.880 4.858 ( -1.641 5.114 -1.630) 5.612 5.005 ( 1.436 5.920 -1.245) 6.218 5.038 ( -0.568 2.604 0.846) 2.797 5.165 ( 0.978 1.867 1.142) 2.397 5.291 ( -0.429 2.487 0.572) 2.588 5.326 ( 0.760 1.847 0.262) 2.014 5.338 ( -0.574 0.135 -2.157) 2.236 5.440 ( -2.636 3.853 6.766) 8.220 5.517 ( 0.015 6.650 0.545) 6.673 5.546 ( -0.508 4.952 1.760) 5.280 5.655 ( 0.605 1.807 -0.997) 2.150 5.699 ( 1.946 4.588 -3.135) 5.887 5.758 ( -1.220 -0.535 1.386) 1.923 5.798 ( 0.186 -0.559 -1.841) 1.933 5.901 ( -0.692 2.517 0.202) 2.618 6.045 ( 1.497 0.286 -3.009) 3.373 6.155 ( 0.404 -4.647 1.450) 4.885 6.187 ( -0.126 1.403 -0.309) 1.442 ======================= Grid point 269 (116/140) ======================= q-point: (-0.31 -0.54 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.326 ( -3.184 -8.556 1.358) 9.230 1.349 ( -8.844 -5.530 1.440) 10.529 1.498 ( -0.194 -6.462 2.705) 7.008 1.555 ( -1.345 -7.462 -1.797) 7.792 1.677 ( 5.127 -6.138 0.362) 8.006 1.723 ( 5.665 -6.208 -0.056) 8.405 1.832 ( 1.108 -3.334 -4.027) 5.344 1.944 ( 1.370 -6.719 2.493) 7.296 1.976 ( 2.624 -4.475 -0.339) 5.199 2.013 ( -0.078 -1.628 -7.239) 7.420 2.131 ( -2.022 -3.035 2.590) 4.473 2.180 ( 1.814 1.654 1.518) 2.887 2.292 ( 1.155 -5.645 -1.088) 5.864 2.548 ( -1.882 -7.491 0.958) 7.783 2.597 ( -0.485 -2.771 0.543) 2.865 2.645 ( 0.088 -4.077 2.308) 4.686 2.714 ( -0.699 -3.206 -2.532) 4.145 2.759 ( -3.748 -7.400 -1.392) 8.411 2.843 ( 1.090 -4.349 2.863) 5.320 2.894 ( 3.226 -6.565 3.185) 7.978 2.968 ( -1.499 -2.949 -0.382) 3.330 3.044 ( 0.122 -7.134 -1.610) 7.314 3.098 ( 2.167 -2.560 -3.880) 5.128 3.307 ( 0.870 0.380 2.642) 2.808 3.314 ( -0.843 1.849 -1.037) 2.281 3.405 ( -0.480 1.031 3.269) 3.462 3.629 ( -3.662 -0.700 -0.866) 3.828 3.646 ( -4.203 -9.730 0.744) 10.625 3.773 ( 4.061 -8.520 -1.339) 9.533 3.952 ( 0.484 -0.241 1.455) 1.552 4.065 ( -1.777 -0.064 -3.488) 3.915 4.321 ( -2.274 -4.249 -0.557) 4.851 4.377 ( -0.156 -5.107 1.154) 5.238 4.453 ( -1.830 -4.762 -0.879) 5.176 4.500 ( 1.353 -1.449 -0.501) 2.044 4.610 ( 2.198 -1.320 0.973) 2.742 4.663 ( -0.842 -1.216 -0.478) 1.554 4.728 ( -0.323 2.510 1.539) 2.962 4.776 ( 1.632 0.671 -2.849) 3.351 4.813 ( 0.698 -7.266 1.653) 7.484 4.895 ( 1.183 4.496 -0.741) 4.708 5.001 ( -1.455 0.336 0.225) 1.510 5.153 ( 0.644 0.451 0.477) 0.920 5.211 ( 0.889 4.428 0.032) 4.516 5.290 ( 0.823 2.628 0.228) 2.763 5.356 ( 0.043 -0.617 -0.536) 0.818 5.377 ( -0.633 2.488 1.542) 2.995 5.412 ( -1.138 2.405 2.650) 3.755 5.484 ( -0.128 1.452 2.343) 2.760 5.597 ( 0.476 3.096 -3.154) 4.445 5.646 ( 0.699 1.653 -0.837) 1.980 5.758 ( 1.003 1.687 0.544) 2.036 5.801 ( -0.116 -0.464 -1.226) 1.316 5.872 ( 0.500 0.520 -0.279) 0.773 6.001 ( 1.271 3.660 -0.782) 3.952 6.195 ( 0.131 -1.251 -0.121) 1.264 6.242 ( 0.822 -3.483 0.652) 3.637 ======================= Grid point 270 (117/140) ======================= q-point: (-0.23 -0.54 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.469 ( -1.113 -9.547 1.036) 9.667 1.507 ( -0.960 -10.356 1.894) 10.572 1.605 ( 0.451 -5.951 0.338) 5.978 1.719 ( 0.981 -7.361 -0.523) 7.445 1.776 ( 5.204 -1.791 -0.765) 5.556 1.875 ( 2.658 -5.410 2.245) 6.432 1.893 ( 0.913 -4.521 -3.773) 5.959 2.000 ( -0.499 -0.012 0.305) 0.585 2.044 ( 1.485 -1.848 -4.059) 4.700 2.116 ( 2.100 -7.783 -1.811) 8.262 2.153 ( 0.785 -1.289 3.334) 3.660 2.216 ( 0.721 -2.664 1.599) 3.189 2.391 ( 2.508 -3.965 0.099) 4.693 2.580 ( -3.134 2.138 -1.482) 4.073 2.614 ( -0.937 0.399 0.200) 1.038 2.656 ( -0.103 -1.150 3.240) 3.440 2.763 ( -0.658 -1.951 -1.822) 2.749 2.852 ( -3.221 -1.290 4.666) 5.814 2.865 ( 0.556 1.290 -4.193) 4.422 3.019 ( 3.480 -1.296 0.220) 3.720 3.063 ( -2.323 -4.919 0.704) 5.485 3.157 ( 1.187 -2.480 -1.606) 3.184 3.181 ( -0.284 -0.130 0.161) 0.351 3.274 ( -0.272 -8.608 -2.955) 9.106 3.358 ( -0.097 -2.240 3.238) 3.939 3.389 ( 0.856 -0.774 1.474) 1.872 3.614 ( -0.598 -0.319 -0.145) 0.693 3.821 ( -3.178 -9.253 0.240) 9.786 3.918 ( -2.843 -7.945 -2.043) 8.682 3.995 ( -0.310 -1.137 1.252) 1.719 4.042 ( -1.199 -0.611 -1.617) 2.104 4.368 ( -1.625 -1.775 0.274) 2.422 4.450 ( -1.398 -2.276 0.140) 2.674 4.474 ( -1.348 1.517 0.184) 2.038 4.501 ( 0.923 -0.992 -0.529) 1.454 4.576 ( -0.964 1.911 -1.128) 2.419 4.687 ( 0.643 -1.233 1.091) 1.767 4.750 ( 2.228 -1.293 1.675) 3.073 4.799 ( -0.727 -3.196 -3.167) 4.557 4.823 ( -0.049 1.478 -0.181) 1.490 4.903 ( 0.660 1.134 2.013) 2.403 5.044 ( -0.831 -4.603 0.058) 4.678 5.127 ( 0.232 0.638 -0.050) 0.680 5.191 ( 2.853 0.940 0.202) 3.011 5.253 ( 3.016 0.440 -0.076) 3.049 5.339 ( -0.020 -0.615 1.164) 1.316 5.382 ( -0.497 -1.144 1.146) 1.694 5.429 ( -0.256 -2.464 -0.285) 2.494 5.489 ( -0.158 -1.397 1.111) 1.791 5.555 ( 0.032 1.160 -0.632) 1.321 5.615 ( 0.632 1.920 -1.074) 2.289 5.736 ( 1.827 0.851 -0.832) 2.181 5.799 ( 0.189 0.845 0.290) 0.914 5.863 ( 0.837 1.115 -0.736) 1.576 5.942 ( 1.331 3.039 -0.254) 3.328 6.211 ( 0.419 -0.154 0.155) 0.472 6.293 ( 0.549 -1.355 0.301) 1.492 ======================= Grid point 271 (118/140) ======================= q-point: (-0.15 -0.54 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.645 ( 0.689 -8.064 1.069) 8.164 1.698 ( 2.336 -7.869 0.002) 8.208 1.727 ( -0.526 -5.488 -0.012) 5.514 1.807 ( 3.355 -1.598 -0.347) 3.732 1.830 ( 1.998 -3.405 -1.726) 4.308 1.951 ( 1.361 1.456 0.504) 2.056 1.954 ( -0.196 -2.616 -1.140) 2.860 2.008 ( 2.585 -2.178 1.553) 3.719 2.097 ( 0.647 -2.863 -2.066) 3.589 2.190 ( -0.584 -2.397 1.493) 2.883 2.244 ( -0.320 -1.621 0.363) 1.691 2.293 ( 1.664 -7.501 -0.608) 7.708 2.472 ( 2.873 -1.998 3.207) 4.747 2.507 ( -1.903 2.339 1.355) 3.306 2.591 ( -1.097 1.042 -0.373) 1.558 2.685 ( 0.987 -0.902 0.162) 1.347 2.771 ( 1.101 1.796 1.158) 2.404 2.809 ( -2.648 1.023 -1.570) 3.244 2.824 ( 0.261 3.267 -3.546) 4.829 2.987 ( 2.368 4.754 -2.186) 5.744 3.067 ( 0.723 5.021 -0.775) 5.131 3.131 ( -2.555 -4.057 5.288) 7.138 3.238 ( -1.281 -2.109 -2.621) 3.599 3.335 ( -0.723 2.507 2.117) 3.360 3.462 ( -0.200 -8.600 -1.619) 8.753 3.516 ( 1.612 -7.389 -0.064) 7.563 3.622 ( 0.599 -0.169 0.104) 0.631 3.896 ( -2.887 0.692 0.565) 3.022 3.979 ( -0.980 2.240 0.313) 2.465 4.033 ( -3.796 -5.897 0.531) 7.033 4.142 ( -1.729 -11.322 -2.031) 11.632 4.372 ( -0.344 0.131 0.478) 0.603 4.438 ( 0.019 0.448 -0.126) 0.466 4.476 ( -3.109 -0.486 -0.988) 3.298 4.522 ( 2.533 -0.178 1.647) 3.027 4.581 ( -0.658 -2.147 -0.905) 2.421 4.711 ( 0.398 -0.910 1.503) 1.801 4.769 ( -0.254 -0.861 -1.754) 1.970 4.806 ( -0.719 0.142 -1.119) 1.337 4.845 ( 0.413 -0.495 0.329) 0.724 4.888 ( 0.607 -0.697 1.946) 2.154 5.092 ( -0.916 -0.256 0.038) 0.952 5.139 ( 1.132 -0.516 0.062) 1.246 5.204 ( 3.164 -1.671 -0.101) 3.580 5.297 ( 2.200 -1.868 -0.007) 2.886 5.386 ( -0.191 -3.985 1.164) 4.156 5.417 ( 0.184 -2.309 0.527) 2.376 5.466 ( 0.265 -1.227 -0.603) 1.393 5.513 ( -1.261 -0.681 -0.164) 1.442 5.556 ( 0.265 -0.799 1.047) 1.343 5.580 ( 0.702 1.353 -1.037) 1.843 5.743 ( 1.473 -0.529 -0.474) 1.636 5.772 ( 0.316 1.943 0.234) 1.983 5.831 ( 0.941 2.573 -0.935) 2.895 5.900 ( 1.159 2.007 -0.257) 2.332 6.207 ( 0.483 0.716 0.304) 0.916 6.303 ( 0.200 0.328 0.156) 0.414 ======================= Grid point 272 (119/140) ======================= q-point: (-0.08 -0.54 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.752 ( -0.813 0.311 -1.201) 1.483 1.776 ( 0.767 -4.814 -0.188) 4.878 1.812 ( 0.455 -2.332 -0.573) 2.444 1.848 ( 0.222 -1.616 -0.912) 1.869 1.888 ( 0.717 1.127 -2.234) 2.603 1.940 ( 1.661 -2.977 2.699) 4.349 2.013 ( 0.889 -2.608 -1.111) 2.971 2.031 ( 0.731 0.734 1.572) 1.883 2.129 ( 0.030 -0.561 