----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 00:27:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [3 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.473768480001313 0.000000000000000 0.000000000000000 b 0.000000000000000 5.482012370000001 0.000000000000000 c -2.313844795339012 0.000000000000000 5.048198807910841 Atomic positions (fractional): *1 P 0.15714837364125 0.87143073889441 0.87052927509769 30.974 2 P 0.84285162635875 0.37143073889441 0.62947072490231 30.974 3 P 0.84285162635875 0.12856926110559 0.12947072490230 30.974 4 P 0.15714837364125 0.62856926110559 0.37052927509770 30.974 *5 P 0.33959944427809 0.37036155909191 0.18341887298571 30.974 6 P 0.66040055572191 0.87036155909191 0.31658112701429 30.974 7 P 0.66040055572191 0.62963844090809 0.81658112701429 30.974 8 P 0.33959944427809 0.12963844090809 0.68341887298571 30.974 *9 Co 0.27215713411327 0.49894473750275 0.78984474040248 58.933 10 Co 0.72784286588673 0.99894473750275 0.71015525959752 58.933 11 Co 0.72784286588673 0.50105526249725 0.21015525959752 58.933 12 Co 0.27215713411327 0.00105526249725 0.28984474040248 58.933 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.473768480001313 0.000000000000000 0.000000000000000 b 0.000000000000000 5.482012370000001 0.000000000000000 c -2.313844795339012 0.000000000000000 5.048198807910841 Atomic positions (fractional): *1 P 0.15714837364125 0.87143073889441 0.87052927509769 30.974 > 1 2 P 0.84285162635875 0.37143073889441 0.62947072490231 30.974 > 2 3 P 0.84285162635875 0.12856926110559 0.12947072490230 30.974 > 3 4 P 0.15714837364125 0.62856926110559 0.37052927509770 30.974 > 4 *5 P 0.33959944427809 0.37036155909191 0.18341887298571 30.974 > 5 6 P 0.66040055572191 0.87036155909191 0.31658112701429 30.974 > 6 7 P 0.66040055572191 0.62963844090809 0.81658112701429 30.974 > 7 8 P 0.33959944427809 0.12963844090809 0.68341887298571 30.974 > 8 *9 Co 0.27215713411327 0.49894473750275 0.78984474040248 58.933 > 9 10 Co 0.72784286588673 0.99894473750275 0.71015525959752 58.933 > 10 11 Co 0.72784286588673 0.50105526249725 0.21015525959752 58.933 > 11 12 Co 0.27215713411327 0.00105526249725 0.28984474040248 58.933 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 16.421305440003941 0.000000000000000 0.000000000000000 b 0.000000000000000 10.964024740000003 0.000000000000000 c -4.627689590678024 0.000000000000000 10.096397615821681 Atomic positions (fractional): *1 P 0.05238279121375 0.43571536944721 0.43526463754885 30.974 > 1 2 P 0.38571612454708 0.43571536944721 0.43526463754885 30.974 > 1 3 P 0.71904945788042 0.43571536944721 0.43526463754885 30.974 > 1 4 P 0.05238279121375 0.93571536944721 0.43526463754885 30.974 > 1 5 P 0.38571612454708 0.93571536944721 0.43526463754885 30.974 > 1 6 P 0.71904945788042 0.93571536944721 0.43526463754885 30.974 > 1 7 P 0.05238279121375 0.43571536944721 0.93526463754885 30.974 > 1 8 P 0.38571612454708 0.43571536944721 0.93526463754885 30.974 > 1 9 P 0.71904945788042 0.43571536944721 0.93526463754885 30.974 > 1 10 P 0.05238279121375 0.93571536944721 0.93526463754885 30.974 > 1 11 P 0.38571612454708 0.93571536944721 0.93526463754885 30.974 > 1 12 P 0.71904945788042 0.93571536944721 0.93526463754885 30.974 > 1 13 P 0.28095054211958 0.18571536944721 0.31473536245115 30.974 > 2 14 P 0.61428387545292 0.18571536944721 0.31473536245115 30.974 > 2 15 P 0.94761720878625 0.18571536944721 0.31473536245115 30.974 > 2 16 P 0.28095054211958 0.68571536944721 0.31473536245115 30.974 > 2 17 P 0.61428387545292 0.68571536944721 0.31473536245115 30.974 > 2 18 P 0.94761720878625 0.68571536944721 0.31473536245115 30.974 > 2 19 P 0.28095054211958 0.18571536944721 0.81473536245115 30.974 > 2 20 P 0.61428387545292 0.18571536944721 0.81473536245115 30.974 > 2 21 P 0.94761720878625 0.18571536944721 0.81473536245115 30.974 > 2 22 P 0.28095054211958 0.68571536944721 0.81473536245115 30.974 > 2 23 P 0.61428387545292 0.68571536944721 0.81473536245115 30.974 > 2 24 P 0.94761720878625 0.68571536944721 0.81473536245115 30.974 > 2 25 P 0.28095054211958 0.06428463055279 0.06473536245115 30.974 > 3 26 P 0.61428387545292 0.06428463055279 0.06473536245115 30.974 > 3 27 P 0.94761720878625 0.06428463055279 0.06473536245115 30.974 > 3 28 P 0.28095054211958 0.56428463055279 0.06473536245115 30.974 > 3 29 P 0.61428387545292 0.56428463055279 0.06473536245115 30.974 > 3 30 P 0.94761720878625 0.56428463055279 0.06473536245115 30.974 > 3 31 P 0.28095054211958 0.06428463055279 0.56473536245115 30.974 > 3 32 P 0.61428387545292 0.06428463055279 0.56473536245115 30.974 > 3 33 P 0.94761720878625 0.06428463055279 0.56473536245115 30.974 > 3 34 P 0.28095054211958 0.56428463055279 0.56473536245115 30.974 > 3 35 P 0.61428387545292 0.56428463055279 0.56473536245115 30.974 > 3 36 P 0.94761720878625 0.56428463055279 0.56473536245115 30.974 > 3 37 P 0.05238279121375 0.31428463055279 0.18526463754885 30.974 > 4 38 P 0.38571612454708 0.31428463055279 0.18526463754885 30.974 > 4 39 P 0.71904945788042 0.31428463055279 0.18526463754885 30.974 > 4 40 P 0.05238279121375 0.81428463055279 0.18526463754885 30.974 > 4 41 P 0.38571612454708 0.81428463055279 0.18526463754885 30.974 > 4 42 P 0.71904945788042 0.81428463055279 0.18526463754885 30.974 > 4 43 P 0.05238279121375 0.31428463055279 0.68526463754885 30.974 > 4 44 P 0.38571612454708 0.31428463055279 0.68526463754885 30.974 > 4 45 P 0.71904945788042 0.31428463055279 0.68526463754885 30.974 > 4 46 P 0.05238279121375 0.81428463055279 0.68526463754885 30.974 > 4 47 P 0.38571612454708 0.81428463055279 0.68526463754885 30.974 > 4 48 P 0.71904945788042 0.81428463055279 0.68526463754885 30.974 > 4 *49 P 0.11319981475936 0.18518077954595 0.09170943649285 30.974 > 5 50 P 0.44653314809270 0.18518077954595 0.09170943649285 30.974 > 5 51 P 0.77986648142603 0.18518077954595 0.09170943649285 30.974 > 5 52 P 0.11319981475936 0.68518077954595 0.09170943649285 30.974 > 5 53 P 0.44653314809270 0.68518077954595 0.09170943649285 30.974 > 5 54 P 0.77986648142603 0.68518077954595 0.09170943649285 30.974 > 5 55 P 0.11319981475936 0.18518077954595 0.59170943649285 30.974 > 5 56 P 0.44653314809270 0.18518077954595 0.59170943649285 30.974 > 5 57 P 0.77986648142603 0.18518077954595 0.59170943649285 30.974 > 5 58 P 0.11319981475936 0.68518077954595 0.59170943649285 30.974 > 5 59 P 0.44653314809270 0.68518077954595 0.59170943649285 30.974 > 5 60 P 0.77986648142603 0.68518077954595 0.59170943649285 30.974 > 5 61 P 0.22013351857397 0.43518077954595 0.15829056350715 30.974 > 6 62 P 0.55346685190730 0.43518077954595 0.15829056350715 30.974 > 6 63 P 0.88680018524064 0.43518077954595 0.15829056350715 30.974 > 6 64 P 0.22013351857397 0.93518077954595 0.15829056350715 30.974 > 6 65 P 0.55346685190730 0.93518077954595 0.15829056350715 30.974 > 6 66 P 0.88680018524064 0.93518077954595 0.15829056350715 30.974 > 6 67 P 0.22013351857397 0.43518077954595 0.65829056350715 30.974 > 6 68 P 0.55346685190730 0.43518077954595 0.65829056350715 30.974 > 6 69 P 0.88680018524064 0.43518077954595 0.65829056350715 30.974 > 6 70 P 0.22013351857397 0.93518077954595 0.65829056350715 30.974 > 6 71 P 0.55346685190730 0.93518077954595 0.65829056350715 30.974 > 6 72 P 0.88680018524064 0.93518077954595 0.65829056350715 30.974 > 6 73 P 0.22013351857397 0.31481922045405 0.40829056350715 30.974 > 7 74 P 0.55346685190730 0.31481922045405 0.40829056350715 30.974 > 7 75 P 0.88680018524064 0.31481922045405 0.40829056350715 30.974 > 7 76 P 0.22013351857397 0.81481922045405 0.40829056350715 30.974 > 7 77 P 0.55346685190730 0.81481922045405 0.40829056350715 30.974 > 7 78 P 0.88680018524064 0.81481922045405 0.40829056350715 30.974 > 7 79 P 0.22013351857397 0.31481922045405 0.90829056350715 30.974 > 7 80 P 0.55346685190730 0.31481922045405 0.90829056350715 30.974 > 7 81 P 0.88680018524064 0.31481922045405 0.90829056350715 30.974 > 7 82 P 0.22013351857397 0.81481922045405 0.90829056350715 30.974 > 7 83 P 0.55346685190730 0.81481922045405 0.90829056350715 30.974 > 7 84 P 0.88680018524064 0.81481922045405 0.90829056350715 30.974 > 7 85 P 0.11319981475936 0.06481922045405 0.34170943649285 30.974 > 8 86 P 0.44653314809270 0.06481922045405 0.34170943649285 30.974 > 8 87 P 0.77986648142603 0.06481922045405 0.34170943649285 30.974 > 8 88 P 0.11319981475936 0.56481922045405 0.34170943649285 30.974 > 8 89 P 0.44653314809270 0.56481922045405 0.34170943649285 30.974 > 8 90 P 0.77986648142603 0.56481922045405 0.34170943649285 30.974 > 8 91 P 0.11319981475936 0.06481922045405 0.84170943649285 30.974 > 8 92 P 0.44653314809270 0.06481922045405 0.84170943649285 30.974 > 8 93 P 0.77986648142603 0.06481922045405 0.84170943649285 30.974 > 8 94 P 0.11319981475936 0.56481922045405 0.84170943649285 30.974 > 8 95 P 0.44653314809270 0.56481922045405 0.84170943649285 30.974 > 8 96 P 0.77986648142603 0.56481922045405 0.84170943649285 30.974 > 8 *97 Co 0.09071904470442 0.24947236875137 0.39492237020124 58.933 > 9 98 Co 0.42405237803776 0.24947236875137 0.39492237020124 58.933 > 9 99 Co 0.75738571137109 0.24947236875137 0.39492237020124 58.933 > 9 100 Co 0.09071904470442 0.74947236875137 0.39492237020124 58.933 > 9 101 Co 0.42405237803776 0.74947236875137 0.39492237020124 58.933 > 9 102 Co 0.75738571137109 0.74947236875137 0.39492237020124 58.933 > 9 103 Co 0.09071904470442 0.24947236875137 0.89492237020124 58.933 > 9 104 Co 0.42405237803776 0.24947236875137 0.89492237020124 58.933 > 9 105 Co 0.75738571137109 0.24947236875137 0.89492237020124 58.933 > 9 106 Co 0.09071904470442 0.74947236875137 0.89492237020124 58.933 > 9 107 Co 0.42405237803776 0.74947236875137 0.89492237020124 58.933 > 9 108 Co 0.75738571137109 0.74947236875137 0.89492237020124 58.933 > 9 109 Co 0.24261428862891 0.49947236875137 0.35507762979876 58.933 > 10 110 Co 0.57594762196224 0.49947236875137 0.35507762979876 58.933 > 10 111 Co 0.90928095529558 0.49947236875137 0.35507762979876 58.933 > 10 112 Co 0.24261428862891 