0.698) 0.897 2.251 ( -1.165 -3.565 0.432) 3.775 2.259 ( -0.876 -1.362 0.338) 1.654 2.400 ( 0.732 0.084 -2.365) 2.477 2.458 ( -1.787 0.746 4.579) 4.972 2.514 ( 1.939 0.880 5.907) 6.279 2.588 ( -0.845 -1.863 -0.270) 2.064 2.695 ( 1.204 -0.169 -3.142) 3.369 2.729 ( 0.357 1.727 -1.032) 2.043 2.763 ( 1.052 2.242 -4.335) 4.992 2.824 ( 3.261 -1.639 2.378) 4.356 2.908 ( 1.469 2.870 -3.070) 4.452 3.005 ( 0.047 1.410 -1.575) 2.114 3.208 ( -2.412 -3.579 2.728) 5.106 3.235 ( -2.643 1.025 0.280) 2.849 3.284 ( -0.717 2.076 1.966) 2.948 3.574 ( 1.228 -2.786 -1.925) 3.602 3.601 ( 0.372 -0.485 -1.067) 1.230 3.627 ( 0.652 -0.781 0.447) 1.111 3.881 ( -0.560 -0.520 1.037) 1.289 3.900 ( -2.656 2.866 -0.558) 3.947 4.105 ( -1.813 -2.195 0.128) 2.850 4.320 ( -0.195 -5.504 -0.132) 5.509 4.381 ( -0.416 -1.554 -0.848) 1.819 4.432 ( 0.479 0.403 -0.359) 0.722 4.465 ( -0.898 0.114 0.774) 1.191 4.528 ( 1.793 1.116 1.389) 2.528 4.608 ( -1.677 -1.541 -1.722) 2.855 4.733 ( 2.072 -0.037 2.288) 3.087 4.775 ( -1.213 0.431 -2.268) 2.608 4.801 ( -0.491 0.461 -0.266) 0.724 4.858 ( 0.958 -2.162 1.381) 2.739 4.930 ( 0.072 -2.289 0.281) 2.307 5.047 ( -0.908 3.575 0.142) 3.691 5.156 ( 0.639 -0.757 -0.148) 1.002 5.269 ( 1.192 -3.068 -0.262) 3.301 5.320 ( 0.572 0.202 0.194) 0.637 5.458 ( -0.285 -1.266 0.397) 1.357 5.465 ( 0.275 -2.024 0.107) 2.046 5.483 ( 0.036 -1.481 0.137) 1.488 5.519 ( -0.255 -0.651 0.422) 0.817 5.539 ( -0.122 0.520 -0.810) 0.970 5.581 ( 0.361 1.070 0.642) 1.299 5.746 ( -0.031 0.268 0.447) 0.522 5.764 ( -0.009 -0.427 -1.101) 1.181 5.788 ( 1.286 1.355 -0.228) 1.882 5.875 ( 0.564 1.017 -0.696) 1.356 6.198 ( 0.154 0.308 0.357) 0.496 6.294 ( 0.022 0.469 0.117) 0.484 ======================= Grid point 280 (120/140) ======================= q-point: (-0.46 -0.46 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.067 ( -2.905 0.000 0.370) 2.928 1.130 ( -9.187 0.000 7.894) 12.113 1.239 ( 5.417 -0.000 8.329) 9.936 1.371 ( -1.959 0.000 -8.650) 8.869 1.376 ( -2.542 0.000 0.315) 2.562 1.607 ( -0.492 0.000 -1.827) 1.892 1.625 ( -0.287 0.000 -1.899) 1.920 1.760 ( -2.378 0.000 -3.116) 3.920 1.766 ( -0.975 0.000 1.389) 1.697 1.812 ( 2.494 -0.000 -0.120) 2.496 1.924 ( 1.846 -0.000 -6.442) 6.702 1.957 ( 0.296 -0.000 -0.025) 0.297 2.115 ( -5.360 0.000 2.941) 6.114 2.167 ( 0.407 -0.000 -0.980) 1.061 2.447 ( 0.282 -0.000 0.003) 0.282 2.505 ( -1.448 0.000 0.258) 1.471 2.569 ( 0.105 -0.000 -1.140) 1.145 2.667 ( 3.959 -0.000 2.432) 4.646 2.742 ( 0.701 -0.000 6.491) 6.529 2.762 ( 0.028 -0.000 -0.040) 0.049 2.873 ( -0.303 0.000 2.561) 2.579 2.906 ( -1.466 0.000 -5.551) 5.741 2.995 ( 4.059 -0.000 -4.957) 6.407 3.203 ( 0.028 -0.000 0.036) 0.046 3.216 ( 0.216 -0.000 -0.032) 0.219 3.220 ( -0.764 0.000 3.289) 3.376 3.314 ( -0.126 0.000 -0.957) 0.965 3.543 ( -0.441 0.000 3.201) 3.232 3.798 ( -1.100 0.000 -0.349) 1.154 3.863 ( 0.005 -0.000 -0.001) 0.005 4.016 ( 0.055 -0.000 0.193) 0.201 4.029 ( 0.009 -0.000 -0.200) 0.200 4.075 ( 8.622 -0.000 9.877) 13.111 4.188 ( -7.602 0.000 -12.027) 14.228 4.276 ( -0.010 0.000 0.030) 0.031 4.352 ( 0.363 -0.000 -0.020) 0.364 4.422 ( -0.109 0.000 -1.160) 1.165 4.702 ( 1.080 -0.000 1.252) 1.653 4.871 ( 0.710 -0.000 -0.185) 0.734 4.953 ( -1.724 0.000 -1.159) 2.078 5.108 ( 1.734 -0.000 -2.383) 2.947 5.118 ( 0.082 -0.000 1.684) 1.686 5.225 ( 1.315 -0.000 0.544) 1.423 5.298 ( 0.086 -0.000 -0.551) 0.558 5.371 ( -0.960 0.000 0.407) 1.042 5.395 ( 0.097 -0.000 0.036) 0.103 5.582 ( -3.007 0.000 6.518) 7.178 5.664 ( -0.068 0.000 -0.041) 0.080 5.670 ( -0.126 0.000 0.041) 0.133 5.688 ( 0.483 -0.000 -0.762) 0.903 5.713 ( 1.891 -0.000 3.183) 3.702 5.831 ( 0.116 -0.000 -0.006) 0.116 5.838 ( -0.161 0.000 -3.082) 3.086 5.925 ( -0.118 0.000 0.008) 0.118 5.928 ( -0.720 0.000 1.584) 1.740 6.093 ( -0.639 0.000 -4.114) 4.163 6.278 ( 0.327 -0.000 -0.908) 0.965 ======================= Grid point 281 (121/140) ======================= q-point: (-0.38 -0.46 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.078 ( -10.174 -3.419 5.505) 12.062 1.172 ( -7.340 -8.398 1.842) 11.305 1.285 ( 0.177 -0.114 4.665) 4.670 1.364 ( -0.775 -2.392 -4.063) 4.778 1.457 ( -5.158 -6.131 -0.694) 8.042 1.567 ( 1.650 -4.063 -1.674) 4.694 1.649 ( -0.848 -0.113 -0.662) 1.081 1.724 ( -0.568 -0.727 -1.821) 2.041 1.865 ( 0.700 -7.339 1.895) 7.612 1.892 ( 2.877 -4.385 -1.697) 5.512 1.946 ( 0.677 -4.048 -5.051) 6.508 2.046 ( 0.365 -2.771 1.042) 2.983 2.089 ( -3.732 -6.992 1.044) 7.994 2.182 ( 2.010 -1.992 -0.295) 2.845 2.459 ( -0.075 3.503 0.372) 3.523 2.527 ( -1.470 -4.811 -1.024) 5.133 2.579 ( -2.121 -2.603 -0.239) 3.366 2.666 ( 2.647 0.030 1.803) 3.203 2.734 ( 1.878 0.946 2.922) 3.600 2.808 ( -1.483 -1.431 -0.482) 2.117 2.874 ( -3.119 -1.451 3.087) 4.622 2.919 ( 2.212 -1.639 -3.332) 4.322 3.024 ( 4.272 -1.480 -4.848) 6.629 3.230 ( 0.851 -1.148 2.545) 2.919 3.269 ( -1.923 -5.137 0.112) 5.487 3.310 ( 0.359 -8.613 -0.373) 8.628 3.330 ( 0.740 -2.758 1.066) 3.048 3.503 ( -0.818 3.084 1.847) 3.687 3.766 ( -0.972 2.244 0.038) 2.446 4.000 ( 0.482 -9.981 0.024) 9.993 4.036 ( 2.079 -0.549 2.710) 3.460 4.052 ( -1.035 -1.453 -2.697) 3.233 4.137 ( -1.611 -2.789 -3.536) 4.783 4.159 ( 1.459 -5.276 1.788) 5.758 4.346 ( 0.051 -5.396 -0.861) 5.465 4.429 ( 1.415 -6.796 0.660) 6.973 4.449 ( 1.960 -2.709 0.848) 3.449 4.695 ( 0.894 1.348 0.436) 1.675 4.851 ( -0.864 1.611 -2.123) 2.802 4.922 ( -1.134 2.409 0.111) 2.665 5.080 ( -1.191 2.288 -2.641) 3.691 5.099 ( 1.259 2.800 0.023) 3.071 5.216 ( 2.061 1.923 0.869) 2.950 5.299 ( -0.019 -0.248 -0.497) 0.556 5.357 ( -0.238 1.182 1.164) 1.676 5.368 ( -0.385 2.369 -0.864) 2.551 5.523 ( -2.846 4.596 7.066) 8.897 5.625 ( 0.075 4.401 -0.825) 4.478 5.644 ( -0.483 3.937 1.854) 4.379 5.683 ( 0.629 0.997 -0.625) 1.334 5.719 ( 0.997 -0.882 2.707) 3.017 5.784 ( 1.768 0.570 -5.259) 5.578 5.823 ( -2.979 5.118 0.428) 5.937 5.914 ( -0.805 -1.812 2.680) 3.334 6.015 ( 2.830 -3.715 -3.705) 5.961 6.083 ( -0.754 -1.693 -0.004) 1.853 6.243 ( -0.098 3.230 -0.958) 3.371 ======================= Grid point 282 (122/140) ======================= q-point: (-0.31 -0.46 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.140 ( -9.007 -7.785 6.386) 13.510 1.206 ( -15.241 -3.060 -2.713) 15.780 1.363 ( 1.393 -7.631 5.100) 9.284 1.426 ( -2.282 -4.704 -2.400) 5.753 1.559 ( 1.036 -7.483 -0.278) 7.559 1.668 ( 5.211 -3.362 1.214) 6.319 1.743 ( 0.627 -7.653 -1.903) 7.911 1.797 ( 0.195 -6.782 -1.605) 6.972 1.936 ( 3.352 -2.162 -2.361) 4.634 2.007 ( 1.881 -0.737 -1.986) 2.833 2.034 ( 0.361 -5.911 1.641) 6.145 2.129 ( -1.040 -9.434 -2.409) 9.792 2.207 ( -0.131 -1.816 1.254) 2.211 2.345 ( -1.249 -12.767 0.761) 12.850 2.461 ( 4.206 -5.674 1.732) 7.273 2.573 ( -2.010 -2.206 0.755) 3.078 2.631 ( -2.607 -3.941 -1.225) 4.882 2.694 ( -1.201 -0.344 -1.578) 2.013 2.773 ( 3.605 -4.020 1.834) 5.703 2.819 ( -3.198 -2.492 -0.438) 4.078 2.907 ( -1.422 -2.466 4.530) 5.350 2.963 ( 1.003 -2.418 -3.250) 4.174 3.068 ( 3.370 -1.613 -4.874) 6.141 3.277 ( 1.723 -2.395 1.930) 3.526 3.334 ( -2.122 -1.509 -0.704) 2.697 3.411 ( -3.524 -7.531 -0.280) 8.319 3.433 ( -0.557 0.873 4.455) 4.574 3.543 ( 0.371 -9.660 -0.652) 9.689 3.720 ( 0.638 1.440 -0.179) 1.585 3.990 ( 1.254 2.407 -0.203) 2.722 4.045 ( -1.206 0.392 -1.540) 1.995 4.202 ( -2.104 -6.889 -0.508) 7.221 4.247 ( -0.891 -8.321 0.603) 8.390 4.321 ( 1.129 -8.445 0.837) 8.561 4.442 ( 1.065 -4.665 -1.170) 4.926 4.540 ( 1.935 -5.504 0.463) 5.853 4.610 ( 3.081 -9.040 2.403) 9.848 4.674 ( 0.220 0.444 -0.292) 0.575 4.804 ( -0.491 1.915 -3.666) 4.165 