0.99947236875137 0.35507762979876 58.933 > 10 113 Co 0.57594762196224 0.99947236875137 0.35507762979876 58.933 > 10 114 Co 0.90928095529558 0.99947236875137 0.35507762979876 58.933 > 10 115 Co 0.24261428862891 0.49947236875137 0.85507762979876 58.933 > 10 116 Co 0.57594762196224 0.49947236875137 0.85507762979876 58.933 > 10 117 Co 0.90928095529558 0.49947236875137 0.85507762979876 58.933 > 10 118 Co 0.24261428862891 0.99947236875137 0.85507762979876 58.933 > 10 119 Co 0.57594762196224 0.99947236875137 0.85507762979876 58.933 > 10 120 Co 0.90928095529558 0.99947236875137 0.85507762979876 58.933 > 10 121 Co 0.24261428862891 0.25052763124863 0.10507762979876 58.933 > 11 122 Co 0.57594762196224 0.25052763124863 0.10507762979876 58.933 > 11 123 Co 0.90928095529558 0.25052763124863 0.10507762979876 58.933 > 11 124 Co 0.24261428862891 0.75052763124863 0.10507762979876 58.933 > 11 125 Co 0.57594762196224 0.75052763124863 0.10507762979876 58.933 > 11 126 Co 0.90928095529558 0.75052763124863 0.10507762979876 58.933 > 11 127 Co 0.24261428862891 0.25052763124863 0.60507762979876 58.933 > 11 128 Co 0.57594762196224 0.25052763124863 0.60507762979876 58.933 > 11 129 Co 0.90928095529558 0.25052763124863 0.60507762979876 58.933 > 11 130 Co 0.24261428862891 0.75052763124863 0.60507762979876 58.933 > 11 131 Co 0.57594762196224 0.75052763124863 0.60507762979876 58.933 > 11 132 Co 0.90928095529558 0.75052763124863 0.60507762979876 58.933 > 11 133 Co 0.09071904470442 0.00052763124863 0.14492237020124 58.933 > 12 134 Co 0.42405237803776 0.00052763124863 0.14492237020124 58.933 > 12 135 Co 0.75738571137109 0.00052763124863 0.14492237020124 58.933 > 12 136 Co 0.09071904470442 0.50052763124863 0.14492237020124 58.933 > 12 137 Co 0.42405237803776 0.50052763124863 0.14492237020124 58.933 > 12 138 Co 0.75738571137109 0.50052763124863 0.14492237020124 58.933 > 12 139 Co 0.09071904470442 0.00052763124863 0.64492237020124 58.933 > 12 140 Co 0.42405237803776 0.00052763124863 0.64492237020124 58.933 > 12 141 Co 0.75738571137109 0.00052763124863 0.64492237020124 58.933 > 12 142 Co 0.09071904470442 0.50052763124863 0.64492237020124 58.933 > 12 143 Co 0.42405237803776 0.50052763124863 0.64492237020124 58.933 > 12 144 Co 0.75738571137109 0.50052763124863 0.64492237020124 58.933 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 23.8833766 0.0000000 1.0875110 0.0000000 23.3088401 0.0000000 1.0875124 0.0000000 23.9086997 -------------------------- Born effective charges -------------------------- 1 P 2.1682115 -0.0357188 0.5960079 0.0628659 2.5934846 -0.3077436 -0.1288972 0.0568033 2.9053190 2 P 2.1682115 0.0357188 0.5960079 -0.0628659 2.5934846 0.3077436 -0.1288972 -0.0568033 2.9053190 3 P 2.1682115 -0.0357188 0.5960079 0.0628659 2.5934846 -0.3077436 -0.1288972 0.0568033 2.9053190 4 P 2.1682115 0.0357188 0.5960079 -0.0628659 2.5934846 0.3077436 -0.1288972 -0.0568033 2.9053190 5 P 3.2657458 -0.0774552 -0.0612036 0.0493762 2.6589705 -0.1702367 0.2549648 -0.1791764 3.0491031 6 P 3.2657458 0.0774552 -0.0612036 -0.0493762 2.6589705 0.1702367 0.2549648 0.1791764 3.0491031 7 P 3.2657458 -0.0774552 -0.0612036 0.0493762 2.6589705 -0.1702367 0.2549648 -0.1791764 3.0491031 8 P 3.2657458 0.0774552 -0.0612036 -0.0493762 2.6589705 0.1702367 0.2549648 0.1791764 3.0491031 9 Co -5.4339573 -0.0696664 -0.5348043 -0.4186265 -5.2524551 0.3016558 -0.1260675 0.1214735 -5.9544221 10 Co -5.4339573 0.0696664 -0.5348043 0.4186265 -5.2524551 -0.3016558 -0.1260675 -0.1214735 -5.9544221 11 Co -5.4339573 -0.0696664 -0.5348043 -0.4186265 -5.2524551 0.3016558 -0.1260675 0.1214735 -5.9544221 12 Co -5.4339573 0.0696664 -0.5348043 0.4186265 -5.2524551 -0.3016558 -0.1260675 -0.1214735 -5.9544221 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 432/432 Permutation basis: 8352/8352 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2016 Number of blocks in projector: 2016 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: 432 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 432 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 432 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 240 Use standard eigh solver. Tree of FC basis block matrices: - (2016, 1990), data: False |-- (240, 237), data: True |-- (240, 237), data: True |-- (240, 237), data: True |-- (432, 427), data: True |-- (432, 426), data: True |-- (432, 426), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.008 Solver_block: 100 / 400 - Time: 4.813 Solver_block: 200 / 400 - Time: 4.952 Solver_block: 300 / 400 - Time: 4.872 Solver_block: 400 / 400 - Time: 4.858 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 19.892 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 432/432 Permutation basis: 8352/8352 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2016 Number of blocks in projector: 2016 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: 432 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 432 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 432 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 240 Use standard eigh solver. Tree of FC basis block matrices: - (2016, 1990), data: False |-- (240, 237), data: True |-- (240, 237), data: True |-- (240, 237), data: True |-- (432, 427), data: True |-- (432, 426), data: True |-- (432, 426), 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 2026-01-08 00:28:19]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:28:20]------------------------- 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): [3 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.473768480001313 0.000000000000000 0.000000000000000 b 0.000000000000000 5.482012370000001 0.000000000000000 c -2.313844795339012 0.000000000000000 5.048198807910841 Atomic positions (fractional): 1 P 0.15714837364125 0.87143073889441 0.87052927509769 30.974 2 P 0.84285162635875 0.37143073889441 0.62947072490231 30.974 3 P 0.84285162635875 0.12856926110559 0.12947072490230 30.974 4 P 0.15714837364125 0.62856926110559 0.37052927509770 30.974 5 P 0.33959944427809 0.37036155909191 0.18341887298571 30.974 6 P 0.66040055572191 0.87036155909191 0.31658112701429 30.974 7 P 0.66040055572191 0.62963844090809 0.81658112701429 30.974 8 P 0.33959944427809 0.12963844090809 0.68341887298571 30.974 9 Co 0.27215713411327 0.49894473750275 0.78984474040248 58.933 10 Co 0.72784286588673 0.99894473750275 0.71015525959752 58.933 11 Co 0.72784286588673 0.50105526249725 0.21015525959752 58.933 12 Co 0.27215713411327 0.00105526249725 0.28984474040248 58.933 -------------------------------- supercell --------------------------------- Lattice vectors: a 16.421305440003941 0.000000000000000 0.000000000000000 b 0.000000000000000 10.964024740000003 0.000000000000000 c -4.627689590678024 0.000000000000000 10.096397615821681 Atomic positions (fractional): 1 P 0.05238279121375 0.43571536944721 0.43526463754885 30.974 > 1 2 P 0.38571612454708 0.43571536944721 0.43526463754885 30.974 > 1 3 P 0.71904945788042 0.43571536944721 0.43526463754885 30.974 > 1 4 P 0.05238279121375 0.93571536944721 0.43526463754885 30.974 > 1 5 P 0.38571612454708 0.93571536944721 0.43526463754885 30.974 > 1 6 P 0.71904945788042 0.93571536944721 0.43526463754885 30.974 > 1 7 P 0.05238279121375 0.43571536944721 0.93526463754885 30.974 > 1 8 P 0.38571612454708 0.43571536944721 0.93526463754885 30.974 > 1 9 P 0.71904945788042 0.43571536944721 0.93526463754885 30.974 > 1 10 P 0.05238279121375 0.93571536944721 0.93526463754885 30.974 > 1 11 P 0.38571612454708 0.93571536944721 0.93526463754885 30.974 > 1 12 P 0.71904945788042 0.93571536944721 0.93526463754885 30.974 > 1 13 P 0.28095054211958 0.18571536944721 0.31473536245115 30.974 > 13 14 P 0.61428387545292 0.18571536944721 0.31473536245115 30.974 > 13 15 P 0.94761720878625 0.18571536944721 0.31473536245115 30.974 > 13 16 P 0.28095054211958 0.68571536944721 0.31473536245115 30.974 > 13 17 P 0.61428387545292 0.68571536944721 0.31473536245115 30.974 > 13 18 P 0.94761720878625 0.68571536944721 0.31473536245115 30.974 > 13 19 P 0.28095054211958 0.18571536944721 0.81473536245115 30.974 > 13 20 P 0.61428387545292 0.18571536944721 0.81473536245115 30.974 > 13 21 P 0.94761720878625 0.18571536944721 0.81473536245115 30.974 > 13 22 P 0.28095054211958 0.68571536944721 0.81473536245115 30.974 > 13 23 P 0.61428387545292 0.68571536944721 0.81473536245115 30.974 > 13 24 P 0.94761720878625 0.68571536944721 0.81473536245115 30.974 > 13 25 P 0.28095054211958 0.06428463055279 0.06473536245115 30.974 > 25 26 P 0.61428387545292 0.06428463055279 0.06473536245115 30.974 > 25 27 P 0.94761720878625 0.06428463055279 0.06473536245115 30.974 > 25 28 P 0.28095054211958 0.56428463055279 0.06473536245115 30.974 > 25 29 P 0.61428387545292 0.56428463055279 0.06473536245115 30.974 > 25 30 P 0.94761720878625 0.56428463055279 0.06473536245115 30.974 > 25 31 P 0.28095054211958 0.06428463055279 0.56473536245115 30.974 > 25 32 P 0.61428387545292 0.06428463055279 0.56473536245115 30.974 > 25 33 P 0.94761720878625 0.06428463055279 0.56473536245115 30.974 > 25 34 P 0.28095054211958 0.56428463055279 0.56473536245115 30.974 > 25 35 P 0.61428387545292 0.56428463055279 0.56473536245115 30.974 > 25 36 P 0.94761720878625 0.56428463055279 0.56473536245115 30.974 > 25 37 P 0.05238279121375 0.31428463055279 0.18526463754885 30.974 > 37 38 P 0.38571612454708 0.31428463055279 0.18526463754885 30.974 > 37 39 P 0.71904945788042 0.31428463055279 0.18526463754885 30.974 > 37 40 P 0.05238279121375 0.81428463055279 0.18526463754885 30.974 > 37 41 P 0.38571612454708 0.81428463055279 0.18526463754885 30.974 > 37 42 P 0.71904945788042 0.81428463055279 0.18526463754885 30.974 > 37 43 P 0.05238279121375 0.31428463055279 0.68526463754885 30.974 > 37 44 P 0.38571612454708 0.31428463055279 0.68526463754885 30.974 > 37 45 P 0.71904945788042 0.31428463055279 0.68526463754885 30.974 > 37 46 P 0.05238279121375 0.81428463055279 0.68526463754885 30.974 > 37 47 P 0.38571612454708 0.81428463055279 0.68526463754885 30.974 > 37 48 P 0.71904945788042 0.81428463055279 0.68526463754885 30.974 > 37 49 P 0.11319981475936 0.18518077954595 0.09170943649285 30.974 > 49 50 P 0.44653314809270 0.18518077954595 0.09170943649285 30.974 > 49 51 P 0.77986648142603 0.18518077954595 0.09170943649285 30.974 > 49 52 P 0.11319981475936 0.68518077954595 0.09170943649285 30.974 > 49 53 P 0.44653314809270 0.68518077954595 0.09170943649285 30.974 > 49 54 P 0.77986648142603 0.68518077954595 0.09170943649285 30.974 > 49 55 P 0.11319981475936 0.18518077954595 0.59170943649285 30.974 > 49 56 P 0.44653314809270 0.18518077954595 0.59170943649285 30.974 > 49 57 P 0.77986648142603 0.18518077954595 0.59170943649285 30.974 > 49 58 P 0.11319981475936 0.68518077954595 0.59170943649285 30.974 > 49 59 P 0.44653314809270 0.68518077954595 0.59170943649285 30.974 > 49 60 P 0.77986648142603 0.68518077954595 0.59170943649285 30.974 > 49 61 P 0.22013351857397 0.43518077954595 0.15829056350715 30.974 > 61 62 P 0.55346685190730 0.43518077954595 0.15829056350715 30.974 > 61 63 P 0.88680018524064 0.43518077954595 0.15829056350715 30.974 > 61 64 P 0.22013351857397 0.93518077954595 0.15829056350715 30.974 > 61 65 P 0.55346685190730 0.93518077954595 0.15829056350715 30.974 > 61 66 P 0.88680018524064 0.93518077954595 0.15829056350715 30.974 > 61 67 P 0.22013351857397 0.43518077954595 0.65829056350715 30.974 > 61 68 P 0.55346685190730 0.43518077954595 0.65829056350715 30.974 > 61 69 P 0.88680018524064 0.43518077954595 0.65829056350715 30.974 > 61 70 P 0.22013351857397 0.93518077954595 0.65829056350715 30.974 > 61 71 P 0.55346685190730 0.93518077954595 0.65829056350715 30.974 > 61 72 P 0.88680018524064 0.93518077954595 0.65829056350715 30.974 > 61 73 P 0.22013351857397 0.31481922045405 0.40829056350715 30.974 > 73 74 P 0.55346685190730 0.31481922045405 0.40829056350715 30.974 > 73 75 P 0.88680018524064 0.31481922045405 0.40829056350715 30.974 > 73 76 P 0.22013351857397 0.81481922045405 0.40829056350715 30.974 > 73 77 P 0.55346685190730 0.81481922045405 0.40829056350715 30.974 > 73 78 P 0.88680018524064 0.81481922045405 0.40829056350715 30.974 > 73 79 P 0.22013351857397 0.31481922045405 0.90829056350715 30.974 > 73 80 P 0.55346685190730 0.31481922045405 0.90829056350715 30.974 > 73 81 P 0.88680018524064 0.31481922045405 0.90829056350715 30.974 > 73 82 P 0.22013351857397 0.81481922045405 0.90829056350715 30.974 > 73 83 P 0.55346685190730 0.81481922045405 0.90829056350715 30.974 > 73 84 P 0.88680018524064 0.81481922045405 0.90829056350715 30.974 > 73 85 P 0.11319981475936 0.06481922045405 0.34170943649285 30.974 > 85 86 P 0.44653314809270 0.06481922045405 0.34170943649285 30.974 > 85 87 P 0.77986648142603 0.06481922045405 0.34170943649285 30.974 > 85 88 P 0.11319981475936 0.56481922045405 0.34170943649285 30.974 > 85 89 P 0.44653314809270 0.56481922045405 0.34170943649285 30.974 > 85 90 P 0.77986648142603 0.56481922045405 0.34170943649285 30.974 > 85 91 P 0.11319981475936 0.06481922045405 0.84170943649285 30.974 > 85 92 P 0.44653314809270 0.06481922045405 0.84170943649285 30.974 > 85 93 P 0.77986648142603 0.06481922045405 0.84170943649285 30.974 > 85 94 P 0.11319981475936 0.56481922045405 0.84170943649285 30.974 > 85 95 P 0.44653314809270 0.56481922045405 0.84170943649285 30.974 > 85 96 P 0.77986648142603 0.56481922045405 0.84170943649285 30.974 > 85 97 Co 0.09071904470442 0.24947236875137 0.39492237020124 58.933 > 97 98 Co 0.42405237803776 0.24947236875137 0.39492237020124 58.933 > 97 99 Co 0.75738571137109 0.24947236875137 0.39492237020124 58.933 > 97 100 Co 0.09071904470442 0.74947236875137 0.39492237020124 58.933 > 97 101 Co 0.42405237803776 0.74947236875137 0.39492237020124 58.933 > 97 102 Co 0.75738571137109 0.74947236875137 0.39492237020124 58.933 > 97 103 Co 0.09071904470442 0.24947236875137 0.89492237020124 58.933 > 97 104 Co 0.42405237803776 0.24947236875137 0.89492237020124 58.933 > 97 105 Co 0.75738571137109 0.24947236875137 0.89492237020124 58.933 > 97 106 Co 0.09071904470442 0.74947236875137 0.89492237020124 58.933 > 97 107 Co 0.42405237803776 0.74947236875137 0.89492237020124 58.933 > 97 108 Co 0.75738571137109 0.74947236875137 0.89492237020124 58.933 > 97 109 Co 0.24261428862891 0.49947236875137 0.35507762979876 58.933 > 109 110 Co 0.57594762196224 0.49947236875137 0.35507762979876 58.933 > 109 111 Co 0.90928095529558 0.49947236875137 0.35507762979876 58.933 > 109 112 Co 0.24261428862891 0.99947236875137 0.35507762979876 58.933 > 109 113 Co 0.57594762196224 0.99947236875137 0.35507762979876 58.933 > 109 114 Co 0.90928095529558 0.99947236875137 0.35507762979876 58.933 > 109 115 Co 0.24261428862891 0.49947236875137 0.85507762979876 58.933 > 109 116 Co 0.57594762196224 0.49947236875137 0.85507762979876 58.933 > 109 117 Co 0.90928095529558 0.49947236875137 0.85507762979876 58.933 > 109 118 Co 0.24261428862891 0.99947236875137 0.85507762979876 58.933 > 109 119 Co 0.57594762196224 0.99947236875137 0.85507762979876 58.933 > 109 120 Co 0.90928095529558 0.99947236875137 0.85507762979876 58.933 > 109 121 Co 0.24261428862891 0.25052763124863 0.10507762979876 58.933 > 121 122 Co 0.57594762196224 0.25052763124863 0.10507762979876 58.933 > 121 123 Co 0.90928095529558 0.25052763124863 0.10507762979876 58.933 > 121 124 Co 0.24261428862891 0.75052763124863 0.10507762979876 58.933 > 121 125 Co 0.57594762196224 0.75052763124863 0.10507762979876 58.933 > 121 126 Co 0.90928095529558 0.75052763124863 0.10507762979876 58.933 > 121 127 Co 0.24261428862891 0.25052763124863 0.60507762979876 58.933 > 121 128 Co 0.57594762196224 0.25052763124863 0.60507762979876 58.933 > 121 129 Co 0.90928095529558 0.25052763124863 0.60507762979876 58.933 > 121 130 Co 0.24261428862891 0.75052763124863 0.60507762979876 58.933 > 121 131 Co 0.57594762196224 0.75052763124863 0.60507762979876 58.933 > 121 132 Co 0.90928095529558 0.75052763124863 0.60507762979876 58.933 > 121 133 Co 0.09071904470442 0.00052763124863 0.14492237020124 58.933 > 133 134 Co 0.42405237803776 0.00052763124863 0.14492237020124 58.933 > 133 135 Co 0.75738571137109 0.00052763124863 0.14492237020124 58.933 > 133 136 Co 0.09071904470442 0.50052763124863 0.14492237020124 58.933 > 133 137 Co 0.42405237803776 0.50052763124863 0.14492237020124 58.933 > 133 138 Co 0.75738571137109 0.50052763124863 0.14492237020124 58.933 > 133 139 Co 0.09071904470442 0.00052763124863 0.64492237020124 58.933 > 133 140 Co 0.42405237803776 0.00052763124863 0.64492237020124 58.933 > 133 141 Co 0.75738571137109 0.00052763124863 0.64492237020124 58.933 > 133 142 Co 0.09071904470442 0.50052763124863 0.64492237020124 58.933 > 133 143 Co 0.42405237803776 0.50052763124863 0.64492237020124 58.933 > 133 144 Co 0.75738571137109 0.50052763124863 0.64492237020124 58.933 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 23.8833766 0.0000000 1.0875110 0.0000000 23.3088401 0.0000000 1.0875124 0.0000000 23.9086997 -------------------------- Born effective charges -------------------------- 1 P 2.1682115 -0.0357188 0.5960079 0.0628659 2.5934846 -0.3077436 -0.1288972 0.0568033 2.9053190 2 P 2.1682115 0.0357188 0.5960079 -0.0628659 2.5934846 0.3077436 -0.1288972 -0.0568033 2.9053190 3 P 2.1682115 -0.0357188 0.5960079 0.0628659 2.5934846 -0.3077436 -0.1288972 0.0568033 2.9053190 4 P 2.1682115 0.0357188 0.5960079 -0.0628659 2.5934846 0.3077436 -0.1288972 -0.0568033 2.9053190 5 P 3.2657458 -0.0774552 -0.0612036 0.0493762 2.6589705 -0.1702367 0.2549648 -0.1791764 3.0491031 6 P 3.2657458 0.0774552 -0.0612036 -0.0493762 2.6589705 0.1702367 0.2549648 0.1791764 3.0491031 7 P 3.2657458 -0.0774552 -0.0612036 0.0493762 2.6589705 -0.1702367 0.2549648 -0.1791764 3.0491031 8 P 3.2657458 0.0774552 -0.0612036 -0.0493762 2.6589705 0.1702367 0.2549648 0.1791764 3.0491031 9 Co -5.4339573 -0.0696664 -0.5348043 -0.4186265 -5.2524551 0.3016558 -0.1260675 0.1214735 -5.9544221 10 Co -5.4339573 0.0696664 -0.5348043 0.4186265 -5.2524551 -0.3016558 -0.1260675 -0.1214735 -5.9544221 11 Co -5.4339573 -0.0696664 -0.5348043 -0.4186265 -5.2524551 0.3016558 -0.1260675 0.1214735 -5.9544221 12 Co -5.4339573 0.0696664 -0.5348043 0.4186265 -5.2524551 -0.3016558 -0.1260675 -0.1214735 -5.9544221 ---------------------------------------------------------------------------- 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] [-0.0042 0.0000 0.0091] [ 0.0042 0.0000 -0.0091] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0042 0.0000 0.0091] [ 0.0042 0.0000 -0.0091] Computing fc3[ 97, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0042 0.0000 0.0091] [ 0.0042 0.0000 -0.0091] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000002 (zzz) -0.00000002 (zzz) -0.00000002 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000001 (xz) -0.00000001 (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 2026-01-08 00:28:42]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:28:42]------------------------- 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): [3 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.473768480001313 0.000000000000000 0.000000000000000 b 0.000000000000000 5.482012370000001 0.000000000000000 c -2.313844795339012 0.000000000000000 5.048198807910841 Atomic positions (fractional): 1 P 0.15714837364125 0.87143073889441 0.87052927509769 30.974 2 P 0.84285162635875 0.37143073889441 0.62947072490231 30.974 3 P 0.84285162635875 0.12856926110559 0.12947072490230 30.974 4 P 0.15714837364125 0.62856926110559 0.37052927509770 30.974 5 P 0.33959944427809 0.37036155909191 0.18341887298571 30.974 6 P 0.66040055572191 0.87036155909191 0.31658112701429 30.974 7 P 0.66040055572191 0.62963844090809 0.81658112701429 30.974 8 P 0.33959944427809 0.12963844090809 0.68341887298571 30.974 9 Co 0.27215713411327 0.49894473750275 0.78984474040248 58.933 10 Co 0.72784286588673 0.99894473750275 0.71015525959752 58.933 11 Co 0.72784286588673 0.50105526249725 0.21015525959752 58.933 