4.846 ( 0.008 5.201 1.088) 5.313 5.004 ( -0.425 4.846 -3.125) 5.782 5.031 ( -0.721 3.603 0.532) 3.712 5.188 ( 2.330 2.145 0.966) 3.311 5.287 ( -0.716 2.860 0.755) 3.044 5.322 ( -0.581 0.312 -2.026) 2.131 5.338 ( 0.954 0.946 0.402) 1.403 5.438 ( -2.605 3.878 7.076) 8.479 5.516 ( -0.498 6.343 0.307) 6.369 5.547 ( -0.378 4.924 1.230) 5.089 5.656 ( 0.143 2.473 -1.334) 2.813 5.695 ( -0.314 4.437 -2.960) 5.343 5.762 ( 0.693 -1.936 2.092) 2.934 5.798 ( 1.132 -0.009 -1.568) 1.934 5.897 ( -0.261 2.099 0.383) 2.150 6.054 ( 1.818 0.243 -2.293) 2.937 6.167 ( 0.731 -3.553 0.464) 3.657 6.188 ( 0.738 0.028 0.252) 0.781 ======================= Grid point 283 (123/140) ======================= q-point: (-0.23 -0.46 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.265 ( -6.003 -9.994 0.701) 11.679 1.292 ( -5.254 -10.741 5.177) 13.030 1.485 ( -2.920 -6.668 -0.774) 7.320 1.570 ( 3.275 -8.655 2.488) 9.583 1.711 ( 1.699 -7.277 -1.801) 7.687 1.803 ( 7.531 -5.697 1.417) 9.549 1.814 ( -1.538 -2.505 -3.694) 4.721 1.956 ( 0.894 -7.543 0.109) 7.597 1.994 ( 1.474 -1.443 -5.392) 5.773 2.032 ( 6.809 -2.119 0.334) 7.139 2.120 ( -1.580 -3.418 2.406) 4.469 2.211 ( 1.837 0.665 2.095) 2.865 2.293 ( 1.008 -7.379 -3.438) 8.203 2.532 ( -2.493 -6.725 1.447) 7.317 2.597 ( -0.803 -1.794 2.867) 3.476 2.648 ( -0.924 -0.091 -0.068) 0.931 2.693 ( -2.848 -4.943 -3.849) 6.882 2.722 ( -0.181 -9.727 3.242) 10.254 2.857 ( 0.164 -2.119 -1.153) 2.418 2.911 ( -1.131 -8.093 -0.086) 8.172 2.971 ( 0.901 -3.852 3.858) 5.525 3.038 ( 0.411 -7.268 -2.941) 7.851 3.105 ( 1.932 -1.903 -4.437) 5.200 3.295 ( -1.348 3.027 -1.723) 3.734 3.331 ( 1.307 -0.756 2.585) 2.993 3.410 ( -0.470 0.695 2.084) 2.246 3.567 ( -4.791 -7.935 -1.126) 9.337 3.633 ( -1.081 -3.060 3.044) 4.450 3.791 ( 0.490 -6.293 -2.466) 6.776 3.976 ( 1.690 -0.291 4.032) 4.381 4.018 ( -3.796 0.332 -3.884) 5.441 4.295 ( -2.374 -4.558 0.305) 5.148 4.362 ( -2.725 -4.761 0.189) 5.489 4.449 ( 0.623 -4.490 -0.028) 4.534 4.500 ( -0.621 -0.504 -0.542) 0.966 4.640 ( 2.269 -0.841 0.280) 2.436 4.653 ( -0.348 0.796 -0.142) 0.880 4.727 ( -0.695 -0.860 0.524) 1.224 4.775 ( 1.742 0.431 -3.259) 3.721 4.845 ( 1.913 -4.423 3.092) 5.725 4.908 ( 2.087 2.540 -1.829) 3.762 4.980 ( -2.079 0.687 0.044) 2.190 5.164 ( 1.239 2.065 0.274) 2.424 5.224 ( 1.467 2.334 0.164) 2.762 5.302 ( 1.137 1.694 0.038) 2.041 5.355 ( -0.012 -1.241 -0.496) 1.337 5.377 ( -0.714 2.336 2.323) 3.371 5.411 ( -0.693 3.044 2.135) 3.782 5.490 ( -0.133 1.203 1.536) 1.956 5.587 ( -0.210 2.749 -2.295) 3.587 5.650 ( 0.758 1.613 -1.066) 2.076 5.778 ( 2.408 2.167 -0.443) 3.269 5.800 ( 0.386 -0.946 0.749) 1.267 5.877 ( 0.555 0.287 -0.594) 0.862 6.014 ( 1.681 3.564 -0.883) 4.039 6.194 ( -0.074 -1.730 -0.349) 1.766 6.260 ( 2.000 -2.760 0.763) 3.493 ======================= Grid point 284 (124/140) ======================= q-point: (-0.15 -0.46 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.468 ( -0.951 -10.632 2.578) 10.981 1.506 ( -0.041 -12.789 1.964) 12.939 1.618 ( 1.501 -7.162 0.981) 7.383 1.732 ( 1.527 -6.204 -1.090) 6.482 1.821 ( 3.229 -1.997 -1.579) 4.112 1.858 ( -2.152 -5.240 -1.287) 5.809 1.941 ( 5.816 -4.170 0.656) 7.186 2.004 ( 1.763 -1.018 -0.475) 2.091 2.068 ( 4.357 -0.408 -1.621) 4.666 2.138 ( 3.357 -7.354 -2.077) 8.347 2.165 ( 0.100 -1.485 1.696) 2.256 2.232 ( 0.436 -1.227 1.734) 2.168 2.419 ( 3.487 -5.633 -2.001) 6.920 2.549 ( -2.724 2.743 2.584) 4.650 2.594 ( -2.864 -0.429 0.256) 2.907 2.672 ( 1.003 -1.553 1.926) 2.670 2.746 ( -1.579 -2.866 -0.907) 3.396 2.812 ( -3.016 -0.090 -1.811) 3.519 2.869 ( -0.105 1.424 -0.150) 1.436 3.031 ( -0.932 -3.743 -2.601) 4.652 3.067 ( 1.569 -2.194 4.036) 4.854 3.158 ( 0.254 -2.520 -2.117) 3.301 3.179 ( -0.063 -0.246 0.211) 0.330 3.257 ( -0.788 -7.952 -3.251) 8.627 3.366 ( -0.289 -1.521 1.677) 2.283 3.402 ( 0.983 -1.880 0.219) 2.133 3.609 ( -0.505 -1.325 0.565) 1.526 3.786 ( -3.261 -9.890 1.143) 10.476 3.887 ( -2.061 -6.752 0.074) 7.060 3.977 ( -2.476 0.904 -1.644) 3.106 4.024 ( -2.494 -1.972 0.957) 3.320 4.354 ( -1.461 -2.436 0.977) 3.004 4.412 ( -3.797 -2.964 -1.684) 5.103 4.459 ( -1.123 1.794 -0.019) 2.117 4.522 ( 1.507 -1.717 0.892) 2.453 4.575 ( 0.768 2.323 0.216) 2.457 4.679 ( -1.160 -1.312 -0.348) 1.785 4.775 ( 0.668 -0.415 -4.116) 4.191 4.791 ( 1.113 -2.788 2.511) 3.913 4.819 ( -0.267 2.006 -0.622) 2.117 4.922 ( 1.204 1.452 2.270) 2.951 5.037 ( -0.343 -4.988 -0.454) 5.021 5.136 ( 1.349 0.624 0.115) 1.491 5.225 ( 3.216 0.284 0.177) 3.233 5.287 ( 3.010 0.181 0.069) 3.016 5.345 ( 0.392 -0.457 0.917) 1.097 5.383 ( -0.331 -1.280 1.661) 2.123 5.424 ( -0.433 -2.737 -0.646) 2.845 5.489 ( -0.228 -0.602 -0.013) 0.644 5.554 ( -0.133 0.519 0.403) 0.671 5.618 ( 0.718 2.035 -1.268) 2.503 5.758 ( 2.614 1.061 -0.811) 2.936 5.806 ( 0.573 0.932 1.105) 1.555 5.870 ( 0.951 1.042 -0.948) 1.700 5.957 ( 1.722 3.133 -0.595) 3.624 6.217 ( 0.433 -0.370 0.097) 0.578 6.303 ( 1.057 -0.777 0.334) 1.353 ======================= Grid point 285 (125/140) ======================= q-point: (-0.08 -0.46 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( -0.253 -8.635 0.906) 8.686 1.715 ( -0.036 -5.464 -1.856) 5.771 1.737 ( 3.003 -4.688 1.882) 5.876 1.836 ( 1.891 -5.192 0.352) 5.537 1.859 ( 3.894 -0.319 -1.008) 4.035 1.946 ( -0.198 -4.302 -0.039) 4.307 1.973 ( 2.133 2.488 -0.396) 3.301 2.049 ( 3.221 -1.041 2.441) 4.173 2.108 ( 2.835 -1.672 -1.822) 3.762 2.182 ( -1.261 -1.649 0.121) 2.079 2.243 ( -0.228 -0.578 0.181) 0.647 2.306 ( 2.351 -7.765 -2.470) 8.480 2.493 ( -1.572 2.142 4.611) 5.322 2.532 ( 4.026 -2.828 3.165) 5.850 2.571 ( -2.484 1.036 0.489) 2.736 2.689 ( 0.357 -0.155 -3.029) 3.054 2.769 ( -1.767 2.277 -2.263) 3.664 2.789 ( -0.764 -2.134 2.594) 3.445 2.814 ( 0.967 2.262 -3.933) 4.639 2.997 ( 0.818 5.054 -1.943) 5.476 3.075 ( 1.306 4.622 -0.831) 4.874 3.127 ( -1.515 -2.506 3.633) 4.666 3.212 ( -2.003 -1.745 -0.960) 2.825 3.331 ( -0.762 2.307 0.510) 2.482 3.454 ( -0.220 -9.212 -1.514) 9.338 3.529 ( 0.980 -6.863 -0.421) 6.945 3.630 ( 0.520 -0.516 0.459) 0.864 3.874 ( -1.787 -0.377 1.709) 2.501 3.946 ( -4.796 2.829 -0.301) 5.577 4.010 ( -0.734 -5.851 0.120) 5.898 4.109 ( -2.928 -12.295 -0.559) 12.651 4.374 ( 0.052 -0.400 1.012) 1.089 4.434 ( -0.658 0.318 -0.650) 0.978 4.439 ( -2.754 -1.806 -0.594) 3.347 4.550 ( 0.791 -0.266 1.140) 1.413 4.581 ( 1.136 -1.065 0.340) 1.593 4.703 ( -1.338 -2.549 -0.496) 2.921 4.762 ( 0.459 0.498 -1.894) 2.011 4.791 ( -1.058 0.213 -2.044) 2.312 4.858 ( -0.182 -2.761 1.842) 3.324 4.909 ( 2.418 1.322 2.261) 3.565 5.080 ( -1.174 0.045 -0.319) 1.218 5.153 ( 1.411 -0.796 -0.017) 1.620 5.240 ( 3.448 -0.549 0.019) 3.492 5.322 ( 2.230 -1.001 -0.010) 2.445 5.389 ( -0.104 -3.784 1.334) 4.013 5.422 ( 0.375 -2.449 0.541) 2.536 5.464 ( -0.021 -1.205 -1.131) 1.653 5.499 ( -1.050 -1.104 -0.176) 1.533 5.561 ( -0.021 0.145 1.093) 1.103 5.584 ( 0.681 0.692 -0.917) 1.336 5.759 ( 1.648 0.164 -0.609) 1.765 5.778 ( 0.503 2.261 0.715) 2.424 5.839 ( 1.260 2.464 -0.842) 2.893 5.913 ( 1.335 2.363 -0.619) 2.784 6.214 ( 0.575 0.785 0.282) 1.013 6.307 ( 0.329 0.607 0.168) 0.710 ======================= Grid point 294 (126/140) ======================= q-point: (-0.38 -0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.009 ( -8.069 0.000 0.862) 8.115 1.020 ( -14.241 0.000 6.495) 15.652 1.297 ( -3.774 0.000 -3.222) 4.963 1.322 ( -6.954 0.000 -0.353) 6.962 1.355 ( 6.167 -0.000 4.047) 7.376 1.586 ( -1.638 0.000 -1.956) 2.552 1.614 ( -1.695 0.000 -0.590) 1.795 1.690 ( -10.251 0.000 0.895) 10.290 1.770 ( 0.427 -0.000 