12 Co 0.27215713411327 0.00105526249725 0.28984474040248 58.933 -------------------------------- supercell --------------------------------- Lattice vectors: a 16.421305440003941 0.000000000000000 0.000000000000000 b 0.000000000000000 10.964024740000003 0.000000000000000 c -4.627689590678024 0.000000000000000 10.096397615821681 Atomic positions (fractional): 1 P 0.05238279121375 0.43571536944721 0.43526463754885 30.974 > 1 2 P 0.38571612454708 0.43571536944721 0.43526463754885 30.974 > 1 3 P 0.71904945788042 0.43571536944721 0.43526463754885 30.974 > 1 4 P 0.05238279121375 0.93571536944721 0.43526463754885 30.974 > 1 5 P 0.38571612454708 0.93571536944721 0.43526463754885 30.974 > 1 6 P 0.71904945788042 0.93571536944721 0.43526463754885 30.974 > 1 7 P 0.05238279121375 0.43571536944721 0.93526463754885 30.974 > 1 8 P 0.38571612454708 0.43571536944721 0.93526463754885 30.974 > 1 9 P 0.71904945788042 0.43571536944721 0.93526463754885 30.974 > 1 10 P 0.05238279121375 0.93571536944721 0.93526463754885 30.974 > 1 11 P 0.38571612454708 0.93571536944721 0.93526463754885 30.974 > 1 12 P 0.71904945788042 0.93571536944721 0.93526463754885 30.974 > 1 13 P 0.28095054211958 0.18571536944721 0.31473536245115 30.974 > 13 14 P 0.61428387545292 0.18571536944721 0.31473536245115 30.974 > 13 15 P 0.94761720878625 0.18571536944721 0.31473536245115 30.974 > 13 16 P 0.28095054211958 0.68571536944721 0.31473536245115 30.974 > 13 17 P 0.61428387545292 0.68571536944721 0.31473536245115 30.974 > 13 18 P 0.94761720878625 0.68571536944721 0.31473536245115 30.974 > 13 19 P 0.28095054211958 0.18571536944721 0.81473536245115 30.974 > 13 20 P 0.61428387545292 0.18571536944721 0.81473536245115 30.974 > 13 21 P 0.94761720878625 0.18571536944721 0.81473536245115 30.974 > 13 22 P 0.28095054211958 0.68571536944721 0.81473536245115 30.974 > 13 23 P 0.61428387545292 0.68571536944721 0.81473536245115 30.974 > 13 24 P 0.94761720878625 0.68571536944721 0.81473536245115 30.974 > 13 25 P 0.28095054211958 0.06428463055279 0.06473536245115 30.974 > 25 26 P 0.61428387545292 0.06428463055279 0.06473536245115 30.974 > 25 27 P 0.94761720878625 0.06428463055279 0.06473536245115 30.974 > 25 28 P 0.28095054211958 0.56428463055279 0.06473536245115 30.974 > 25 29 P 0.61428387545292 0.56428463055279 0.06473536245115 30.974 > 25 30 P 0.94761720878625 0.56428463055279 0.06473536245115 30.974 > 25 31 P 0.28095054211958 0.06428463055279 0.56473536245115 30.974 > 25 32 P 0.61428387545292 0.06428463055279 0.56473536245115 30.974 > 25 33 P 0.94761720878625 0.06428463055279 0.56473536245115 30.974 > 25 34 P 0.28095054211958 0.56428463055279 0.56473536245115 30.974 > 25 35 P 0.61428387545292 0.56428463055279 0.56473536245115 30.974 > 25 36 P 0.94761720878625 0.56428463055279 0.56473536245115 30.974 > 25 37 P 0.05238279121375 0.31428463055279 0.18526463754885 30.974 > 37 38 P 0.38571612454708 0.31428463055279 0.18526463754885 30.974 > 37 39 P 0.71904945788042 0.31428463055279 0.18526463754885 30.974 > 37 40 P 0.05238279121375 0.81428463055279 0.18526463754885 30.974 > 37 41 P 0.38571612454708 0.81428463055279 0.18526463754885 30.974 > 37 42 P 0.71904945788042 0.81428463055279 0.18526463754885 30.974 > 37 43 P 0.05238279121375 0.31428463055279 0.68526463754885 30.974 > 37 44 P 0.38571612454708 0.31428463055279 0.68526463754885 30.974 > 37 45 P 0.71904945788042 0.31428463055279 0.68526463754885 30.974 > 37 46 P 0.05238279121375 0.81428463055279 0.68526463754885 30.974 > 37 47 P 0.38571612454708 0.81428463055279 0.68526463754885 30.974 > 37 48 P 0.71904945788042 0.81428463055279 0.68526463754885 30.974 > 37 49 P 0.11319981475936 0.18518077954595 0.09170943649285 30.974 > 49 50 P 0.44653314809270 0.18518077954595 0.09170943649285 30.974 > 49 51 P 0.77986648142603 0.18518077954595 0.09170943649285 30.974 > 49 52 P 0.11319981475936 0.68518077954595 0.09170943649285 30.974 > 49 53 P 0.44653314809270 0.68518077954595 0.09170943649285 30.974 > 49 54 P 0.77986648142603 0.68518077954595 0.09170943649285 30.974 > 49 55 P 0.11319981475936 0.18518077954595 0.59170943649285 30.974 > 49 56 P 0.44653314809270 0.18518077954595 0.59170943649285 30.974 > 49 57 P 0.77986648142603 0.18518077954595 0.59170943649285 30.974 > 49 58 P 0.11319981475936 0.68518077954595 0.59170943649285 30.974 > 49 59 P 0.44653314809270 0.68518077954595 0.59170943649285 30.974 > 49 60 P 0.77986648142603 0.68518077954595 0.59170943649285 30.974 > 49 61 P 0.22013351857397 0.43518077954595 0.15829056350715 30.974 > 61 62 P 0.55346685190730 0.43518077954595 0.15829056350715 30.974 > 61 63 P 0.88680018524064 0.43518077954595 0.15829056350715 30.974 > 61 64 P 0.22013351857397 0.93518077954595 0.15829056350715 30.974 > 61 65 P 0.55346685190730 0.93518077954595 0.15829056350715 30.974 > 61 66 P 0.88680018524064 0.93518077954595 0.15829056350715 30.974 > 61 67 P 0.22013351857397 0.43518077954595 0.65829056350715 30.974 > 61 68 P 0.55346685190730 0.43518077954595 0.65829056350715 30.974 > 61 69 P 0.88680018524064 0.43518077954595 0.65829056350715 30.974 > 61 70 P 0.22013351857397 0.93518077954595 0.65829056350715 30.974 > 61 71 P 0.55346685190730 0.93518077954595 0.65829056350715 30.974 > 61 72 P 0.88680018524064 0.93518077954595 0.65829056350715 30.974 > 61 73 P 0.22013351857397 0.31481922045405 0.40829056350715 30.974 > 73 74 P 0.55346685190730 0.31481922045405 0.40829056350715 30.974 > 73 75 P 0.88680018524064 0.31481922045405 0.40829056350715 30.974 > 73 76 P 0.22013351857397 0.81481922045405 0.40829056350715 30.974 > 73 77 P 0.55346685190730 0.81481922045405 0.40829056350715 30.974 > 73 78 P 0.88680018524064 0.81481922045405 0.40829056350715 30.974 > 73 79 P 0.22013351857397 0.31481922045405 0.90829056350715 30.974 > 73 80 P 0.55346685190730 0.31481922045405 0.90829056350715 30.974 > 73 81 P 0.88680018524064 0.31481922045405 0.90829056350715 30.974 > 73 82 P 0.22013351857397 0.81481922045405 0.90829056350715 30.974 > 73 83 P 0.55346685190730 0.81481922045405 0.90829056350715 30.974 > 73 84 P 0.88680018524064 0.81481922045405 0.90829056350715 30.974 > 73 85 P 0.11319981475936 0.06481922045405 0.34170943649285 30.974 > 85 86 P 0.44653314809270 0.06481922045405 0.34170943649285 30.974 > 85 87 P 0.77986648142603 0.06481922045405 0.34170943649285 30.974 > 85 88 P 0.11319981475936 0.56481922045405 0.34170943649285 30.974 > 85 89 P 0.44653314809270 0.56481922045405 0.34170943649285 30.974 > 85 90 P 0.77986648142603 0.56481922045405 0.34170943649285 30.974 > 85 91 P 0.11319981475936 0.06481922045405 0.84170943649285 30.974 > 85 92 P 0.44653314809270 0.06481922045405 0.84170943649285 30.974 > 85 93 P 0.77986648142603 0.06481922045405 0.84170943649285 30.974 > 85 94 P 0.11319981475936 0.56481922045405 0.84170943649285 30.974 > 85 95 P 0.44653314809270 0.56481922045405 0.84170943649285 30.974 > 85 96 P 0.77986648142603 0.56481922045405 0.84170943649285 30.974 > 85 97 Co 0.09071904470442 0.24947236875137 0.39492237020124 58.933 > 97 98 Co 0.42405237803776 0.24947236875137 0.39492237020124 58.933 > 97 99 Co 0.75738571137109 0.24947236875137 0.39492237020124 58.933 > 97 100 Co 0.09071904470442 0.74947236875137 0.39492237020124 58.933 > 97 101 Co 0.42405237803776 0.74947236875137 0.39492237020124 58.933 > 97 102 Co 0.75738571137109 0.74947236875137 0.39492237020124 58.933 > 97 103 Co 0.09071904470442 0.24947236875137 0.89492237020124 58.933 > 97 104 Co 0.42405237803776 0.24947236875137 0.89492237020124 58.933 > 97 105 Co 0.75738571137109 0.24947236875137 0.89492237020124 58.933 > 97 106 Co 0.09071904470442 0.74947236875137 0.89492237020124 58.933 > 97 107 Co 0.42405237803776 0.74947236875137 0.89492237020124 58.933 > 97 108 Co 0.75738571137109 0.74947236875137 0.89492237020124 58.933 > 97 109 Co 0.24261428862891 0.49947236875137 0.35507762979876 58.933 > 109 110 Co 0.57594762196224 0.49947236875137 0.35507762979876 58.933 > 109 111 Co 0.90928095529558 0.49947236875137 0.35507762979876 58.933 > 109 112 Co 0.24261428862891 0.99947236875137 0.35507762979876 58.933 > 109 113 Co 0.57594762196224 0.99947236875137 0.35507762979876 58.933 > 109 114 Co 0.90928095529558 0.99947236875137 0.35507762979876 58.933 > 109 115 Co 0.24261428862891 0.49947236875137 0.85507762979876 58.933 > 109 116 Co 0.57594762196224 0.49947236875137 0.85507762979876 58.933 > 109 117 Co 0.90928095529558 0.49947236875137 0.85507762979876 58.933 > 109 118 Co 0.24261428862891 0.99947236875137 0.85507762979876 58.933 > 109 119 Co 0.57594762196224 0.99947236875137 0.85507762979876 58.933 > 109 120 Co 0.90928095529558 0.99947236875137 0.85507762979876 58.933 > 109 121 Co 0.24261428862891 0.25052763124863 0.10507762979876 58.933 > 121 122 Co 0.57594762196224 0.25052763124863 0.10507762979876 58.933 > 121 123 Co 0.90928095529558 0.25052763124863 0.10507762979876 58.933 > 121 124 Co 0.24261428862891 0.75052763124863 0.10507762979876 58.933 > 121 125 Co 0.57594762196224 0.75052763124863 0.10507762979876 58.933 > 121 126 Co 0.90928095529558 0.75052763124863 0.10507762979876 58.933 > 121 127 Co 0.24261428862891 0.25052763124863 0.60507762979876 58.933 > 121 128 Co 0.57594762196224 0.25052763124863 0.60507762979876 58.933 > 121 129 Co 0.90928095529558 0.25052763124863 0.60507762979876 58.933 > 121 130 Co 0.24261428862891 0.75052763124863 0.60507762979876 58.933 > 121 131 Co 0.57594762196224 0.75052763124863 0.60507762979876 58.933 > 121 132 Co 0.90928095529558 0.75052763124863 0.60507762979876 58.933 > 121 133 Co 0.09071904470442 0.00052763124863 0.14492237020124 58.933 > 133 134 Co 0.42405237803776 0.00052763124863 0.14492237020124 58.933 > 133 135 Co 0.75738571137109 0.00052763124863 0.14492237020124 58.933 > 133 136 Co 0.09071904470442 0.50052763124863 0.14492237020124 58.933 > 133 137 Co 0.42405237803776 0.50052763124863 0.14492237020124 58.933 > 133 138 Co 0.75738571137109 0.50052763124863 0.14492237020124 58.933 > 133 139 Co 0.09071904470442 0.00052763124863 0.64492237020124 58.933 > 133 140 