2.476) 2.512 1.849 ( 3.863 -0.000 -0.635) 3.915 1.920 ( 1.570 -0.000 -6.863) 7.040 1.961 ( 0.617 -0.000 -0.226) 0.657 2.049 ( -5.055 0.000 1.166) 5.188 2.189 ( 3.519 -0.000 0.956) 3.646 2.453 ( 0.713 -0.000 -0.000) 0.713 2.496 ( -1.200 0.000 1.914) 2.259 2.561 ( -0.186 0.000 -2.366) 2.374 2.703 ( 1.976 -0.000 -0.046) 1.976 2.762 ( -0.018 0.000 -0.041) 0.045 2.770 ( -0.420 0.000 1.371) 1.434 2.836 ( -3.737 0.000 -1.374) 3.981 2.927 ( 4.274 -0.000 0.867) 4.361 3.029 ( 5.014 -0.000 -3.565) 6.153 3.205 ( 0.350 -0.000 0.171) 0.390 3.219 ( 0.382 -0.000 -0.159) 0.414 3.231 ( 0.623 -0.000 2.605) 2.679 3.311 ( 0.004 -0.000 -0.054) 0.054 3.545 ( -1.132 0.000 2.111) 2.395 3.782 ( -1.858 0.000 0.556) 1.940 3.863 ( 0.009 -0.000 0.003) 0.010 4.018 ( 0.151 -0.000 0.148) 0.211 4.029 ( 0.019 -0.000 -0.163) 0.164 4.072 ( -4.776 0.000 -10.426) 11.468 4.208 ( 7.798 -0.000 9.318) 12.151 4.277 ( 0.131 -0.000 0.033) 0.135 4.359 ( 0.856 -0.000 -0.020) 0.856 4.443 ( 3.478 -0.000 1.856) 3.942 4.715 ( 0.914 -0.000 0.069) 0.916 4.848 ( -3.049 0.000 -3.074) 4.329 4.942 ( -0.108 0.000 0.418) 0.432 5.084 ( -2.471 0.000 -4.476) 5.113 5.131 ( 0.486 -0.000 0.031) 0.487 5.250 ( 2.544 -0.000 0.340) 2.567 5.295 ( 0.024 -0.000 -0.780) 0.781 5.370 ( 0.106 -0.000 0.905) 0.911 5.391 ( -0.652 0.000 -0.140) 0.667 5.576 ( -2.688 0.000 6.578) 7.106 5.662 ( -0.232 0.000 -0.050) 0.237 5.668 ( -0.308 0.000 0.049) 0.312 5.694 ( 0.778 -0.000 0.380) 0.866 5.749 ( 2.763 -0.000 3.028) 4.099 5.815 ( -1.733 0.000 -3.845) 4.218 5.834 ( 0.331 -0.000 -0.006) 0.331 5.923 ( -0.337 0.000 0.007) 0.337 5.933 ( 0.692 -0.000 2.078) 2.190 6.073 ( -0.956 0.000 -2.135) 2.339 6.273 ( -0.416 0.000 -1.581) 1.635 ======================= Grid point 295 (127/140) ======================= q-point: (-0.31 -0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.977 ( -12.361 -4.151 7.561) 15.073 1.040 ( -15.573 -4.952 -0.499) 16.349 1.252 ( -6.197 -2.356 -1.191) 6.736 1.362 ( -1.017 -2.751 -6.181) 6.841 1.426 ( -0.633 -5.760 6.387) 8.624 1.563 ( -1.915 -5.215 0.273) 5.562 1.647 ( -0.829 -2.001 4.082) 4.621 1.690 ( -4.407 -4.959 -1.405) 6.781 1.881 ( 0.393 -8.095 2.790) 8.572 1.917 ( 1.299 -0.936 -4.613) 4.883 1.933 ( 1.946 -6.418 -2.672) 7.220 2.040 ( -1.935 -2.691 -0.303) 3.328 2.075 ( 2.157 -8.297 0.038) 8.573 2.214 ( 3.160 -0.722 0.459) 3.274 2.471 ( 1.456 1.668 2.448) 3.301 2.507 ( -0.831 -3.839 -0.912) 4.032 2.556 ( -1.555 -1.258 -1.535) 2.521 2.693 ( 0.639 0.837 0.728) 1.280 2.747 ( 0.722 -0.196 -2.126) 2.254 2.782 ( -2.317 0.059 -2.265) 3.241 2.846 ( -2.662 -3.633 2.074) 4.958 2.949 ( 3.141 0.048 0.279) 3.153 3.056 ( 4.353 -0.652 -3.581) 5.674 3.253 ( 0.924 -1.621 2.532) 3.145 3.256 ( 0.231 -3.605 -0.615) 3.664 3.293 ( -1.802 -4.894 -0.983) 5.307 3.357 ( 1.865 -6.676 1.954) 7.202 3.495 ( -1.678 3.332 1.174) 3.911 3.753 ( -1.706 1.699 0.489) 2.457 4.003 ( 0.051 -1.416 -4.108) 4.345 4.011 ( -0.093 -9.491 -1.511) 9.611 4.065 ( 0.448 -1.992 0.690) 2.155 4.104 ( -0.867 -5.645 -0.702) 5.754 4.223 ( 4.272 -0.762 5.844) 7.279 4.344 ( 0.364 -5.249 -0.939) 5.344 4.445 ( 1.809 -6.127 -0.354) 6.398 4.501 ( 4.214 -3.670 4.194) 6.987 4.705 ( 1.104 1.434 -0.491) 1.876 4.816 ( -2.532 0.911 -3.286) 4.247 4.920 ( 0.118 2.410 0.002) 2.413 5.042 ( -2.942 1.768 -4.569) 5.715 5.103 ( -0.130 2.883 -0.653) 2.959 5.246 ( 2.555 1.826 0.249) 3.150 5.295 ( -0.126 -0.199 -0.835) 0.867 5.355 ( -1.218 2.221 -1.524) 2.956 5.368 ( 0.748 1.394 2.269) 2.765 5.519 ( -2.821 4.483 7.229) 8.962 5.621 ( -0.175 4.619 -0.657) 4.669 5.643 ( -0.739 3.895 1.191) 4.139 5.686 ( 0.216 0.915 -0.162) 0.954 5.743 ( 0.914 0.279 2.714) 2.877 5.771 ( -1.435 3.295 -4.770) 5.972 5.801 ( 0.228 1.187 0.203) 1.226 5.919 ( -0.115 -0.825 2.731) 2.855 6.032 ( 2.767 -2.396 -4.743) 5.991 6.085 ( 0.625 -4.537 3.123) 5.543 6.234 ( -0.662 3.049 -1.532) 3.476 ======================= Grid point 296 (128/140) ======================= q-point: (-0.23 -0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.043 ( -13.442 -7.508 1.622) 15.482 1.069 ( -8.866 -9.771 7.781) 15.318 1.322 ( -6.079 -6.913 -3.633) 9.897 1.446 ( 2.748 -6.987 -0.535) 7.527 1.559 ( -0.230 -7.615 1.347) 7.736 1.722 ( 0.989 -8.335 1.944) 8.616 1.750 ( 1.981 -3.888 -0.183) 4.368 1.773 ( -2.296 -9.293 -0.157) 9.573 1.950 ( 0.791 -2.797 -2.002) 3.529 2.028 ( 1.702 -5.521 2.020) 6.120 2.061 ( 4.415 -1.922 -1.783) 5.135 2.115 ( 0.422 -9.366 -3.174) 9.898 2.208 ( -0.572 -2.256 1.222) 2.629 2.332 ( -1.455 -11.783 0.319) 11.877 2.514 ( 2.636 -5.004 1.395) 5.825 2.554 ( -1.268 -2.627 -0.620) 2.982 2.608 ( -0.571 -4.842 1.602) 5.132 2.665 ( -2.332 0.971 -3.206) 4.082 2.776 ( -3.365 -2.314 -0.865) 4.175 2.816 ( 2.800 -4.675 0.504) 5.472 2.909 ( -0.731 -3.429 3.647) 5.059 2.963 ( 1.095 -0.865 -2.878) 3.198 3.084 ( 2.764 -0.918 -4.602) 5.446 3.299 ( -0.631 -0.764 -1.498) 1.796 3.312 ( 0.483 -3.061 1.529) 3.456 3.386 ( -0.998 -6.671 0.838) 6.797 3.433 ( -1.722 1.682 1.746) 2.973 3.540 ( -0.560 -9.066 0.773) 9.116 3.717 ( -1.283 0.462 -0.831) 1.596 3.990 ( 0.773 -0.115 -3.387) 3.476 4.046 ( 0.138 3.618 3.601) 5.107 4.181 ( -1.764 -5.961 0.637) 6.249 4.237 ( -0.998 -7.933 1.138) 8.076 4.337 ( 0.556 -6.387 0.042) 6.411 4.453 ( 1.723 -4.503 0.508) 4.848 4.574 ( 3.466 -5.294 0.548) 6.351 4.634 ( -0.688 -8.053 0.627) 8.107 4.684 ( 2.306 1.111 -0.604) 2.630 4.786 ( 0.285 0.612 -2.504) 2.593 4.853 ( 0.572 4.041 -0.426) 4.103 4.977 ( -1.808 2.776 -2.971) 4.450 5.028 ( -0.108 4.376 -0.489) 4.405 5.218 ( 2.357 2.381 0.389) 3.373 5.280 ( -1.013 2.929 0.781) 3.197 5.310 ( -0.134 -0.533 -2.436) 2.497 5.351 ( 0.887 1.215 1.193) 1.920 5.437 ( -2.414 3.837 7.051) 8.383 5.510 ( -0.873 6.030 0.288) 6.099 5.546 ( -0.479 4.616 0.556) 4.674 5.644 ( -1.224 3.574 -1.854) 4.208 5.683 ( -0.061 2.085 -1.426) 2.527 5.776 ( 0.600 -1.670 0.803) 1.948 5.816 ( 2.645 -0.283 -0.512) 2.708 5.899 ( 0.336 2.240 0.914) 2.442 6.064 ( 1.255 -0.237 -1.543) 2.003 6.167 ( -0.125 0.343 -1.449) 1.495 6.214 ( 3.193 -3.747 1.744) 5.223 ======================= Grid point 297 (129/140) ======================= q-point: (-0.15 -0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.229 ( -2.019 -14.709 2.995) 15.147 1.256 ( -5.470 -11.912 6.471) 14.618 1.450 ( -1.914 -9.897 -2.356) 10.352 1.604 ( 1.071 -7.748 -2.635) 8.254 1.714 ( 0.589 -8.089 0.716) 8.142 1.787 ( -0.684 -2.010 -1.579) 2.646 1.882 ( 5.397 -5.749 1.474) 8.021 1.970 ( 0.631 -8.434 1.737) 8.634 2.005 ( 3.275 -3.095 -2.949) 5.385 2.105 ( 4.265 -0.833 -0.618) 4.389 2.129 ( 3.988 -3.086 1.276) 5.202 2.229 ( 0.679 -0.839 0.690) 1.281 2.296 ( 1.845 -8.022 -2.688) 8.659 2.499 ( -4.512 -6.414 1.702) 8.025 2.593 ( -1.802 0.387 1.514) 2.385 2.636 ( -0.199 -2.056 -0.271) 2.083 2.641 ( -3.318 -6.768 -3.260) 8.212 2.757 ( 1.581 -6.209 5.706) 8.580 2.830 ( -2.812 -6.755 -4.219) 8.447 2.899 ( -1.224 -2.435 1.213) 2.983 2.996 ( 1.477 -5.234 2.253) 5.886 3.030 ( 0.123 -7.541 -3.128) 8.165 3.106 ( 1.699 -1.550 -5.096) 5.591 3.271 ( -1.852 2.137 -1.639) 3.269 3.353 ( 0.841 0.220 2.102) 2.275 3.409 ( -0.304 -0.008 -0.025) 0.305 3.530 ( -1.226 -7.282 -0.097) 7.385 3.640 ( -0.360 -2.860 4.296) 5.174 3.767 ( -2.614 -6.391 -3.747) 7.856 3.965 ( -3.457 1.668 -1.689) 4.194 4.008 ( 0.541 0.676 4.666) 4.746 4.270 ( -2.381 -4.738 0.905) 5.379 4.335 ( -1.795 -3.431 -0.699) 3.935 4.446 ( -1.082 -4.871 -0.437) 5.009 4.491 ( -1.084 0.150 1.152) 1.589 4.655 ( 0.503 2.453 0.075) 2.506 4.659 ( 1.415 -0.026 -0.694) 1.576 4.718 ( -0.738 -2.599 -0.612) 2.770 4.789 ( 2.033 -0.526 -1.654) 2.674 