Co 0.42405237803776 0.00052763124863 0.64492237020124 58.933 > 133 141 Co 0.75738571137109 0.00052763124863 0.64492237020124 58.933 > 133 142 Co 0.09071904470442 0.50052763124863 0.64492237020124 58.933 > 133 143 Co 0.42405237803776 0.50052763124863 0.64492237020124 58.933 > 133 144 Co 0.75738571137109 0.50052763124863 0.64492237020124 58.933 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 23.8833766 0.0000000 1.0875110 0.0000000 23.3088401 0.0000000 1.0875124 0.0000000 23.9086997 -------------------------- Born effective charges -------------------------- 1 P 2.1682115 -0.0357188 0.5960079 0.0628659 2.5934846 -0.3077436 -0.1288972 0.0568033 2.9053190 2 P 2.1682115 0.0357188 0.5960079 -0.0628659 2.5934846 0.3077436 -0.1288972 -0.0568033 2.9053190 3 P 2.1682115 -0.0357188 0.5960079 0.0628659 2.5934846 -0.3077436 -0.1288972 0.0568033 2.9053190 4 P 2.1682115 0.0357188 0.5960079 -0.0628659 2.5934846 0.3077436 -0.1288972 -0.0568033 2.9053190 5 P 3.2657458 -0.0774552 -0.0612036 0.0493762 2.6589705 -0.1702367 0.2549648 -0.1791764 3.0491031 6 P 3.2657458 0.0774552 -0.0612036 -0.0493762 2.6589705 0.1702367 0.2549648 0.1791764 3.0491031 7 P 3.2657458 -0.0774552 -0.0612036 0.0493762 2.6589705 -0.1702367 0.2549648 -0.1791764 3.0491031 8 P 3.2657458 0.0774552 -0.0612036 -0.0493762 2.6589705 0.1702367 0.2549648 0.1791764 3.0491031 9 Co -5.4339573 -0.0696664 -0.5348043 -0.4186265 -5.2524551 0.3016558 -0.1260675 0.1214735 -5.9544221 10 Co -5.4339573 0.0696664 -0.5348043 0.4186265 -5.2524551 -0.3016558 -0.1260675 -0.1214735 -5.9544221 11 Co -5.4339573 -0.0696664 -0.5348043 -0.4186265 -5.2524551 0.3016558 -0.1260675 0.1214735 -5.9544221 12 Co -5.4339573 0.0696664 -0.5348043 0.4186265 -5.2524551 -0.3016558 -0.1260675 -0.1214735 -5.9544221 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000002 (zzz) -0.00000002 (zzz) -0.00000002 (zzz) 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 ... [ 10 9 10 ] 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: 0.78, Number of G-points: 303, Lambda: 0.40 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/260) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 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 4.782 ( 0.000 0.000 0.000) 0.000 4.895 ( 0.000 0.000 0.000) 0.000 6.134 ( 0.000 0.000 0.000) 0.000 6.235 ( 0.000 0.000 0.000) 0.000 6.395 ( 0.000 0.000 0.000) 0.000 6.854 ( 0.000 0.000 0.000) 0.000 8.209 ( 0.000 0.000 0.000) 0.000 8.731 ( 0.000 0.000 0.000) 0.000 8.749 ( 0.000 0.000 0.000) 0.000 8.767 ( 0.000 0.000 0.000) 0.000 9.075 ( 0.000 0.000 0.000) 0.000 9.085 ( 0.000 0.000 0.000) 0.000 9.688 ( 0.000 0.000 0.000) 0.000 9.731 ( 0.000 0.000 0.000) 0.000 9.939 ( 0.000 0.000 0.000) 0.000 10.054 ( 0.000 0.000 0.000) 0.000 10.468 ( 0.000 0.000 0.000) 0.000 10.606 ( 0.000 0.000 0.000) 0.000 10.735 ( 0.000 0.000 0.000) 0.000 11.082 ( 0.000 0.000 0.000) 0.000 11.157 ( 0.000 0.000 0.000) 0.000 11.452 ( 0.000 0.000 0.000) 0.000 11.468 ( 0.000 0.000 0.000) 0.000 11.867 ( 0.000 0.000 0.000) 0.000 12.074 ( 0.000 0.000 0.000) 0.000 12.942 ( 0.000 0.000 0.000) 0.000 13.163 ( 0.000 0.000 0.000) 0.000 13.220 ( 0.000 0.000 0.000) 0.000 13.640 ( 0.000 0.000 0.000) 0.000 14.072 ( 0.000 0.000 0.000) 0.000 14.120 ( 0.000 0.000 0.000) 0.000 14.349 ( 0.000 0.000 0.000) 0.000 14.624 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/260) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.753 ( 28.201 0.000 26.038) 38.383 0.953 ( 48.179 0.000 7.262) 48.723 1.689 ( 78.357 0.000 26.806) 82.815 4.881 ( 11.297 0.000 -3.755) 11.904 4.881 ( -0.308 0.000 -2.799) 2.816 6.123 ( 1.250 0.000 -3.035) 3.282 6.266 ( 4.921 0.000 -2.762) 5.643 6.473 ( 5.296 0.000 6.110) 8.086 6.899 ( 4.278 0.000 1.318) 4.477 8.245 ( 2.901 0.000 1.892) 3.464 8.665 ( -6.964 0.000 -2.687) 7.465 8.720 ( -2.720 0.000 3.135) 4.151 8.801 ( 1.119 0.000 -3.747) 3.911 8.992 ( -7.388 0.000 -1.954) 7.642 9.100 ( 0.104 0.000 1.456) 1.460 9.719 ( 2.647 0.000 0.666) 2.730 9.742 ( 0.886 0.000 -3.775) 3.878 9.917 ( -2.531 0.000 0.280) 2.546 9.946 ( -7.958 0.000 -3.387) 8.649 10.539 ( -1.400 0.000 -0.350) 1.443 10.696 ( 6.712 0.000 1.645) 6.910 11.057 ( -2.258 0.000 -0.106) 2.261 11.115 ( -5.862 0.000 3.101) 6.632 11.234 ( -9.009 0.000 7.472) 11.704 11.586 ( 7.473 0.000 5.106) 9.051 11.860 ( -1.810 0.000 2.408) 3.013 12.066 ( -0.629 0.000 -0.644) 0.901 12.621 ( -28.728 0.000 52.744) 60.060 12.966 ( 2.141 0.000 0.603) 2.225 13.191 ( 2.379 0.000 1.249) 2.687 13.220 ( -0.638 0.000 1.485) 1.616 13.661 ( 2.998 0.000 -1.947) 3.575 14.127 ( -0.893 0.000 3.273) 3.392 14.333 ( -0.196 0.000 -3.028) 3.034 14.396 ( 15.936 0.000 -35.993) 39.363 14.625 ( 0.508 0.000 -0.803) 0.950 ======================= Grid point 2 (3/260) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.447 ( 24.894 0.000 22.652) 33.657 1.871 ( 45.631 0.000 6.649) 46.113 3.267 ( 67.563 0.000 26.925) 72.730 4.847 ( 2.006 0.000 -6.207) 6.523 5.042 ( 6.546 0.000 -3.779) 7.558 6.195 ( 13.511 0.000 -6.958) 15.197 6.379 ( 11.019 0.000 -4.343) 11.845 6.676 ( 8.986 0.000 10.636) 13.924 7.029 ( 7.873 0.000 2.902) 8.391 8.331 ( 3.817 0.000 2.119) 4.366 8.476 ( -11.968 0.000 0.073) 11.968 8.672 ( -5.911 0.000 1.788) 6.175 8.751 ( -2.197 0.000 -6.285) 6.658 8.799 ( -9.278 0.000 -4.562) 10.339 9.081 ( -6.567 0.000 5.681) 8.683 9.680 ( -5.463 0.000 -4.626) 7.159 9.727 ( -2.870 0.000 -5.305) 6.032 9.836 ( 0.559 0.000 2.804) 2.859 9.871 ( -4.410 0.000 6.476) 7.835 10.490 ( -1.601 0.000 -5.009) 5.259 10.780 ( 0.435 0.000 -2.771) 2.805 11.029 ( -6.125 0.000 4.947) 7.873 11.047 ( 1.325 0.000 3.953) 4.169 11.157 ( -3.329 0.000 0.611) 3.384 11.769 ( 8.761 0.000 2.500) 9.110 11.845 ( -2.750 0.000 4.081) 4.921 12.042 ( -0.894 0.000 -1.700) 1.921 12.517 ( -18.264 0.000 25.945) 31.729 13.020 ( 3.503 0.000 -0.320) 3.518 13.223 ( -1.298 0.000 3.408) 3.647 13.266 ( 4.024 0.000 2.351) 4.660 13.707 ( 4.169 0.000 -3.243) 5.282 14.125 ( -3.147 0.000 3.260) 4.531 14.306 ( 0.785 0.000 -3.236) 3.330 14.383 ( 6.566 0.000 -16.044) 17.335 14.630 ( 1.100 0.000 -1.466) 1.833 ======================= Grid point 3 (4/260) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.024 ( 19.551 0.000 17.226) 26.057 2.721 ( 41.532 0.000 5.684) 41.919 4.308 ( 12.561 0.000 14.461) 19.155 4.980 ( -10.485 0.000 -2.274) 10.729 5.128 ( 44.841 0.000 2.756) 44.926 6.525 ( 28.675 0.000 -10.010) 30.372 6.598 ( 16.871 0.000 -4.468) 17.452 6.969 ( 11.677 0.000 13.368) 17.749 7.224 ( 9.652 0.000 4.703) 10.737 8.201 ( -16.085 0.000 1.108) 16.123 8.432 ( 1.857 0.000 0.999) 2.108 8.473 ( -10.595 0.000 -9.486) 14.221 8.614 ( -5.544 0.000 -7.596) 9.404 8.645 ( -8.613 0.000 3.599) 9.335 8.933 ( -13.666 0.000 3.394) 14.081 9.447 ( -13.981 0.000 -6.499) 15.418 9.652 ( -0.792 0.000 -0.754) 1.094 9.882 ( -3.527 0.000 13.048) 13.516 9.907 ( 3.023 0.000 1.949) 3.596 10.397 ( -1.048 0.000 -11.121) 11.170 10.676 ( -6.368 0.000 -4.724) 7.929 10.988 ( -2.727 0.000 4.095) 4.920 11.121 ( -1.213 0.000 0.835) 1.473 11.155 ( 4.419 0.000 5.497) 7.053 11.832 ( -2.445 0.000 4.375) 5.012 11.942 ( 8.744 0.000 0.343) 8.751 12.008 ( -0.659 0.000 -2.733) 2.812 12.401 ( -13.679 0.000 16.637) 21.538 13.083 ( 3.965 0.000 -1.338) 4.185 13.226 ( -1.949 0.000 4.338) 4.756 13.372 ( 4.902 0.000 3.256) 5.885 13.752 ( 3.748 0.000 -3.426) 5.078 14.054 ( -5.243 0.000 -1.081) 5.353 14.317 ( 1.491 0.000 0.191) 1.503 14.369 ( 3.187 0.000 -8.347) 8.935 14.641 ( 1.487 0.000 -1.656) 2.226 ======================= Grid point 4 (5/260) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.428 ( 11.584 0.000 9.713) 15.117 3.473 ( 35.758 0.000 4.479) 36.037 4.327 ( -5.510 0.000 0.904) 5.583 4.658 ( -21.574 0.000 -2.401) 21.707 6.139 ( 44.918 0.000 11.424) 46.348 6.925 ( 22.979 0.000 -1.934) 23.060 6.968 ( 24.614 0.000 -7.998) 25.881 7.301 ( 12.156 0.000 11.035) 16.418 7.446 ( 9.201 0.000 6.065) 11.020 7.902 ( -18.030 0.000 2.329) 18.180 8.195 ( -9.881 0.000 -9.829) 13.937 8.236 ( -17.083 0.000 -11.050) 20.345 8.506 ( -8.652 0.000 2.578) 9.028 8.589 ( 3.834 0.000 1.365) 4.070 8.672 ( -14.886 0.000 0.119) 14.886 9.127 ( -13.599 0.000 -4.444) 14.306 9.684 ( 2.570 0.000 2.861) 3.845 9.947 ( 0.126 0.000 -0.123) 0.176 9.950 ( -2.130 0.000 14.630) 14.785 10.277 ( -0.179 0.000 -13.824) 13.825 10.523 ( -5.520 0.000 -3.295) 6.429 10.984 ( -0.798 0.000 2.013) 2.165 11.121 ( -0.041 0.000 1.074) 1.075 11.264 ( 2.772 0.000 3.684) 4.611 11.828 ( -1.351 0.000 2.956) 3.250 11.977 ( -0.223 0.000 -2.434) 2.445 12.088 ( 8.087 0.000 -2.419) 8.441 12.299 ( -10.079 0.000 10.802) 14.774 13.141 ( 3.934 0.000 -2.174) 4.495 13.219 ( -2.792 0.000 4.105) 4.965 13.491 ( 4.675 0.000 3.379) 5.768 13.784 ( 2.221 0.000 -2.223) 3.142 13.936 ( -5.111 0.000 -2.958) 5.905 14.347 ( 0.886 0.000 1.037) 1.364 14.360 ( 1.353 0.000 -3.654) 3.896 14.654 ( 1.135 0.000 -1.096) 1.577 ======================= Grid point 5 (6/260) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.581 ( 0.000 0.000 0.000) 0.000 3.998 ( -0.000 0.000 0.000) 0.000 4.269 ( 0.000 0.000 0.000) 0.000 4.269 ( 0.000 0.000 0.000) 0.000 6.631 ( -0.000 0.000 0.000) 0.000 7.177 ( 0.000 0.000 0.000) 0.000 7.471 ( -0.000 0.000 -0.000) 0.000 7.473 ( 0.000 0.000 0.000) 0.000 7.494 ( 0.000 0.000 0.000) 0.000 7.595 ( 0.000 0.000 0.000) 0.000 7.935 ( 0.000 0.000 0.000) 0.000 8.025 ( 0.000 0.000 -0.000) 0.000 8.429 ( 0.000 0.000 0.000) 0.000 8.497 ( 0.000 0.000 0.000) 0.000 8.651 ( 0.000 0.000 0.000) 0.000 8.962 ( 0.000 0.000 0.000) 0.000 9.740 ( 0.000 0.000 0.000) 0.000 9.931 ( 0.000 0.000 0.000) 0.000 10.011 ( 0.000 0.000 0.000) 0.000 10.199 ( 0.000 0.000 -0.000) 0.000 10.454 ( 0.000 0.000 -0.000) 0.000 10.986 ( 0.000 0.000 -0.000) 0.000 11.127 ( 0.000 0.000 0.000) 0.000 11.306 ( 0.000 0.000 0.000) 0.000 11.829 ( 0.000 0.000 0.000) 0.000 11.964 ( 0.000 0.000 -0.000) 0.000 12.184 ( 0.000 0.000 -0.000) 0.000 12.221 ( -0.000 0.000 0.000) 0.000 13.181 ( 0.000 0.000 -0.000) 0.000 13.198 ( -0.000 0.000 0.000) 0.000 13.562 ( 0.000 0.000 0.000) 0.000 13.795 ( 0.000 0.000 -0.000) 0.000 