4.868 ( 0.805 -0.318 1.673) 1.884 4.924 ( 2.276 -1.945 -3.032) 4.261 4.963 ( -0.858 1.643 0.468) 1.912 5.182 ( 1.771 2.605 0.133) 3.153 5.242 ( 1.571 0.636 0.397) 1.740 5.314 ( 1.062 0.676 -0.325) 1.300 5.353 ( -0.058 -1.169 -0.191) 1.186 5.380 ( -0.507 1.853 3.098) 3.645 5.412 ( -0.382 3.157 1.480) 3.507 5.493 ( -0.001 1.146 0.566) 1.278 5.576 ( -0.539 2.162 -1.204) 2.533 5.654 ( 0.741 1.550 -1.173) 2.080 5.794 ( 1.146 0.547 -1.433) 1.915 5.825 ( 2.777 0.742 2.512) 3.818 5.880 ( 0.511 0.123 -0.748) 0.914 6.029 ( 1.668 3.361 -1.034) 3.892 6.191 ( -0.224 -2.257 -0.491) 2.320 6.290 ( 2.805 -1.776 0.832) 3.422 ======================= Grid point 298 (130/140) ======================= q-point: (-0.08 -0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.459 ( -2.392 -11.017 3.120) 11.697 1.527 ( 2.262 -13.981 1.305) 14.223 1.641 ( 1.521 -8.685 1.511) 8.946 1.729 ( -0.289 -6.466 -4.678) 7.986 1.831 ( 0.737 -2.945 0.735) 3.123 1.858 ( 0.941 -5.876 1.417) 6.117 2.005 ( 5.271 -3.153 0.371) 6.153 2.028 ( 2.237 -0.945 -0.096) 2.430 2.112 ( 3.296 -0.781 -0.756) 3.470 2.168 ( 3.049 -4.555 -0.478) 5.502 2.191 ( 5.082 -2.080 -0.391) 5.505 2.236 ( 0.585 0.216 -0.470) 0.781 2.451 ( 3.113 -7.274 -0.922) 7.965 2.540 ( -1.429 2.639 4.032) 5.026 2.556 ( -4.291 -1.994 1.116) 4.861 2.681 ( 0.138 -1.066 -2.717) 2.923 2.727 ( -1.615 -3.605 2.116) 4.481 2.776 ( -1.590 0.291 -3.483) 3.840 2.863 ( -1.075 2.823 0.766) 3.117 3.011 ( -1.430 -6.181 -0.900) 6.408 3.090 ( 0.421 -0.559 1.391) 1.557 3.146 ( -0.499 -3.168 -3.377) 4.657 3.183 ( 0.352 -2.312 0.898) 2.506 3.235 ( -0.787 -5.383 -2.831) 6.133 3.365 ( -0.388 -0.958 0.062) 1.035 3.410 ( 0.511 -2.721 -0.618) 2.837 3.606 ( -0.406 -2.126 0.781) 2.301 3.766 ( -1.598 -8.959 2.462) 9.427 3.873 ( -1.233 -7.254 0.861) 7.409 3.940 ( -2.695 -0.861 -1.192) 3.070 3.987 ( -4.961 1.191 1.135) 5.227 4.342 ( -1.427 -3.312 1.372) 3.858 4.374 ( -2.002 -2.742 -0.994) 3.537 4.444 ( -1.810 1.432 -0.288) 2.326 4.533 ( 0.002 -2.521 0.950) 2.694 4.588 ( 1.227 2.157 0.286) 2.498 4.672 ( 0.250 -0.450 -0.625) 0.810 4.764 ( 0.063 -1.237 -3.608) 3.815 4.797 ( -0.869 0.442 0.324) 1.028 4.820 ( 0.138 1.022 1.054) 1.475 4.947 ( 1.800 0.507 1.662) 2.502 5.032 ( 0.097 -4.552 -1.222) 4.714 5.156 ( 2.033 0.911 0.236) 2.240 5.260 ( 2.800 -0.403 0.214) 2.837 5.315 ( 1.890 -0.435 0.410) 1.982 5.356 ( 1.088 -0.227 0.529) 1.231 5.388 ( -0.097 -1.261 2.174) 2.515 5.416 ( -0.373 -2.675 -0.887) 2.843 5.485 ( -0.111 0.013 -0.827) 0.835 5.554 ( -0.404 -0.067 1.046) 1.123 5.621 ( 0.726 2.118 -1.334) 2.606 5.783 ( 2.281 1.069 -0.976) 2.701 5.822 ( 1.374 1.506 2.104) 2.929 5.876 ( 0.887 0.842 -1.118) 1.657 5.973 ( 1.754 3.181 -0.991) 3.765 6.221 ( 0.279 -0.716 0.050) 0.770 6.318 ( 1.388 0.034 0.353) 1.433 ======================= Grid point 308 (131/140) ======================= q-point: (-0.31 -0.31 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.882 ( -15.230 0.000 6.915) 16.726 0.897 ( -13.274 0.000 2.060) 13.432 1.216 ( -6.902 0.000 -6.428) 9.432 1.230 ( -8.693 0.000 -2.170) 8.960 1.405 ( -6.560 0.000 2.620) 7.064 1.525 ( -11.822 0.000 5.604) 13.083 1.562 ( -1.704 0.000 -0.803) 1.884 1.627 ( -0.958 0.000 5.651) 5.731 1.794 ( 1.811 -0.000 3.368) 3.824 1.878 ( 2.184 -0.000 -2.252) 3.137 1.907 ( 1.277 -0.000 -5.920) 6.057 1.972 ( 1.655 -0.000 0.163) 1.663 2.047 ( 3.298 -0.000 -1.312) 3.550 2.239 ( 4.083 -0.000 0.798) 4.160 2.462 ( 0.858 -0.000 -0.000) 0.858 2.498 ( 0.683 -0.000 3.290) 3.360 2.552 ( 0.297 -0.000 -2.490) 2.508 2.716 ( -0.101 0.000 -1.773) 1.776 2.731 ( -3.572 0.000 -4.772) 5.961 2.761 ( -0.211 0.000 -0.046) 0.216 2.795 ( -2.402 0.000 -1.985) 3.116 2.978 ( 3.094 -0.000 1.951) 3.658 3.081 ( 6.105 -0.000 -1.117) 6.207 3.211 ( 0.632 -0.000 0.306) 0.702 3.223 ( 0.503 -0.000 -0.284) 0.578 3.249 ( 0.988 -0.000 1.052) 1.444 3.318 ( 1.038 -0.000 1.792) 2.071 3.533 ( -2.014 0.000 0.638) 2.112 3.760 ( -2.695 0.000 1.289) 2.987 3.863 ( -0.009 0.000 0.005) 0.010 4.020 ( 0.206 -0.000 0.079) 0.220 4.022 ( 1.362 -0.000 -4.968) 5.152 4.028 ( 0.043 -0.000 -0.103) 0.112 4.280 ( 0.457 -0.000 0.039) 0.458 4.297 ( 3.100 -0.000 5.534) 6.343 4.369 ( 0.933 -0.000 -0.021) 0.933 4.504 ( 4.472 -0.000 4.029) 6.019 4.725 ( 1.332 -0.000 -0.911) 1.614 4.804 ( -2.197 0.000 -2.401) 3.254 4.942 ( -0.207 0.000 -1.178) 1.196 5.030 ( -3.469 0.000 -5.566) 6.559 5.127 ( -1.051 0.000 -0.419) 1.131 5.272 ( 1.705 -0.000 -1.769) 2.457 5.295 ( 0.213 -0.000 0.095) 0.234 5.364 ( -1.265 0.000 -1.774) 2.179 5.394 ( 0.731 -0.000 2.360) 2.470 5.571 ( -2.661 0.000 6.213) 6.759 5.659 ( -0.341 0.000 -0.056) 0.345 5.664 ( -0.426 0.000 0.055) 0.429 5.705 ( 0.489 -0.000 1.022) 1.133 5.775 ( -3.174 0.000 -2.594) 4.099 5.795 ( 3.749 -0.000 1.473) 4.028 5.838 ( 0.512 -0.000 -0.006) 0.512 5.918 ( -0.521 0.000 0.007) 0.521 5.962 ( 3.229 -0.000 1.819) 3.706 6.058 ( -1.226 0.000 1.431) 1.885 6.258 ( -0.971 0.000 -2.164) 2.372 ======================= Grid point 309 (132/140) ======================= q-point: (-0.23 -0.31 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.853 ( -17.285 -3.698 1.626) 17.751 0.875 ( -13.252 -5.773 10.943) 18.130 1.163 ( -7.675 -4.097 -4.697) 9.887 1.295 ( -4.952 -7.268 -8.419) 12.175 1.422 ( -8.521 -9.341 4.989) 13.593 1.528 ( -4.434 -4.750 4.090) 7.678 1.611 ( -5.953 -5.569 2.421) 8.503 1.694 ( 3.667 -4.224 4.729) 7.325 1.889 ( 0.281 -5.611 1.743) 5.883 1.918 ( 2.327 -3.792 -2.462) 5.085 1.951 ( 1.765 -6.078 -2.472) 6.795 2.034 ( 1.358 -3.217 -1.034) 3.641 2.103 ( 2.795 -5.784 -1.730) 6.653 2.243 ( 1.949 0.805 -0.463) 2.159 2.491 ( -0.121 -1.396 0.856) 1.642 2.521 ( 2.831 0.439 -1.024) 3.043 2.540 ( 0.658 -2.154 1.747) 2.851 2.668 ( -3.421 1.587 -4.716) 6.039 2.730 ( -2.336 -1.264 -3.846) 4.674 2.769 ( 1.434 -0.826 0.854) 1.862 2.835 ( -0.790 -4.742 1.612) 5.070 2.980 ( 2.219 1.167 0.388) 2.537 3.091 ( 4.046 0.987 -2.527) 4.871 3.246 ( -1.370 -1.944 -0.308) 2.398 3.271 ( -0.392 -4.955 0.413) 4.988 3.290 ( 2.882 -1.811 -0.289) 3.416 3.376 ( 0.368 -6.209 1.159) 6.326 3.476 ( -2.426 3.105 0.788) 4.019 3.731 ( -2.665 1.381 0.612) 3.063 4.001 ( 2.479 0.154 -2.022) 3.202 4.023 ( 1.610 -10.588 0.711) 10.733 4.063 ( -0.444 -2.627 -0.251) 2.676 4.109 ( 1.142 -5.193 0.940) 5.399 4.277 ( 1.654 0.419 3.649) 4.029 4.356 ( 2.622 -6.550 0.462) 7.070 4.459 ( 0.522 -6.737 -0.483) 6.775 4.548 ( 1.822 -1.910 2.255) 3.472 4.719 ( 2.134 1.145 -1.769) 2.999 4.791 ( -0.119 0.234 -0.883) 0.921 4.912 ( -1.290 2.281 -2.911) 3.917 4.993 ( -2.358 1.055 -3.451) 4.310 5.093 ( -1.065 2.577 -0.749) 2.888 5.268 ( 1.666 1.265 -1.192) 2.407 5.291 ( -0.131 0.045 -0.699) 0.713 5.332 ( -1.735 2.130 -1.643) 3.201 5.387 ( 1.048 1.472 2.261) 2.894 5.517 ( -2.507 4.298 7.060) 8.637 5.616 ( -0.372 4.829 -0.331) 4.855 5.635 ( -1.599 4.064 0.626) 4.412 5.686 ( -0.618 1.768 0.369) 1.908 5.723 ( -2.794 2.778 -1.798) 4.331 5.766 ( 0.628 1.061 1.181) 1.707 5.816 ( 2.406 0.230 -1.640) 2.921 5.933 ( 0.731 -0.888 3.148) 3.351 6.033 ( 0.596 -1.083 -3.392) 3.610 6.129 ( 4.529 -6.495 4.187) 8.957 6.218 ( -0.961 2.643 -1.761) 3.318 ======================= Grid point 310 (133/140) ======================= q-point: (-0.15 -0.31 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.936 ( -8.006 -13.254 5.081) 16.297 1.009 ( -8.399 -11.489 10.615) 17.754 1.239 ( -5.231 -8.829 -6.221) 12.001 1.432 ( -1.958 -9.228 -7.861) 12.280 1.580 ( 1.581 -7.152 3.949) 8.321 1.694 ( -5.404 -12.581 -0.231) 13.695 1.727 ( -3.779 -8.542 1.044) 9.398 1.811 ( 3.169 -6.362 6.708) 9.773 1.959 ( 2.095 -3.300 -0.317) 3.921 2.062 ( 2.921 -5.580 2.475) 6.767 2.090 ( 1.866 -4.541 -2.783) 5.644 2.113 ( 1.261 -8.288 -3.093) 8.936 2.208 ( 0.516 -2.735 -0.328) 2.802 2.319 ( -0.921 -9.143 -0.007) 9.189 2.512 ( -1.365 -2.898 -2.517) 4.074 2.544 ( 0.024 -2.745 -1.114) 2.963 2.622 ( -2.365 0.269 -4.561) 5.145 2.637 ( 1.177 -5.227 5.803) 7.898 2.743 ( -1.592 -2.289 -0.342) 2.809 2.838 ( 0.784 -4.545 0.079) 4.612 2.923 ( 1.272 -4.086 2.591) 5.002 2.966 ( 1.257 0.865 -2.172) 2.654 3.094 ( 2.280 -0.108 -4.620) 5.153 3.266 ( -3.294 -0.936 -0.919) 3.546 3.338 ( 2.170 -2.595 0.332) 3.399 3.391 ( 0.392 -5.738 -1.736) 6.008 3.416 ( -0.775 0.362 1.970) 2.148 3.535 ( -1.200 -8.849 0.570) 8.948 3.690 ( -2.671 1.153 -0.453) 2.944 3.992 ( 1.053 1.600 -1.064) 2.191 4.061 ( -0.352 2.667 3.609) 4.501 4.175 ( -0.154 -4.406 2.271) 4.960 4.236 ( -0.292 -7.455 1.344) 7.581 4.329 ( -1.306 -4.778 -1.254) 5.109 4.475 ( 0.207 -2.432 2.204) 3.289 4.610 ( 1.956 -3.646 -0.387) 4.156 4.625 ( 1.627 -8.231 -0.734) 8.422 4.701 ( 1.425 1.260 -2.216) 2.920 4.791 ( 0.836 0.066 -1.197) 1.462 4.851 ( -0.036 1.581 -1.957) 2.516 4.955 ( -0.396 1.750 -1.147) 2.129 5.024 ( 0.105 3.981 -1.199) 4.159 5.240 ( 1.577 2.318 -0.509) 2.849 5.271 ( -1.053 2.146 0.782) 2.515 5.302 ( 0.387 -1.131 -2.332) 2.621 5.366 ( 0.823 1.560 1.564) 2.357 5.438 ( -2.217 3.769 6.743) 8.037 5.498 ( -1.598 5.704 0.651) 5.960 5.541 ( -0.344 3.885 -0.244) 3.908 5.623 ( -1.321 3.248 -1.247) 3.722 5.681 ( 0.246 1.227 -0.940) 1.565 5.783 ( 0.454 -1.187 -0.109) 1.275 5.840 ( 1.822 -1.229 -0.962) 2.399 5.917 ( 1.952 2.858 2.486) 4.261 6.070 ( 0.715 -1.128 -0.978) 1.655 6.157 ( -0.463 0.817 -1.960) 2.174 6.266 ( 4.638 -3.354 2.010) 6.066 ======================= Grid point 311 (134/140) ======================= q-point: (-0.08 -0.31 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( -5.257 -12.814 6.937) 15.490 1.238 ( 0.934 -17.152 3.781) 17.589 1.430 ( -0.046 -13.000 -2.240) 13.192 1.567 ( -2.546 -8.164 -8.029) 11.730 1.734 ( 1.176 -7.482 0.518) 7.592 1.794 ( 1.589 -2.570 3.089) 4.321 1.920 ( 0.611 -8.501 0.947) 8.575 1.991 ( 1.857 -6.908 3.779) 8.090 2.042 ( 4.711 -4.515 -1.333) 6.660 2.137 ( 3.112 -1.330 0.657) 3.448 2.179 ( 2.083 -3.878 -0.317) 4.414 2.245 ( 3.456 -2.389 -2.364) 4.821 2.309 ( 1.286 -8.038 -0.074) 8.141 2.449 ( -5.326 -5.904 0.967) 8.010 2.576 ( -2.295 0.923 0.795) 2.598 2.595 ( -1.496 -6.102 -4.187) 7.550 2.647 ( 0.664 -5.495 2.073) 5.910 2.769 ( -1.772 -1.776 -3.561) 4.357 2.791 ( -2.289 -8.998 4.077) 10.141 2.893 ( -0.827 0.179 2.183) 2.341 3.005 ( -0.450 -7.197 -4.412) 8.454 3.034 ( 2.542 -5.538 1.365) 6.245 3.105 ( 1.828 -1.256 -5.438) 5.873 3.243 ( -2.172 0.815 -1.070) 2.555 3.358 ( -1.269 1.119 1.402) 2.198 3.406 ( 0.760 -0.871 -2.137) 2.429 3.539 ( 1.992 -5.609 1.183) 6.069 3.653 ( -0.302 -2.482 3.706) 4.471 3.710 ( -4.588 -8.012 -4.650) 10.337 3.938 ( -1.417 2.604 1.621) 3.378 4.015 ( -2.157 2.663 3.743) 5.075 4.260 ( -0.417 -4.364 2.150) 4.883 4.315 ( -1.264 -2.632 -1.100) 3.120 4.426 ( -1.870 -4.121 -0.751) 4.588 4.485 ( -1.334 -0.654 2.592) 2.987 4.659 ( -0.193 3.595 0.311) 3.614 4.667 ( 0.893 -0.555 -1.360) 1.719 4.711 ( 0.268 -3.209 -0.950) 3.358 4.794 ( -0.170 -0.157 -1.742) 1.757 4.883 ( 1.299 1.765 0.737) 2.312 4.930 ( 1.114 -3.051 -2.956) 4.392 4.967 ( 1.185 0.759 -0.235) 1.427 5.201 ( 1.669 2.146 -0.259) 2.731 5.261 ( 1.339 -0.370 0.800) 1.603 5.321 ( 0.746 -0.202 -0.911) 1.194 5.353 ( -0.003 -0.489 0.426) 0.648 5.390 ( -0.093 1.241 3.628) 3.836 5.413 ( -0.358 2.614 1.030) 2.832 5.495 ( 0.352 1.226 -0.364) 1.327 5.567 ( -0.755 1.701 -0.217) 1.874 5.657 ( 0.679 1.495 -1.183) 2.024 5.800 ( 0.774 -0.267 -0.634) 1.036 5.864 ( 2.254 0.283 0.500) 2.326 5.886 ( 1.372 1.318 0.934) 2.119 6.042 ( 1.491 3.123 -1.214) 3.667 6.186 ( -0.323 -2.742 -0.537) 2.813 6.325 ( 2.898 -0.668 0.837) 3.090 ======================= Grid point 322 (135/140) ======================= q-point: (-0.23 -0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.741 ( -17.121 0.000 4.527) 17.710 0.742 ( -15.611 0.000 8.279) 17.671 1.100 ( -10.743 0.000 -3.374) 11.260 1.120 ( -8.717 0.000 -5.259) 10.180 1.204 ( -24.402 0.000 3.768) 24.691 1.496 ( -2.317 0.000 5.192) 5.686 1.545 ( -1.379 0.000 1.587) 2.103 1.672 ( 3.613 -0.000 5.080) 6.233 1.832 ( 2.648 -0.000 3.396) 4.306 1.878 ( 0.131 -0.000 -3.680) 3.682 1.909 ( 2.247 -0.000 -2.990) 3.740 1.997 ( 2.352 -0.000 0.420) 2.389 2.077 ( 3.000 -0.000 -3.333) 4.485 2.270 ( 1.885 -0.000 -1.238) 2.255 2.471 ( 0.743 -0.000 -0.002) 0.743 2.535 ( 1.396 -0.000 -0.681) 1.553 2.560 ( 3.741 -0.000 2.859) 4.708 2.648 ( -3.933 0.000 -7.795) 8.731 2.711 ( -0.987 0.000 -2.678) 2.854 2.757 ( -0.445 0.000 -0.049) 0.448 2.779 ( -0.052 0.000 1.210) 1.211 3.007 ( 1.821 -0.000 -0.120) 1.825 3.147 ( 6.133 -0.000 -0.667) 6.169 3.220 ( 0.669 -0.000 0.276) 0.724 3.228 ( 0.647 -0.000 -0.249) 0.693 3.252 ( -0.585 0.000 -0.656) 0.879 3.350 ( 2.961 -0.000 3.564) 4.634 3.503 ( -3.255 0.000 -1.490) 3.580 3.737 ( -2.497 0.000 2.558) 3.574 3.863 ( -0.036 0.000 0.002) 0.036 4.022 ( 0.207 -0.000 0.009) 0.207 4.029 ( 0.076 -0.000 -0.037) 0.084 4.061 ( 6.459 -0.000 0.905) 6.522 4.287 ( 0.762 -0.000 0.045) 0.763 4.318 ( -2.144 0.000 2.661) 3.417 4.378 ( 0.706 -0.000 -0.023) 0.707 4.548 ( 1.869 -0.000 1.392) 2.330 4.736 ( 1.685 -0.000 -3.544) 3.924 4.793 ( 0.145 -0.000 0.939) 0.950 4.912 ( -3.211 0.000 -4.654) 5.654 4.989 ( -0.543 0.000 -1.363) 1.467 5.108 ( -1.912 0.000 -0.779) 2.065 5.276 ( 0.987 -0.000 -2.843) 3.009 5.296 ( -0.361 0.000 0.073) 0.368 5.339 ( -1.624 0.000 -2.056) 2.620 5.412 ( 0.692 -0.000 1.970) 2.088 5.566 ( -2.174 0.000 5.483) 5.898 5.655 ( -0.368 0.000 -0.059) 0.372 5.659 ( -0.452 0.000 0.057) 0.456 5.707 ( -1.442 0.000 0.669) 1.589 5.732 ( -2.039 0.000 -2.472) 3.205 5.837 ( 3.084 -0.000 -0.034) 3.084 5.845 ( 0.635 -0.000 -0.005) 0.635 5.912 ( -0.644 0.000 0.006) 0.644 6.009 ( 4.148 -0.000 -2.199) 4.695 6.075 ( 1.894 -0.000 11.194) 11.353 6.237 ( -1.121 0.000 -2.337) 2.592 ======================= Grid point 323 (136/140) ======================= q-point: (-0.15 -0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.686 ( -15.117 -6.803 7.360) 18.138 0.784 ( -12.003 -8.599 13.390) 19.933 1.055 ( -7.239 -4.744 -8.252) 11.959 1.198 ( -6.662 -10.664 -8.576) 15.220 1.276 ( -18.935 -18.095 6.917) 27.089 1.515 ( -1.497 -2.764 2.900) 4.277 1.574 ( -2.970 -3.999 2.618) 5.628 1.763 ( 4.369 -4.654 4.949) 8.077 1.908 ( 1.453 -2.538 -0.172) 2.930 1.929 ( 0.849 -7.826 -1.014) 7.937 1.959 ( 1.795 -5.594 -0.818) 5.931 2.055 ( 2.869 -2.553 -1.136) 4.005 2.115 ( 0.948 -4.993 -2.558) 5.690 2.256 ( 1.517 1.277 -1.690) 2.605 2.488 ( -0.724 -0.216 -0.269) 0.802 2.514 ( 0.150 0.173 -3.311) 3.319 2.592 ( 1.553 -1.427 3.479) 4.068 2.609 ( -2.189 0.700 -6.885) 7.258 2.704 ( 0.470 -0.689 1.785) 1.970 2.791 ( 1.373 -1.322 1.027) 2.165 2.838 ( 0.287 -6.062 0.981) 6.148 3.001 ( 1.905 1.419 -0.897) 2.539 3.122 ( 3.161 2.898 -2.153) 4.798 3.224 ( -2.302 -0.769 -0.341) 2.451 3.272 ( 0.348 -4.361 -0.719) 4.434 3.323 ( 3.226 -3.961 -0.894) 5.186 3.377 ( -0.223 -2.727 0.488) 2.780 3.448 ( -3.132 1.348 0.336) 3.427 3.707 ( -2.129 1.540 1.613) 3.083 4.019 ( 0.791 -5.685 0.628) 5.774 4.052 ( 0.827 -2.169 -0.244) 2.334 4.072 ( 4.165 -3.529 2.292) 5.921 4.128 ( 1.577 -4.342 0.578) 4.656 4.278 ( -2.545 0.439 0.010) 2.583 4.402 ( 3.162 -6.762 1.507) 7.615 4.455 ( 1.380 -8.417 -1.164) 8.609 4.575 ( 3.102 -1.748 0.249) 3.569 4.724 ( 0.912 0.980 -5.467) 5.628 4.791 ( -1.639 0.105 0.185) 1.652 4.872 ( -2.678 1.475 -2.141) 3.732 4.980 ( 0.923 1.027 -0.037) 1.381 5.078 ( -1.013 1.894 -0.857) 2.313 5.275 ( 0.966 0.708 -2.011) 2.341 5.286 ( -0.187 0.011 -0.822) 0.843 5.307 ( -1.717 1.963 -1.499) 3.008 5.403 ( 0.434 1.395 1.623) 2.184 5.519 ( -1.705 4.237 6.477) 7.925 5.603 ( -3.719 5.639 1.415) 6.902 5.615 ( -0.495 3.909 -1.188) 4.116 5.672 ( -1.722 2.604 0.365) 3.143 5.702 ( -0.523 1.405 -0.509) 1.584 5.774 ( 0.332 0.994 0.472) 1.149 5.832 ( 1.513 0.570 -1.962) 2.543 5.959 ( 1.734 -2.394 2.657) 3.974 6.027 ( 0.083 -0.320 -1.146) 1.193 6.192 ( 1.079 1.218 -1.562) 2.256 6.220 ( 5.419 -4.385 4.778) 8.451 ======================= Grid point 324 (137/140) ======================= q-point: (-0.08 -0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.905 ( -2.442 -17.541 7.398) 19.194 0.964 ( -7.757 -12.674 11.729) 18.931 1.171 ( -2.079 -11.969 -7.001) 14.021 1.366 ( -3.088 -9.987 -10.386) 14.736 1.604 ( -0.309 -6.409 0.728) 6.457 1.619 ( -7.598 -21.944 3.821) 23.534 1.694 ( -3.472 -9.667 2.422) 10.553 1.869 ( 2.107 -4.453 8.128) 9.505 1.991 ( 3.237 -4.151 0.664) 5.306 2.085 ( 0.032 -6.315 -2.871) 6.937 2.108 ( 3.342 -6.327 0.933) 7.216 2.120 ( 2.014 -5.188 -1.417) 5.743 2.212 ( 0.881 -3.971 -2.632) 4.845 2.308 ( -1.114 -7.155 -0.389) 7.251 2.484 ( -1.380 -2.293 -3.658) 4.532 2.545 ( 0.739 -2.832 -1.059) 3.112 2.581 ( -1.935 -0.393 -3.891) 4.363 2.647 ( -1.816 -4.172 2.410) 5.149 2.750 ( 1.258 -2.187 3.925) 4.666 2.837 ( -0.526 -3.346 -0.536) 3.429 2.951 ( 1.587 -2.463 1.730) 3.402 2.979 ( 2.776 -0.506 -1.171) 3.055 3.099 ( 2.125 0.439 -5.114) 5.555 3.225 ( -3.733 -0.850 -0.272) 3.838 3.344 ( -2.265 -2.242 -1.420) 3.489 3.374 ( 1.522 -1.501 -2.764) 3.494 3.451 ( 3.563 -4.905 2.995) 6.762 3.514 ( -2.153 -8.278 -1.574) 8.697 3.665 ( -2.105 1.910 1.467) 3.199 4.001 ( 0.686 3.632 0.567) 3.740 4.062 ( -1.348 1.711 2.388) 3.232 4.192 ( 0.523 -3.137 3.552) 4.768 4.237 ( -0.346 -6.324 0.927) 6.401 4.309 ( -0.712 -5.228 -0.896) 5.352 4.463 ( -3.087 -1.673 1.429) 3.791 4.631 ( 3.232 -4.128 -0.868) 5.314 4.660 ( 3.062 -3.066 0.646) 4.381 4.703 ( 1.005 0.612 -3.296) 3.500 4.775 ( -1.783 -0.782 -4.128) 4.564 4.845 ( 0.095 -0.945 -0.708) 1.185 4.961 ( 1.262 1.504 0.464) 2.018 5.022 ( 0.576 3.783 -1.796) 4.227 5.246 ( 0.166 2.149 -1.402) 2.571 5.268 ( -0.159 0.561 1.093) 1.239 5.300 ( 0.713 -1.215 -2.077) 2.510 5.379 ( 0.570 1.677 1.463) 2.297 5.439 ( -2.047 3.584 6.172) 7.424 5.480 ( -2.398 4.798 1.440) 5.554 5.538 ( 0.329 3.183 -1.022) 3.360 5.608 ( -0.966 3.004 -0.229) 3.164 5.680 ( 0.210 0.900 -0.752) 1.191 5.787 ( 0.416 -1.063 -0.345) 1.193 5.846 ( 0.462 -1.375 -1.647) 2.195 5.957 ( 2.807 2.993 3.232) 5.223 6.074 ( 0.754 -2.196 -0.662) 2.414 6.144 ( -0.584 0.924 -1.960) 2.244 6.325 ( 4.563 -1.771 1.920) 5.258 ======================= Grid point 336 (138/140) ======================= q-point: (-0.15 -0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.570 ( -17.978 0.000 8.952) 20.084 0.603 ( -16.438 0.000 10.745) 19.639 0.948 ( -23.604 0.000 21.302) 31.795 0.987 ( -10.201 0.000 -11.084) 15.064 1.003 ( -7.633 0.000 -8.960) 11.770 1.496 ( -0.567 0.000 3.055) 3.108 1.546 ( -0.506 0.000 4.269) 4.298 1.696 ( -0.456 0.000 -5.892) 5.909 1.847 ( -0.877 0.000 -4.658) 4.740 1.885 ( 2.700 -0.000 3.210) 4.194 1.941 ( 4.241 -0.000 2.398) 4.872 2.021 ( 1.733 -0.000 -0.050) 1.734 2.089 ( 1.629 -0.000 -1.927) 2.524 2.286 ( 2.839 -0.000 -2.558) 3.821 2.478 ( 0.513 -0.000 -0.001) 0.513 2.523 ( -1.559 0.000 -2.513) 2.957 2.578 ( -2.305 0.000 1.045) 2.531 2.606 ( -0.007 0.000 -9.540) 9.540 2.733 ( 4.272 -0.000 7.143) 8.323 2.751 ( -0.529 0.000 -0.042) 0.531 2.793 ( 2.111 -0.000 0.273) 2.128 3.025 ( 2.447 -0.000 -1.702) 2.981 3.194 ( 2.540 -0.000 -2.976) 3.913 3.226 ( 0.344 -0.000 -0.196) 0.396 3.237 ( 0.815 -0.000 0.219) 0.843 3.243 ( 0.436 -0.000 -0.508) 0.669 3.406 ( 4.135 -0.000 3.683) 5.538 3.451 ( -4.101 0.000 -4.309) 5.949 3.729 ( -1.416 0.000 3.680) 3.944 3.862 ( -0.050 0.000 -0.005) 0.051 4.024 ( 0.150 -0.000 -0.012) 0.151 4.030 ( 0.102 -0.000 -0.014) 0.103 4.150 ( 7.405 -0.000 3.260) 8.091 4.271 ( -7.155 0.000 0.229) 7.159 4.296 ( 0.836 -0.000 0.050) 0.837 4.384 ( 0.371 -0.000 -0.027) 0.372 4.576 ( 3.513 -0.000 0.084) 3.514 4.721 ( -0.834 0.000 -7.560) 7.606 4.777 ( -3.806 0.000 1.219) 3.997 4.873 ( -2.078 0.000 1.306) 2.454 4.999 ( 1.593 -0.000 0.258) 1.614 5.086 ( -1.029 0.000 -0.015) 1.029 5.278 ( 1.340 -0.000 -2.862) 3.161 5.288 ( -0.924 0.000 -0.256) 0.959 5.314 ( -1.632 0.000 -2.165) 2.711 5.420 ( -0.357 0.000 1.032) 1.092 5.564 ( -1.796 0.000 3.618) 4.039 5.651 ( -0.307 0.000 -0.057) 0.312 5.655 ( -0.378 0.000 0.056) 0.382 5.675 ( -3.032 0.000 -0.685) 3.109 5.719 ( -0.116 0.000 -1.447) 1.451 5.852 ( 0.658 -0.000 -0.005) 0.658 5.857 ( 1.153 -0.000 -1.871) 2.198 5.904 ( -0.666 0.000 0.006) 0.666 6.031 ( 1.830 -0.000 -0.853) 2.019 6.194 ( 9.561 -0.000 12.831) 16.001 6.221 ( 0.175 -0.000 -0.480) 0.511 ======================= Grid point 337 (139/140) ======================= q-point: (-0.08 -0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 254 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.598 ( -7.413 -12.909 12.433) 19.395 0.711 ( -11.347 -11.535 14.686) 21.852 0.955 ( -3.718 -6.545 -11.069) 13.386 1.084 ( -11.485 -18.569 1.645) 21.896 1.116 ( -11.914 -16.084 2.808) 20.212 1.513 ( -0.203 -2.251 1.813) 2.897 1.553 ( -2.871 -2.773 1.070) 4.132 1.803 ( 1.756 -8.701 -2.776) 9.300 1.888 ( -1.680 -5.665 -4.757) 7.585 1.960 ( 2.733 -3.400 3.686) 5.711 1.985 ( 2.113 -5.259 2.322) 6.125 2.084 ( 2.937 -3.012 -0.618) 4.252 2.114 ( 0.500 -4.171 -0.919) 4.301 2.269 ( 2.309 2.098 -2.243) 3.842 2.469 ( -1.768 1.472 -2.157) 3.153 2.508 ( 0.358 -1.410 -1.841) 2.347 2.566 ( -1.789 0.749 -4.734) 5.116 2.584 ( -1.885 -1.681 0.443) 2.564 2.760 ( 3.249 0.077 7.681) 8.340 2.805 ( 1.625 -0.033 -0.270) 1.648 2.847 ( 0.924 -7.757 0.326) 7.819 3.016 ( 1.699 1.850 -1.911) 3.156 3.141 ( 1.680 4.096 -1.873) 4.807 3.195 ( -2.256 -0.133 -1.130) 2.527 3.270 ( -0.154 -3.360 -0.581) 3.414 3.348 ( 1.885 -6.926 -1.206) 7.278 3.376 ( -0.148 1.201 -2.336) 2.630 3.419 ( -1.845 -1.008 1.965) 2.878 3.696 ( -1.405 1.831 2.203) 3.191 4.026 ( 0.145 -6.804 1.109) 6.895 4.053 ( 0.119 -1.649 -0.038) 1.654 4.134 ( 1.363 0.333 1.120) 1.795 4.148 ( 3.116 -3.657 2.937) 5.631 4.231 ( -3.510 -2.413 -3.387) 5.442 4.406 ( -0.727 -2.568 0.203) 2.677 4.507 ( 6.529 -12.917 -5.793) 15.589 4.622 ( 5.237 -2.707 -0.516) 5.918 4.695 ( -1.440 0.580 -4.493) 4.753 4.754 ( -3.617 0.546 0.572) 3.702 4.853 ( -1.449 1.198 2.343) 3.004 4.993 ( 0.381 1.151 -0.587) 1.347 5.075 ( 1.066 1.426 0.645) 1.894 5.273 ( -0.104 0.956 -2.037) 2.253 5.283 ( -0.136 0.872 -2.923) 3.054 5.286 ( -0.429 0.063 0.401) 0.591 5.408 ( -0.280 0.974 0.760) 1.267 5.527 ( -1.064 3.948 4.453) 6.045 5.557 ( -4.970 5.845 2.642) 8.115 5.611 ( 0.034 4.013 -0.721) 4.078 5.658 ( -1.274 2.099 0.768) 2.572 5.697 ( -0.244 1.333 -0.263) 1.381 5.778 ( 0.009 1.060 0.736) 1.290 5.835 ( 0.586 0.837 -1.961) 2.211 5.981 ( 0.933 -5.133 -0.059) 5.217 6.033 ( 0.869 1.388 1.465) 2.197 6.184 ( 0.048 2.624 -1.529) 3.037 6.321 ( 7.480 -2.315 4.705) 9.135 ======================= Grid point 350 (140/140) ======================= q-point: (-0.08 -0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 4.63e-04 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.440 ( -12.822 0.000 15.453) 20.080 0.476 ( -14.701 0.000 16.202) 21.878 0.822 ( -15.324 0.000 30.173) 33.841 0.865 ( -4.851 0.000 -11.163) 12.171 0.892 ( -4.894 0.000 -12.356) 13.290 1.498 ( -1.939 0.000 1.090) 2.225 1.567 ( 0.629 -0.000 6.356) 6.387 1.633 ( -0.296 0.000 -17.025) 17.028 1.810 ( -1.932 0.000 -6.006) 6.309 1.929 ( 2.620 -0.000 3.508) 4.379 2.004 ( 3.166 -0.000 4.483) 5.488 2.032 ( 0.511 -0.000 -0.786) 0.937 2.109 ( 2.540 -0.000 1.448) 2.924 2.313 ( 3.710 -0.000 -2.799) 4.647 2.482 ( 0.260 -0.000 0.001) 0.260 2.483 ( -3.909 0.000 -2.944) 4.893 2.555 ( -2.488 0.000 -5.695) 6.215 2.575 ( 0.475 -0.000 1.355) 1.436 2.746 ( -0.350 0.000 -0.024) 0.351 2.770 ( -1.020 0.000 1.884) 2.142 2.853 ( 5.831 -0.000 4.143) 7.153 3.051 ( 3.244 -0.000 -1.500) 3.574 3.184 ( -1.369 0.000 -1.689) 2.174 3.227 ( 0.115 -0.000 -0.362) 0.380 3.246 ( 0.555 -0.000 0.376) 0.670 3.249 ( 0.450 -0.000 -3.609) 3.637 3.376 ( -5.518 0.000 -4.073) 6.858 3.463 ( 3.548 -0.000 -0.825) 3.642 3.722 ( -2.270 0.000 2.171) 3.141 3.862 ( -0.037 0.000 -0.010) 0.038 4.025 ( 0.035 -0.000 0.023) 0.042 4.031 ( 0.120 -0.000 -0.047) 0.129 4.165 ( -8.394 0.000 -2.567) 8.778 4.243 ( 4.508 -0.000 5.377) 7.016 4.304 ( 0.554 -0.000 0.056) 0.556 4.386 ( 0.120 -0.000 -0.032) 0.124 4.624 ( 4.728 -0.000 -0.839) 4.802 4.698 ( 1.089 -0.000 0.088) 1.092 4.746 ( -2.395 0.000 1.925) 3.072 4.865 ( -0.820 0.000 3.037) 3.146 4.999 ( -0.995 0.000 -2.026) 2.257 5.099 ( 1.799 -0.000 2.902) 3.415 5.275 ( -1.366 0.000 -0.814) 1.590 5.286 ( 1.566 -0.000 -1.765) 2.359 5.288 ( -0.776 0.000 -3.067) 3.163 5.416 ( -0.604 0.000 0.368) 0.708 5.545 ( -3.207 0.000 0.918) 3.335 5.648 ( -0.173 0.000 -0.052) 0.180 5.652 ( -0.215 0.000 0.050) 0.221 5.652 ( -0.920 0.000 0.496) 1.045 5.711 ( -0.204 0.000 -1.417) 1.432 5.851 ( -0.684 0.000 -1.736) 1.865 5.858 ( 0.487 -0.000 -0.005) 0.487 5.898 ( -0.493 0.000 0.006) 0.493 6.045 ( 0.646 -0.000 0.264) 0.698 6.216 ( 0.929 -0.000 -0.446) 1.031 6.366 ( 10.612 -0.000 5.686) 12.039 =================== 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 3/28899 10.0 788.097 482.402 308.357 -0.000 58.332 -0.000 3/28899 20.0 87.185 101.019 50.389 -0.000 0.890 -0.000 3/28899 30.0 29.055 42.168 18.261 -0.000 0.009 -0.000 3/28899 40.0 15.008 23.934 9.879 -0.000 -0.057 -0.000 3/28899 50.0 9.608 16.067 6.497 -0.000 -0.055 -0.000 3/28899 60.0 6.944 11.949 4.776 -0.000 -0.045 -0.000 3/28899 70.0 5.411 9.492 3.765 -0.000 -0.036 -0.000 3/28899 80.0 4.430 7.882 3.109 -0.000 -0.029 -0.000 3/28899 90.0 3.755 6.750 2.651 -0.000 -0.024 -0.000 3/28899 100.0 3.262 5.913 2.315 -0.000 -0.020 -0.000 3/28899 110.0 2.887 5.267 2.057 -0.000 -0.017 -0.000 3/28899 120.0 2.593 4.755 1.853 -0.000 -0.014 -0.000 3/28899 130.0 2.355 4.337 1.687 -0.000 -0.012 -0.000 3/28899 140.0 2.159 3.989 1.550 -0.000 -0.011 -0.000 3/28899 150.0 1.994 3.695 1.434 -0.000 -0.010 -0.000 3/28899 160.0 1.853 3.443 1.335 -0.000 -0.009 -0.000 3/28899 170.0 1.732 3.225 1.249 -0.000 -0.008 -0.000 3/28899 180.0 1.626 3.033 1.174 -0.000 -0.007 -0.000 3/28899 190.0 1.532 2.864 1.108 -0.000 -0.007 -0.000 3/28899 200.0 1.449 2.712 1.049 -0.000 -0.006 -0.000 3/28899 210.0 1.375 2.577 0.996 -0.000 -0.006 -0.000 3/28899 220.0 1.309 2.455 0.948 -0.000 -0.005 -0.000 3/28899 230.0 1.248 2.344 0.905 -0.000 -0.005 -0.000 3/28899 240.0 1.193 2.243 0.865 -0.000 -0.005 -0.000 3/28899 250.0 1.143 2.150 0.829 -0.000 -0.004 -0.000 3/28899 260.0 1.097 2.065 0.796 -0.000 -0.004 -0.000 3/28899 270.0 1.055 1.987 0.766 -0.000 -0.004 -0.000 3/28899 280.0 1.015 1.914 0.738 -0.000 -0.004 -0.000 3/28899 290.0 0.979 1.846 0.712 -0.000 -0.003 -0.000 3/28899 300.0 0.945 1.784 0.687 -0.000 -0.003 -0.000 3/28899 310.0 0.914 1.725 0.665 -0.000 -0.003 -0.000 3/28899 320.0 0.884 1.670 0.643 -0.000 -0.003 -0.000 3/28899 330.0 0.857 1.619 0.623 -0.000 -0.003 -0.000 3/28899 340.0 0.831 1.571 0.605 -0.000 -0.003 -0.000 3/28899 350.0 0.807 1.525 0.587 -0.000 -0.003 -0.000 3/28899 360.0 0.784 1.482 0.571 -0.000 -0.003 -0.000 3/28899 370.0 0.762 1.442 0.555 -0.000 -0.003 -0.000 3/28899 380.0 0.742 1.403 0.540 -0.000 -0.002 -0.000 3/28899 390.0 0.722 1.367 0.526 -0.000 -0.002 -0.000 3/28899 400.0 0.704 1.333 0.513 -0.000 -0.002 -0.000 3/28899 410.0 0.686 1.300 0.500 -0.000 -0.002 -0.000 3/28899 420.0 0.670 1.269 0.488 -0.000 -0.002 -0.000 3/28899 430.0 0.654 1.239 0.477 -0.000 -0.002 -0.000 3/28899 440.0 0.639 1.211 0.466 -0.000 -0.002 -0.000 3/28899 450.0 0.624 1.184 0.455 -0.000 -0.002 -0.000 3/28899 460.0 0.611 1.158 0.445 -0.000 -0.002 -0.000 3/28899 470.0 0.598 1.133 0.436 -0.000 -0.002 -0.000 3/28899 480.0 0.585 1.109 0.426 -0.000 -0.002 -0.000 3/28899 490.0 0.573 1.086 0.418 -0.000 -0.002 -0.000 3/28899 500.0 0.561 1.065 0.409 -0.000 -0.002 -0.000 3/28899 510.0 0.550 1.044 0.401 -0.000 -0.002 -0.000 3/28899 520.0 0.539 1.024 0.393 -0.000 -0.002 -0.000 3/28899 530.0 0.529 1.004 0.386 -0.000 -0.002 -0.000 3/28899 540.0 0.519 0.986 0.379 -0.000 -0.002 -0.000 3/28899 550.0 0.510 0.968 0.372 -0.000 -0.002 -0.000 3/28899 560.0 0.501 0.950 0.365 -0.000 -0.001 -0.000 3/28899 570.0 0.492 0.934 0.359 -0.000 -0.001 -0.000 3/28899 580.0 0.483 0.917 0.353 -0.000 -0.001 -0.000 3/28899 590.0 0.475 0.902 0.347 -0.000 -0.001 -0.000 3/28899 600.0 0.467 0.887 0.341 -0.000 -0.001 -0.000 3/28899 610.0 0.459 0.872 0.335 -0.000 -0.001 -0.000 3/28899 620.0 0.452 0.858 0.330 -0.000 -0.001 -0.000 3/28899 630.0 0.445 0.844 0.324 -0.000 -0.001 -0.000 3/28899 640.0 0.438 0.831 0.319 -0.000 -0.001 -0.000 3/28899 650.0 0.431 0.818 0.314 -0.000 -0.001 -0.000 3/28899 660.0 0.424 0.806 0.310 -0.000 -0.001 -0.000 3/28899 670.0 0.418 0.794 0.305 -0.000 -0.001 -0.000 3/28899 680.0 0.412 0.782 0.301 -0.000 -0.001 -0.000 3/28899 690.0 0.406 0.771 0.296 -0.000 -0.001 -0.000 3/28899 700.0 0.400 0.760 0.292 -0.000 -0.001 -0.000 3/28899 710.0 0.394 0.749 0.288 -0.000 -0.001 -0.000 3/28899 720.0 0.389 0.739 0.284 -0.000 -0.001 -0.000 3/28899 730.0 0.383 0.729 0.280 -0.000 -0.001 -0.000 3/28899 740.0 0.378 0.719 0.276 -0.000 -0.001 -0.000 3/28899 750.0 0.373 0.709 0.272 -0.000 -0.001 -0.000 3/28899 760.0 0.368 0.700 0.269 -0.000 -0.001 -0.000 3/28899 770.0 0.363 0.691 0.265 -0.000 -0.001 -0.000 3/28899 780.0 0.359 0.682 0.262 -0.000 -0.001 -0.000 3/28899 790.0 0.354 0.673 0.259 -0.000 -0.001 -0.000 3/28899 800.0 0.350 0.665 0.255 -0.000 -0.001 -0.000 3/28899 810.0 0.345 0.657 0.252 -0.000 -0.001 -0.000 3/28899 820.0 0.341 0.649 0.249 -0.000 -0.001 -0.000 3/28899 830.0 0.337 0.641 0.246 -0.000 -0.001 -0.000 3/28899 840.0 0.333 0.633 0.243 -0.000 -0.001 -0.000 3/28899 850.0 0.329 0.626 0.240 -0.000 -0.001 -0.000 3/28899 860.0 0.325 0.619 0.238 -0.000 -0.001 -0.000 3/28899 870.0 0.322 0.611 0.235 -0.000 -0.001 -0.000 3/28899 880.0 0.318 0.605 0.232 -0.000 -0.001 -0.000 3/28899 890.0 0.314 0.598 0.230 -0.000 -0.001 -0.000 3/28899 900.0 0.311 0.591 0.227 -0.000 -0.001 -0.000 3/28899 910.0 0.307 0.585 0.224 -0.000 -0.001 -0.000 3/28899 920.0 0.304 0.578 0.222 -0.000 -0.001 -0.000 3/28899 930.0 0.301 0.572 0.220 -0.000 -0.001 -0.000 3/28899 940.0 0.298 0.566 0.217 -0.000 -0.001 -0.000 3/28899 950.0 0.294 0.560 0.215 -0.000 -0.001 -0.000 3/28899 960.0 0.291 0.554 0.213 -0.000 -0.001 -0.000 3/28899 970.0 0.288 0.548 0.211 -0.000 -0.001 -0.000 3/28899 980.0 0.285 0.543 0.208 -0.000 -0.001 -0.000 3/28899 990.0 0.282 0.537 0.206 -0.000 -0.001 -0.000 3/28899 1000.0 0.280 0.532 0.204 -0.000 -0.001 -0.000 3/28899 Thermal conductivity related properties were written into "kappa-m13133.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 04:45:40]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|