13.862 ( 0.000 0.000 0.000) 0.000 14.358 ( 0.000 0.000 0.000) 0.000 14.360 ( 0.000 0.000 -0.000) 0.000 14.661 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 11 (7/260) ======================= q-point: ( 0.00 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.882 ( 0.000 43.565 0.000) 43.565 1.189 ( 0.000 57.936 0.000) 57.936 1.859 ( 0.000 90.023 0.000) 90.023 4.919 ( 0.000 13.029 0.000) 13.029 5.033 ( 0.000 13.238 0.000) 13.238 6.211 ( 0.000 -16.157 0.000) 16.157 6.236 ( 0.000 9.820 0.000) 9.820 6.348 ( 0.000 9.653 0.000) 9.653 6.898 ( 0.000 -11.549 0.000) 11.549 8.223 ( 0.000 -0.480 0.000) 0.480 8.658 ( 0.000 -7.149 0.000) 7.149 8.701 ( 0.000 -3.373 0.000) 3.373 8.752 ( 0.000 -0.223 0.000) 0.223 8.965 ( 0.000 -9.483 0.000) 9.483 9.200 ( 0.000 2.771 0.000) 2.771 9.655 ( 0.000 -7.774 0.000) 7.774 9.738 ( 0.000 -1.866 0.000) 1.866 9.908 ( 0.000 -2.881 0.000) 2.881 9.923 ( 0.000 -10.709 0.000) 10.709 10.501 ( 0.000 0.186 0.000) 0.186 10.794 ( 0.000 6.449 0.000) 6.449 10.868 ( 0.000 -3.727 0.000) 3.727 11.076 ( 0.000 -0.374 0.000) 0.374 11.166 ( 0.000 -0.388 0.000) 0.388 11.458 ( 0.000 -0.830 0.000) 0.830 11.515 ( 0.000 5.557 0.000) 5.557 12.076 ( 0.000 0.157 0.000) 0.157 12.315 ( 0.000 -1.930 0.000) 1.930 12.964 ( 0.000 2.015 0.000) 2.015 13.235 ( 0.000 1.213 0.000) 1.213 13.392 ( 0.000 4.689 0.000) 4.689 13.695 ( 0.000 5.303 0.000) 5.303 14.074 ( 0.000 0.397 0.000) 0.397 14.330 ( 0.000 -1.778 0.000) 1.778 14.621 ( 0.000 -0.393 0.000) 0.393 14.736 ( 0.000 -2.087 0.000) 2.087 ======================= Grid point 12 (8/260) ======================= q-point: ( 0.10 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.309 ( 16.372 40.675 20.135) 48.249 1.648 ( 35.207 40.625 15.803) 56.033 2.331 ( 49.017 63.924 8.062) 80.956 4.982 ( 3.479 11.250 -1.695) 11.897 5.049 ( 7.472 14.616 -5.310) 17.253 6.188 ( -1.049 2.499 -0.635) 2.784 6.299 ( 4.835 -7.279 2.817) 9.181 6.408 ( 7.596 8.211 -1.648) 11.307 6.860 ( 0.716 -7.056 -0.110) 7.093 8.257 ( 2.369 -1.069 2.083) 3.331 8.609 ( -3.762 -5.659 -2.030) 7.092 8.675 ( -3.890 -4.095 0.633) 5.684 8.740 ( -1.863 -1.861 1.008) 2.819 8.896 ( -4.824 -8.296 -4.795) 10.728 9.167 ( -3.011 2.673 2.940) 4.985 9.664 ( 0.388 -7.222 -0.641) 7.261 9.716 ( 0.558 -2.184 -2.570) 3.419 9.817 ( -6.971 -6.991 0.802) 9.905 9.898 ( -0.694 -4.280 -2.393) 4.952 10.605 ( -3.787 2.052 -0.532) 4.340 10.653 ( 6.562 0.058 5.365) 8.476 11.005 ( -4.010 -1.155 -1.276) 4.363 11.148 ( -1.337 -0.311 -0.432) 1.439 11.275 ( -6.749 2.065 13.428) 15.170 11.483 ( 8.707 -11.330 12.881) 19.238 11.668 ( 9.846 -3.585 -1.210) 10.548 12.054 ( -3.636 -0.187 4.172) 5.537 12.404 ( 0.025 -7.319 13.721) 15.551 12.973 ( 1.650 1.907 -1.203) 2.794 13.233 ( -0.314 1.165 0.168) 1.219 13.362 ( -3.505 7.724 4.221) 9.474 13.715 ( 2.945 5.202 -2.054) 6.321 14.100 ( 2.061 -0.560 -0.049) 2.136 14.309 ( -0.599 -1.730 -3.416) 3.876 14.559 ( -3.094 4.292 -11.231) 12.415 14.638 ( 0.496 1.493 -4.516) 4.782 ======================= Grid point 13 (9/260) ======================= q-point: ( 0.20 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( 18.593 32.031 21.244) 42.696 2.384 ( 35.424 39.846 8.362) 53.968 3.538 ( 59.931 28.250 20.891) 69.470 4.972 ( 2.150 12.210 -5.440) 13.539 5.196 ( 8.181 14.508 -5.059) 17.407 6.214 ( 8.223 2.213 -4.389) 9.580 6.451 ( 9.321 -3.746 2.908) 10.458 6.610 ( 14.776 4.059 0.922) 15.351 6.944 ( 6.427 -8.363 2.945) 10.951 8.314 ( 0.528 -5.039 1.276) 5.225 8.493 ( -8.843 1.857 1.649) 9.185 8.560 ( -6.451 -8.081 -2.817) 10.717 8.692 ( -2.847 -5.858 -5.918) 8.800 8.750 ( -6.933 -2.443 0.369) 7.360 9.122 ( -6.870 1.194 5.240) 8.723 9.575 ( -9.031 -9.160 0.906) 12.895 9.653 ( -1.538 -7.344 -9.117) 11.808 9.802 ( 0.579 -3.328 2.636) 4.285 9.894 ( 0.129 2.812 5.360) 6.054 10.527 ( -3.178 2.694 -2.936) 5.097 10.792 ( 2.759 0.387 -1.197) 3.033 10.909 ( -3.467 -3.954 1.231) 5.401 11.128 ( -0.450 -0.396 0.135) 0.614 11.204 ( -5.943 6.226 5.815) 10.387 11.694 ( 3.524 -8.562 9.301) 13.124 11.790 ( 5.453 -2.402 -0.644) 5.994 12.025 ( -2.936 -0.693 3.318) 4.484 12.460 ( -7.759 -4.843 16.081) 18.500 13.006 ( 3.419 0.550 -2.002) 4.000 13.226 ( -1.052 0.910 1.429) 1.994 13.370 ( 0.432 6.922 4.262) 8.140 13.759 ( 4.133 5.027 -3.330) 7.310 14.114 ( -2.376 -0.881 1.834) 3.128 14.275 ( 1.994 -1.753 -5.531) 6.135 14.449 ( 0.430 3.696 -9.307) 10.023 14.630 ( 0.919 -0.111 -1.980) 2.186 ======================= Grid point 14 (10/260) ======================= q-point: ( 0.30 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.300 ( 16.608 25.606 17.220) 35.044 3.095 ( 35.502 32.387 5.823) 48.407 4.449 ( 10.569 14.067 12.039) 21.320 5.133 ( -3.773 14.418 -0.609) 14.916 5.288 ( 38.137 15.897 0.952) 41.329 6.451 ( 21.997 -2.539 -7.733) 23.455 6.696 ( 13.859 -2.441 4.911) 14.905 6.947 ( 20.401 4.446 1.018) 20.905 7.122 ( 9.016 -8.820 5.000) 13.567 8.213 ( -10.994 -2.108 -0.869) 11.227 8.276 ( -13.255 -10.226 -3.256) 17.055 8.487 ( -3.219 -2.722 -8.323) 9.330 8.546 ( -2.246 -3.522 -2.239) 4.739 8.654 ( -8.271 0.981 5.091) 9.761 8.976 ( -12.802 2.108 3.127) 13.346 9.392 ( -13.212 -4.597 -3.491) 14.418 9.534 ( -1.236 -10.358 -3.238) 10.922 9.851 ( 0.129 -2.542 8.333) 8.713 9.955 ( 0.221 3.684 4.909) 6.142 10.439 ( -1.033 3.467 -8.615) 9.344 10.687 ( -6.579 0.988 -5.339) 8.530 10.947 ( 1.364 -3.507 3.998) 5.490 11.102 ( -2.816 -0.722 1.356) 3.208 11.222 ( 2.124 4.974 5.102) 7.435 11.771 ( -0.853 -5.543 6.046) 8.247 11.893 ( 5.356 -3.536 -1.871) 6.685 12.016 ( 0.679 0.390 2.023) 2.169 12.412 ( -9.905 -0.269 12.422) 15.889 13.060 ( 4.095 -1.097 -1.977) 4.678 13.220 ( -1.701 0.145 2.919) 3.382 13.438 ( 2.898 4.831 3.940) 6.875 13.803 ( 3.682 4.889 -3.401) 7.002 14.038 ( -5.333 -1.591 -1.556) 5.779 14.295 ( 3.124 -1.149 -2.238) 4.011 14.401 ( 0.519 1.933 -4.977) 5.364 14.635 ( 1.284 -0.651 -1.737) 2.256 ======================= Grid point 15 (11/260) ======================= q-point: ( 0.40 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.670 ( 10.448 22.714 10.013) 26.932 3.762 ( 32.347 26.242 4.371) 41.882 4.452 ( -5.375 12.231 0.218) 13.362 4.850 ( -20.463 18.024 -1.957) 27.339 6.235 ( 42.488 9.449 10.641) 44.808 6.818 ( 23.937 -4.928 -7.136) 25.459 7.021 ( 14.497 -3.230 9.260) 17.503 7.291 ( 11.110 -8.703 4.669) 14.865 7.377 ( 17.917 4.573 -0.982) 18.517 7.942 ( -18.277 1.477 0.864) 18.357 8.026 ( -8.028 -10.678 -6.874) 15.024 8.222 ( -12.540 -5.287 -12.621) 18.561 8.512 ( -8.768 0.706 2.385) 9.114 8.578 ( -1.248 0.272 3.734) 3.946 8.741 ( -12.667 4.656 1.077) 13.539 9.075 ( -13.818 -4.809 -5.513) 15.635 9.558 ( 2.237 -10.533 3.056) 11.193 9.932 ( 0.872 -0.687 3.191) 3.379 9.976 ( -1.678 1.329 8.572) 8.836 10.337 ( -0.989 4.354 -12.143) 12.938 10.541 ( -4.661 2.083 -2.141) 5.536 10.993 ( 0.942 -0.145 1.948) 2.169 11.073 ( -1.535 -2.840 1.448) 3.538 11.307 ( 2.375 3.493 3.277) 5.346 11.798 ( -0.596 -3.109 3.984) 5.089 11.914 ( 0.393 -4.351 -2.586) 5.077 12.103 ( 6.627 0.285 -0.441) 6.648 12.323 ( -9.044 1.331 8.142) 12.242 13.117 ( 3.831 -2.085 -1.962) 4.782 13.209 ( -2.420 -0.122 3.111) 3.943 13.532 ( 3.596 3.133 3.524) 5.930 13.834 ( 2.120 4.715 -2.113) 5.585 13.918 ( -4.997 -1.718 -3.135) 6.144 14.333 ( 2.091 -0.683 -0.801) 2.341 14.378 ( -0.104 1.039 -1.698) 1.993 14.645 ( 1.014 -0.937 -1.081) 1.754 ======================= Grid point 16 (12/260) ======================= q-point: (-0.50 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.814 ( -0.000 21.992 0.000) 21.992 4.255 ( 0.000 23.958 0.000) 23.958 4.396 ( -0.000 12.280 0.000) 12.280 4.470 ( -0.000 18.636 -0.000) 18.636 6.692 ( -0.000 5.900 -0.000) 5.900 7.065 ( 0.000 -8.248 0.000) 8.248 7.403 ( -0.000 -3.367 -0.000) 3.367 7.429 ( 0.000 -13.087 -0.000) 13.087 7.572 ( -0.000 3.801 0.000) 3.801 7.588 ( 0.000 4.367 -0.000) 4.367 7.921 ( 0.000 -8.752 -0.000) 8.752 7.980 ( 0.000 3.952 -0.000) 3.952 8.424 ( 0.000 0.327 0.000) 0.327 8.508 ( 0.000 2.629 -0.000) 2.629 8.673 ( 0.000 0.900 0.000) 0.900 8.905 ( 0.000 -5.938 -0.000) 5.938 9.606 ( -0.000 -10.755 0.000) 10.755 9.921 ( 0.000 -0.320 0.000) 0.320 10.044 ( 0.000 2.234 -0.000) 2.234 10.244 ( 0.000 2.294 0.000) 2.294 10.493 ( 0.000 4.134 -0.000) 4.134 11.011 ( 0.000 2.244 -0.000) 2.244 11.066 ( 0.000 -5.031 0.000) 5.031 11.344 ( 0.000 3.134 0.000) 3.134 11.812 ( 0.000 -1.988 0.000) 1.988 11.902 ( -0.000 -4.633 0.000) 4.633 12.210 ( 0.000 -1.061 -0.000) 1.061 12.228 ( -0.000 2.644 0.000) 2.644 13.153 ( 0.000 -3.397 -0.000) 3.397 13.191 ( -0.000 0.879 -0.000) 0.879 13.594 ( 0.000 2.457 0.000) 2.457 13.843 ( -0.000 -1.885 -0.000) 1.885 13.846 ( 0.000 4.843 0.000) 4.843 14.352 ( 0.000 -0.444 -0.000) 0.444 14.368 ( 0.000 0.687 -0.000) 0.687 14.650 ( 0.000 -1.032 0.000) 1.032 ======================= Grid point 22 (13/260) ======================= q-point: ( 0.00 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.766 ( 0.000 43.600 0.000) 43.600 2.334 ( 0.000 54.719 0.000) 54.719 3.611 ( 0.000 81.678 0.000) 81.678 5.281 ( 0.000 21.860 0.000) 21.860 5.396 ( 0.000 19.891 0.000) 19.891 5.765 ( 0.000 -24.673 0.000) 24.673 6.511 ( 0.000 16.552 0.000) 16.552 6.536 ( 0.000 -13.449 0.000) 13.449 6.655 ( 0.000 9.011 0.000) 9.011 8.101 ( 0.000 -11.005 0.000) 11.005 8.512 ( 0.000 -16.291 0.000) 16.291 8.601 ( 0.000 1.448 0.000) 1.448 8.714 ( 0.000 -4.319 0.000) 4.319 8.818 ( 0.000 -3.091 0.000) 3.091 9.160 ( 0.000 -7.970 0.000) 7.970 9.409 ( 0.000 -16.053 0.000) 16.053 9.673 ( 0.000 -13.559 0.000) 13.559 9.720 ( 0.000 1.017 0.000) 1.017 9.820 ( 0.000 -5.571 0.000) 5.571 10.446 ( 0.000 -4.858 0.000) 4.858 10.842 ( 0.000 1.569 0.000) 1.569 10.941 ( 0.000 5.210 0.000) 5.210 11.096 ( 0.000 3.795 0.000) 3.795 11.137 ( 0.000 -1.919 0.000) 1.919 11.443 ( 0.000 -0.403 0.000) 0.403 11.633 ( 0.000 5.078 0.000) 5.078 12.080 ( 0.000 0.265 0.000) 0.265 12.267 ( 0.000 -2.650 0.000) 2.650 13.016 ( 0.000 3.066 0.000) 3.066 13.252 ( 0.000 0.187 0.000) 0.187 13.516 ( 0.000 7.081 0.000) 7.081 13.842 ( 0.000 8.741 0.000) 8.741 14.091 ( 0.000 0.966 0.000) 0.966 14.281 ( 0.000 -2.698 0.000) 2.698 14.605 ( 0.000 -1.279 0.000) 1.279 14.679 ( 0.000 -3.441 0.000) 3.441 ======================= Grid point 23 (14/260) ======================= q-point: ( 0.10 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.109 ( 20.888 38.119 16.392) 46.455 2.541 ( 19.178 47.789 10.799) 52.614 3.819 ( 21.823 75.086 2.107) 78.222 5.301 ( 2.427 18.026 -1.610) 18.260 5.446 ( 8.282 23.742 -6.720) 26.028 5.842 ( 5.531 -23.968 6.152) 25.356 6.472 ( -2.479 14.765 -1.828) 15.083 6.560 ( 2.611 -14.382 0.951) 14.648 6.723 ( 7.867 12.996 -1.647) 15.281 8.104 ( -0.467 -12.815 0.611) 12.838 8.468 ( -2.304 -15.614 -4.572) 16.432 8.579 ( -2.326 0.813 0.177) 2.470 8.689 ( -3.081 -3.375 -0.624) 4.612 8.793 ( -3.524 -1.316 2.789) 4.683 9.118 ( -4.139 -7.912 1.950) 9.140 9.433 ( 2.965 -15.575 -2.692) 16.082 9.546 ( -9.743 -11.857 0.246) 15.349 9.733 ( -2.220 -6.057 -6.247) 8.980 9.843 ( 5.821 2.132 5.831) 8.511 10.573 ( 6.293 -3.599 6.320) 9.617 10.705 ( -7.770 2.966 4.035) 9.244 11.033 ( -3.596 2.342 -4.716) 6.376 11.137 ( -0.364 0.478 -0.210) 0.636 11.219 ( 11.865 -4.098 12.692) 17.851 11.398 ( -5.394 0.672 3.740) 6.598 11.684 ( 5.413 2.565 -1.978) 6.308 12.055 ( -4.152 0.148 4.225) 5.926 12.301 ( 2.043 -4.083 1.959) 4.968 13.026 ( 1.224 3.105 -0.480) 3.372 13.250 ( -0.474 0.203 0.513) 0.728 13.510 ( -1.264 7.301 1.728) 7.609 13.859 ( 2.692 8.528 -2.138) 9.195 14.101 ( 0.536 0.095 0.429) 0.693 14.265 ( 0.107 -2.058 -3.511) 4.071 14.572 ( -2.969 -1.171 -2.130) 3.837 14.643 ( -0.529 -1.500 -3.860) 4.175 ======================= Grid point 24 (15/260) ======================= q-point: ( 0.20 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.570 ( 14.759 39.982 17.332) 46.008 3.160 ( 31.184 35.573 14.460) 49.467 4.412 ( 34.478 53.558 9.103) 64.343 5.326 ( 4.348 21.806 -3.817) 22.560 5.581 ( 11.893 21.022 -8.156) 25.493 6.045 ( 8.206 -18.915 10.040) 22.933 6.437 ( 3.664 9.557 -4.932) 11.362 6.659 ( 6.072 -15.302 3.441) 16.818 6.919 ( 16.066 16.378 -3.287) 23.177 8.063 ( -4.887 -16.999 -0.713) 17.702 8.361 ( -2.764 -13.538 -9.232) 16.618 8.539 ( -3.117 0.083 3.382) 4.600 8.570 ( -8.287 -2.675 -3.405) 9.350 8.750 ( -5.335 1.122 6.118) 8.194 9.061 ( -4.692 -7.043 2.339) 8.780 9.359 ( -9.812 -11.343 1.910) 15.119 9.443 ( 0.672 -12.878 -5.668) 14.086 9.690 ( 0.935 -7.996 -1.049) 8.118 9.997 ( 3.815 7.084 7.398) 10.930 10.585 ( -4.831 3.403 0.005) 5.910 10.744 ( 3.630 -4.572 5.530) 8.041 10.901 ( -5.505 1.527 -5.711) 8.078 11.125 ( -0.757 0.603 -0.034) 0.968 11.324 ( -4.612 5.197 5.523) 8.876 11.496 ( 5.451 -8.954 11.338) 15.442 11.769 ( 5.185 -0.061 -1.772) 5.480 12.018 ( -3.656 -0.157 4.773) 6.014 12.348 ( -0.937 -5.849 5.815) 8.301 13.049 ( 2.022 3.095 -1.433) 3.965 13.242 ( -1.158 0.309 1.108) 1.632 13.508 ( -0.849 6.593 2.910) 7.257 13.897 ( 3.762 7.984 -3.331) 9.434 14.086 ( -3.210 -2.082 -0.005) 3.826 14.251 ( 2.859 -0.150 -4.571) 5.393 14.487 ( -2.419 0.115 -4.157) 4.811 14.617 ( 0.335 -1.428 -2.386) 2.800 ======================= Grid point 25 (16/260) ======================= q-point: ( 0.30 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.964 ( 13.015 37.527 15.471) 42.626 3.816 ( 29.355 34.798 9.679) 46.544 4.877 ( 2.412 27.348 4.890) 27.887 5.539 ( 3.960 24.778 1.090) 25.116 5.752 ( 30.258 28.515 -1.113) 41.592 6.314 ( 13.696 -15.956 9.274) 22.982 6.580 ( 16.430 0.670 -5.848) 17.453 6.826 ( 7.466 -15.425 5.788) 18.088 7.246 ( 22.713 16.424 -4.991) 28.470 7.903 ( -9.452 -19.649 -4.859) 22.339 8.231 ( -3.785 -6.924 -7.019) 10.561 8.329 ( -13.583 -4.164 -6.141) 15.477 8.518 ( -2.970 -3.852 3.846) 6.201 8.689 ( -6.970 1.901 5.747) 9.232 8.949 ( -9.288 -4.601 1.214) 10.436 9.281 ( -0.653 -11.211 2.317) 11.467 9.315 ( -9.648 -4.591 -5.724) 12.121 9.756 ( 3.806 -7.446 5.671) 10.104 10.057 ( -3.293 6.433 4.635) 8.586 10.515 ( -0.560 3.779 -5.094) 6.367 10.708 ( -6.587 0.738 -4.258) 7.879 10.868 ( 2.211 -3.515 3.821) 5.643 11.102 ( -2.401 0.459 1.412) 2.823 11.328 ( 0.590 4.854 4.017) 6.328 11.637 ( 1.353 -6.707 8.603) 10.992 11.832 ( 3.163 -2.220 -2.583) 4.648 12.017 ( 0.233 -0.363 3.664) 3.690 12.354 ( -4.548 -5.270 7.430) 10.182 13.073 ( 2.334 2.336 -2.382) 4.072 13.228 ( -1.668 0.309 1.910) 2.555 13.534 ( 0.744 4.412 3.550) 5.711 13.930 ( 2.047 5.517 -3.084) 6.643 13.996 ( -4.096 -0.989 -2.809) 5.065 14.287 ( 3.548 0.475 -2.258) 4.233 14.426 ( -1.114 0.436 -2.754) 3.002 14.611 ( 0.887 -1.811 -1.837) 2.729 ======================= Grid point 26 (17/260) ======================= q-point: ( 0.40 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.278 ( 8.746 35.381 9.799) 37.741 4.399 ( 27.349 33.042 5.872) 43.292 4.815 ( -5.504 23.332 -1.136) 24.000 5.334 ( -18.021 28.149 -1.783) 33.471 6.513 ( 33.404 16.373 8.810) 38.230 6.676 ( 17.100 -12.482 4.653) 21.676 6.900 ( 22.320 -4.024 -0.618) 22.688 6.998 ( 4.322 -15.175 7.249) 17.364 7.573 ( 8.918 1.293 -9.770) 13.291 7.714 ( 2.029 -6.896 -2.998) 7.788 7.981 ( -17.603 -6.061 -7.641) 20.124 8.119 ( -2.767 0.132 -3.805) 4.707 8.490 ( -2.227 -4.250 1.476) 5.020 8.606 ( -6.772 1.497 5.857) 9.078 8.776 ( -9.011 -2.625 0.425) 9.395 8.998 ( -17.108 -0.499 -6.597) 18.343 9.344 ( 2.176 -8.467 4.828) 9.987 9.894 ( 4.591 -4.064 4.972) 7.894 10.004 ( -3.362 1.790 3.744) 5.341 10.400 ( -4.991 1.253 -11.342) 12.455 10.618 ( -1.497 5.449 1.036) 5.745 10.932 ( 1.685 -4.330 2.195) 5.139 11.074 ( -1.822 1.621 1.541) 2.885 11.383 ( 1.813 3.412 2.094) 4.395 11.711 ( 0.281 -4.756 6.356) 7.943 11.834 ( 0.380 -3.306 -3.686) 4.966 12.091 ( 5.004 -1.393 1.311) 5.357 12.308 ( -6.437 -3.351 5.646) 9.194 13.093 ( 1.855 0.393 -2.004) 2.759 13.216 ( -1.374 0.526 1.849) 2.363 13.591 ( 1.990 2.272 3.500) 4.624 13.857 ( -4.545 -3.629 -3.286) 6.680 13.971 ( 1.674 7.847 -2.192) 8.318 14.329 ( 2.310 0.451 -0.959) 2.542 14.396 ( -0.639 0.649 -1.012) 1.362 14.615 ( 0.798 -2.056 -1.101) 2.465 ======================= Grid point 27 (18/260) ======================= q-point: (-0.50 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.407 ( -0.000 34.768 0.000) 34.768 4.743 ( -0.000 21.520 0.000) 21.520 4.885 ( 0.000 35.438 0.000) 35.438 4.952 ( -0.000 26.995 -0.000) 26.995 6.859 ( 0.000 9.978 -0.000) 9.978 6.886 ( -0.000 -9.775 0.000) 9.775 7.061 ( 0.000 -21.458 -0.000) 21.458 7.324 ( -0.000 -4.905 -0.000) 4.905 7.475 ( 0.000 -16.790 0.000) 16.790 7.601 ( 0.000 -0.955 0.000) 0.955 7.878 ( -0.000 6.421 0.000) 6.421 8.084 ( 0.000 5.374 -0.000) 5.374 8.477 ( 0.000 5.276 -0.000) 5.276 8.561 ( 0.000 -2.202 0.000) 2.202 8.714 ( 0.000 7.129 0.000) 7.129 8.720 ( -0.000 -11.775 -0.000) 11.775 9.393 ( -0.000 -8.628 0.000) 8.628 9.919 ( 0.000 -0.418 0.000) 0.418 10.070 ( 0.000 -0.130 -0.000) 0.130 10.250 ( -0.000 -1.556 0.000) 1.556 10.615 ( 0.000 7.127 -0.000) 7.127 10.958 ( 0.000 -5.001 0.000) 5.001 11.063 ( 0.000 2.647 -0.000) 2.647 11.410 ( 0.000 2.763 0.000) 2.763 11.748 ( 0.000 -3.647 0.000) 3.647 11.811 ( -0.000 -3.982 0.000) 3.982 12.176 ( 0.000 -2.435 -0.000) 2.435 12.241 ( -0.000 -1.882 0.000) 1.882 13.103 ( 0.000 -0.904 0.000) 0.904 13.211 ( 0.000 0.934 -0.000) 0.934 13.638 ( 0.000 1.523 0.000) 1.523 13.785 ( 0.000 -3.790 0.000) 3.790 13.978 ( 0.000 7.881 -0.000) 7.881 14.348 ( 0.000 0.325 -0.000) 0.325 14.384 ( 0.000 0.869 -0.000) 0.869 14.618 ( 0.000 -2.148 0.000) 2.148 ======================= Grid point 33 (19/260) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.646 ( 0.000 43.189 0.000) 43.189 3.396 ( 0.000 49.749 0.000) 49.749 5.049 ( 0.000 35.729 0.000) 35.729 5.094 ( 0.000 -17.525 0.000) 17.525 5.768 ( 0.000 25.278 0.000) 25.278 5.946 ( 0.000 20.858 0.000) 20.858 6.170 ( 0.000 -4.358 0.000) 4.358 6.848 ( 0.000 14.149 0.000) 14.149 6.913 ( 0.000 7.615 0.000) 7.615 7.903 ( 0.000 -4.527 0.000) 4.527 8.140 ( 0.000 -17.352 0.000) 17.352 8.507 ( 0.000 -19.212 0.000) 19.212 8.637 ( 0.000 -0.220 0.000) 0.220 8.778 ( 0.000 -2.208 0.000) 2.208 8.914 ( 0.000 -13.445 0.000) 13.445 9.052 ( 0.000 -17.527 0.000) 17.527 9.413 ( 0.000 -9.881 0.000) 9.881 9.631 ( 0.000 -9.076 0.000) 9.076 9.842 ( 0.000 6.855 0.000) 6.855 10.325 ( 0.000 -6.842 0.000) 6.842 10.911 ( 0.000 4.145 0.000) 4.145 10.978 ( 0.000 0.100 0.000) 0.100 11.112 ( 0.000 0.072 0.000) 0.072 11.210 ( 0.000 4.540 0.000) 4.540 11.460 ( 0.000 2.791 0.000) 2.791 11.694 ( 0.000 0.716 0.000) 0.716 12.088 ( 0.000 0.632 0.000) 0.632 12.211 ( 0.000 -2.888 0.000) 2.888 13.086 ( 0.000 3.673 0.000) 3.673 13.240 ( 0.000 -1.218 0.000) 1.218 13.665 ( 0.000 7.413 0.000) 7.413 14.029 ( 0.000 9.201 0.000) 9.201 14.074 ( 0.000 -3.644 0.000) 3.644 14.255 ( 0.000 0.665 0.000) 0.665 14.568 ( 0.000 -2.286 0.000) 2.286 14.605 ( 0.000 -3.623 0.000) 3.623 ======================= Grid point 34 (20/260) ======================= q-point: ( 0.10 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.886 ( 18.015 38.774 11.882) 44.375 3.513 ( 9.983 46.929 6.789) 48.457 5.135 ( 7.179 2.383 3.235) 8.227 5.187 ( 9.344 14.428 3.219) 17.488 5.841 ( 4.102 21.776 1.803) 22.232 5.960 ( 7.368 21.282 -7.391) 23.703 6.223 ( 5.265 -1.073 1.246) 5.515 6.795 ( -4.443 13.683 0.083) 14.386 7.000 ( 8.831 7.990 -1.393) 11.990 7.864 ( -5.478 -7.505 1.963) 9.497 8.122 ( 2.886 -14.661 -9.582) 17.751 8.500 ( -1.921 -15.427 1.522) 15.621 8.598 ( -4.683 -5.337 0.058) 7.101 8.785 ( -1.157 0.123 4.502) 4.650 8.903 ( -0.418 -10.725 -0.427) 10.741 9.074 ( 3.002 -17.932 -1.852) 18.276 9.317 ( -8.520 -8.843 0.240) 12.282 9.558 ( -3.011 -9.808 -6.475) 12.133 9.955 ( 7.115 7.516 8.141) 13.168 10.455 ( 6.440 -7.297 9.878) 13.867 10.796 ( -8.008 5.600 2.451) 10.074 11.055 ( -3.528 -0.020 -3.742) 5.143 11.108 ( 3.681 -2.256 5.753) 7.193 11.218 ( 1.894 0.930 -1.184) 2.419 11.453 ( -1.620 5.256 3.543) 6.542 11.721 ( 3.358 0.437 -1.787) 3.829 12.062 ( -3.848 0.700 3.140) 5.015 12.221 ( 0.870 -3.914 -0.273) 4.019 13.095 ( 0.846 3.566 0.253) 3.674 13.240 ( -0.452 -1.123 0.765) 1.432 13.658 ( -0.950 7.145 0.286) 7.214 14.026 ( -0.105 3.961 -1.426) 4.211 14.079 ( 1.133 0.765 -0.889) 1.631 14.257 ( 1.609 1.419 -2.612) 3.380 14.535 ( -2.809 -2.229 -1.007) 3.725 14.591 ( -0.411 -3.282 -1.937) 3.834 ======================= Grid point 35 (21/260) ======================= q-point: ( 0.20 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.357 ( 17.719 37.011 15.021) 43.697 3.888 ( 22.116 37.001 12.187) 44.797 5.358 ( 11.800 -2.210 6.264) 13.541 5.453 ( 12.677 12.284 6.526) 18.820 5.882 ( 3.915 15.784 0.124) 16.263 6.144 ( 16.031 20.792 -7.548) 27.318 6.385 ( 11.234 8.547 1.294) 14.175 6.705 ( -4.312 12.238 -0.453) 12.983 7.203 ( 15.004 6.044 -2.756) 16.409 7.731 ( -9.555 -12.438 -0.350) 15.688 8.098 ( 5.229 -8.661 -13.698) 17.030 8.429 ( -8.194 -11.431 0.693) 14.082 8.489 ( -6.214 -8.866 0.909) 10.865 8.784 ( -5.122 1.949 6.055) 8.167 8.894 ( -0.099 -8.606 -1.297) 8.704 9.113 ( -0.112 -14.054 -2.740) 14.320 9.190 ( -2.844 -8.197 5.005) 10.016 9.486 ( 0.987 -11.294 -4.243) 12.105 10.161 ( 4.916 8.557 9.858) 13.949 10.623 ( 0.850 -5.656 6.262) 8.481 10.687 ( -3.828 5.220 2.983) 7.127 10.930 ( -5.219 1.146 -5.447) 7.630 11.136 ( -2.148 0.061 1.538) 2.642 11.286 ( 0.480 -7.487 8.247) 11.149 11.490 ( 2.609 6.895 3.338) 8.092 11.771 ( 3.525 -0.300 -2.260) 4.198 12.019 ( -3.838 0.403 4.165) 5.678 12.228 ( -0.852 -5.881 1.844) 6.222 13.117 ( 1.358 3.415 -0.084) 3.676 13.236 ( -0.911 -0.792 1.307) 1.779 13.636 ( -1.849 5.981 0.823) 6.314 13.983 ( -3.240 -3.562 -1.838) 5.154 14.101 ( 3.037 7.339 -3.372) 8.629 14.275 ( 2.886 2.183 -2.717) 4.525 14.469 ( -2.536 -1.531 -1.848) 3.491 14.568 ( -0.131 -3.411 -1.970) 3.941 ======================= Grid point 36 (22/260) ======================= q-point: ( 0.30 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.750 ( 12.693 38.738 13.325) 42.887 4.456 ( 26.496 29.001 12.243) 41.145 5.477 ( -3.366 29.353 -0.140) 29.546 5.768 ( 15.104 -19.411 9.326) 26.304 6.105 ( 12.067 1.224 7.623) 14.326 6.298 ( 4.717 17.453 -1.046) 18.109 6.634 ( 17.483 14.693 -5.875) 23.581 6.745 ( 11.710 13.201 1.292) 17.693 7.418 ( 2.108 -13.144 -5.755) 14.502 7.584 ( 4.806 -1.064 -2.675) 5.602 8.079 ( 4.611 -0.819 -14.135) 14.891 8.217 ( -12.376 -12.478 -2.517) 17.754 8.400 ( -5.898 -6.969 4.313) 10.097 8.679 ( -9.598 -2.625 2.465) 10.251 8.865 ( -2.987 -3.366 0.420) 4.520 9.056 ( -0.881 -8.752 -2.844) 9.245 9.257 ( 0.214 -2.619 6.359) 6.881 9.546 ( 6.833 -12.529 2.385) 14.469 10.206 ( -7.510 7.937 4.351) 11.761 10.568 ( -3.265 0.059 -4.611) 5.651 10.715 ( -2.144 1.223 4.216) 4.885 10.834 ( -0.219 0.025 -0.083) 0.236 11.111 ( -1.897 0.570 2.516) 3.202 11.353 ( 0.534 -3.965 6.158) 7.343 11.577 ( 2.413 2.517 4.895) 6.009 11.800 ( 1.972 -1.201 -3.316) 4.040 12.006 ( -0.957 -0.493 3.907) 4.052 12.222 ( -2.723 -7.183 4.344) 8.825 13.136 ( 1.068 3.385 -1.247) 3.762 13.228 ( -1.188 -0.215 1.689) 2.076 13.613 ( -1.519 3.429 1.751) 4.139 13.884 ( -4.979 -5.155 -3.085) 7.802 14.128 ( 2.930 8.880 -3.574) 10.011 14.313 ( 2.977 1.928 -1.495) 3.849 14.422 ( -1.061 -0.654 -1.311) 1.809 14.557 ( 0.647 -3.624 -1.770) 4.085 ======================= Grid point 37 (23/260) ======================= q-point: ( 0.40 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.041 ( 8.305 38.702 8.942) 40.580 5.007 ( 23.475 26.452 7.644) 36.183 5.368 ( -4.724 29.549 -1.487) 29.961 5.879 ( -11.618 17.469 -0.877) 20.997 6.327 ( 12.189 -13.466 12.230) 21.897 6.530 ( 12.436 -16.654 6.217) 21.695 6.928 ( 18.307 2.282 -6.563) 19.581 7.013 ( 9.949 14.056 -0.899) 17.244 7.235 ( -6.694 -14.066 -2.847) 15.835 7.766 ( 1.282 -7.082 -5.554) 9.091 7.919 ( -0.461 3.612 -5.293) 6.425 8.127 ( 3.424 -0.393 -6.059) 6.970 8.371 ( -1.017 -6.999 6.362) 9.513 8.522 ( -6.482 -5.821 -1.521) 8.844 8.785 ( -5.365 3.115 -1.622) 6.413 8.989 ( -5.160 -1.249 -2.177) 5.738 9.290 ( -1.969 2.686 7.464) 8.173 9.745 ( 9.623 -10.476 5.343) 15.195 10.056 ( -7.442 3.476 0.304) 8.219 10.383 ( -9.115 -2.939 -9.000) 13.142 10.736 ( 0.172 5.263 3.104) 6.113 10.862 ( 0.815 -2.288 1.815) 3.032 11.114 ( -0.313 2.718 2.364) 3.616 11.405 ( 1.136 -2.024 2.148) 3.163 11.653 ( 1.050 0.051 5.979) 6.071 11.784 ( 0.108 -1.703 -4.698) 4.998 12.051 ( 2.821 -2.349 1.962) 4.162 12.198 ( -3.984 -6.668 4.395) 8.924 13.132 ( -0.004 2.967 -1.613) 3.378 13.226 ( -0.501 0.462 1.379) 1.538 13.617 ( 0.065 0.441 2.598) 2.636 13.768 ( -4.237 -4.848 -3.431) 7.296 14.146 ( 1.635 8.922 -2.138) 9.319 14.351 ( 1.897 1.546 -0.630) 2.527 14.405 ( -0.250 0.231 -0.471) 0.581 14.558 ( 0.711 -3.691 -1.154) 3.932 ======================= Grid point 38 (24/260) ======================= q-point: (-0.50 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.164 ( -0.000 38.688 0.000) 38.688 5.236 ( -0.000 26.384 0.000) 26.384 5.501 ( 0.000 26.054 0.000) 26.054 5.573 ( -0.000 27.674 0.000) 27.674 6.563 ( -0.000 -19.784 -0.000) 19.784 6.709 ( 0.000 -12.853 -0.000) 12.853 6.915 ( 0.000 -16.107 0.000) 16.107 7.147 ( 0.000 -9.838 -0.000) 9.838 7.263 ( -0.000 5.891 -0.000) 5.891 7.590 ( 0.000 1.379 0.000) 1.379 8.031 ( -0.000 5.805 0.000) 5.805 8.105 ( 0.000 -6.036 -0.000) 6.036 8.429 ( 0.000 -12.119 0.000) 12.119 8.476 ( 0.000 -2.447 -0.000) 2.447 8.675 ( 0.000 10.946 -0.000) 10.946 8.904 ( 0.000 8.354 0.000) 8.354 9.309 ( 0.000 1.292 0.000) 1.292 9.870 ( 0.000 -5.463 0.000) 5.463 10.039 ( 0.000 -2.082 -0.000) 2.082 10.188 ( -0.000 -4.453 0.000) 4.453 10.750 ( 0.000 5.406 0.000) 5.406 10.878 ( 0.000 -2.800 -0.000) 2.800 11.124 ( 0.000 3.915 -0.000) 3.915 11.425 ( -0.000 -1.694 0.000) 1.694 11.704 ( 0.000 -0.172 0.000) 0.172 11.748 ( -0.000 -2.271 0.000) 2.271 12.106 ( 0.000 -4.226 -0.000) 4.226 12.162 ( -0.000 -5.142 0.000) 5.142 13.122 ( 0.000 2.551 0.000) 2.551 13.228 ( 0.000 0.771 -0.000) 0.771 13.646 ( -0.000 -0.811 -0.000) 0.811 13.697 ( 0.000 -4.568 0.000) 4.568 14.151 ( 0.000 8.860 -0.000) 8.860 14.367 ( 0.000 1.349 -0.000) 1.349 14.401 ( 0.000 0.668 -0.000) 0.668 14.560 ( 0.000 -3.707 0.000) 3.707 ======================= Grid point 44 (25/260) ======================= q-point: ( 0.00 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.510 ( 0.000 41.871 0.000) 41.871 4.335 ( 0.000 -39.193 0.000) 39.193 4.340 ( 0.000 43.159 0.000) 43.159 5.114 ( 0.000 -30.864 0.000) 30.864 6.263 ( 0.000 21.874 0.000) 21.874 6.358 ( 0.000 21.478 0.000) 21.478 6.742 ( 0.000 13.726 0.000) 13.726 6.924 ( 0.000 -9.159 0.000) 9.159 6.979 ( 0.000 27.786 0.000) 27.786 7.846 ( 0.000 -33.951 0.000) 33.951 7.988 ( 0.000 8.106 0.000) 8.106 8.006 ( 0.000 -4.703 0.000) 4.703 8.495 ( 0.000 -8.334 0.000) 8.334 8.611 ( 0.000 -15.070 0.000) 15.070 8.789 ( 0.000 0.114 0.000) 0.114 8.821 ( 0.000 -3.430 0.000) 3.430 9.338 ( 0.000 1.999 0.000) 1.999 9.449 ( 0.000 -8.020 0.000) 8.020 10.003 ( 0.000 8.484 0.000) 8.484 10.173 ( 0.000 -8.054 0.000) 8.054 10.967 ( 0.000 1.167 0.000) 1.167 10.977 ( 0.000 -0.148 0.000) 0.148 11.156 ( 0.000 3.861 0.000) 3.861 11.227 ( 0.000 -2.228 0.000) 2.228 11.559 ( 0.000 5.943 0.000) 5.943 11.662 ( 0.000 -3.678 0.000) 3.678 12.110 ( 0.000 1.599 0.000) 1.599 12.154 ( 0.000 -2.610 0.000) 2.610 13.156 ( 0.000 3.087 0.000) 3.087 13.208 ( 0.000 -2.009 0.000) 2.009 13.814 ( 0.000 7.314 0.000) 7.314 13.959 ( 0.000 -6.843 0.000) 6.843 14.194 ( 0.000 6.525 0.000) 6.525 14.270 ( 0.000 -0.702 0.000) 0.702 14.526 ( 0.000 -1.116 0.000) 1.116 14.541 ( 0.000 -2.360 0.000) 2.360 ======================= Grid point 45 (26/260) ======================= q-point: ( 0.10 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.674 ( 13.295 38.716 8.203) 41.749 4.375 ( 6.030 11.683 2.338) 13.353 4.494 ( 9.934 -6.873 8.685) 14.878 5.178 ( 5.197 -30.494 3.922) 31.181 6.288 ( -0.503 22.848 1.537) 22.905 6.389 ( 8.413 19.722 -6.644) 22.447 6.820 ( 5.831 4.141 2.091) 7.451 6.885 ( -1.073 2.558 -1.380) 3.098 7.044 ( 6.269 24.286 -1.136) 25.107 7.813 ( -5.429 -10.851 0.872) 12.165 7.984 ( 0.792 -19.991 2.937) 20.221 8.026 ( 3.916 -0.092 -7.083) 8.094 8.426 ( -4.627 -4.448 -3.379) 7.254 8.622 ( 3.678 -16.983 -7.258) 18.831 8.812 ( 0.294 1.403 4.627) 4.844 8.854 ( 0.905 -3.534 5.053) 6.232 9.253 ( -6.503 2.318 -2.043) 7.200 9.369 ( -5.003 -8.199 -4.097) 10.442 10.122 ( 6.903 8.598 9.230) 14.379 10.295 ( 6.464 -8.339 9.927) 14.487 10.908 ( -4.852 5.137 1.716) 7.272 11.002 ( -1.043 -4.085 0.885) 4.308 11.130 ( -1.889 3.122 0.713) 3.718 11.195 ( -3.208 -2.722 0.225) 4.213 11.584 ( 2.288 6.540 0.376) 6.939 11.690 ( 3.083 -3.560 -1.150) 4.848 12.089 ( -2.797 2.031 1.463) 3.753 12.145 ( -1.017 -3.429 -0.020) 3.576 13.162 ( 0.281 2.886 0.765) 2.999 13.209 ( -0.202 -1.832 0.893) 2.047 13.800 ( -1.321 6.937 -0.626) 7.090 13.938 ( -1.906 -6.568 -0.882) 6.896 14.212 ( 2.806 6.313 -2.073) 7.213 14.282 ( 2.215 -0.316 -1.934) 2.957 14.498 ( -2.464 -0.737 -0.668) 2.657 14.523 ( -1.327 -2.917 -1.066) 3.377 ======================= Grid point 46 (27/260) ======================= q-point: ( 0.20 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.074 ( 18.918 34.007 12.315) 40.817 4.590 ( 13.525 17.037 6.183) 22.614 4.836 ( 16.696 -12.447 13.676) 24.915 5.367 ( 9.965 -28.972 7.817) 31.619 6.241 ( -4.257 25.319 -1.044) 25.696 6.550 ( 14.143 10.016 -8.423) 19.269 6.786 ( -5.253 0.320 0.300) 5.271 7.037 ( 11.786 -5.757 -0.868) 13.146 7.181 ( 9.977 35.955 -1.077) 37.329 7.670 ( -8.302 4.202 -2.335) 9.594 8.009 ( -1.176 -10.697 -4.838) 11.799 8.055 ( 2.862 -26.546 3.290) 26.902 8.317 ( -0.257 6.304 -9.159) 11.122 8.620 ( 3.894 -17.323 -9.519) 20.146 8.842 ( -3.584 3.083 6.623) 8.137 8.916 ( -0.655 -4.808 6.985) 8.505 9.145 ( -2.132 2.840 0.778) 3.635 9.272 ( -0.669 -9.028 -2.987) 9.532 10.331 ( 4.561 8.076 10.621) 14.101 10.486 ( 3.366 -7.258 9.519) 12.435 10.820 ( -5.565 6.826 0.970) 8.860 10.926 ( -5.211 -2.557 -2.967) 6.519 11.130 ( -1.918 -0.191 3.382) 3.893 11.159 ( -0.867 -3.942 5.977) 7.212 11.635 ( 2.803 6.578 -0.188) 7.153 11.737 ( 3.078 -3.310 -1.813) 4.870 12.044 ( -3.603 2.352 2.622) 5.038 12.117 ( -2.366 -4.785 1.222) 5.476 13.178 ( 0.518 2.421 1.072) 2.698 13.215 ( -0.336 -1.318 1.475) 2.006 13.754 ( -2.936 5.807 -1.071) 6.595 13.874 ( -3.748 -6.036 -2.019) 7.386 14.254 ( 4.238 6.290 -3.684) 8.432 14.314 ( 3.247 0.603 -2.636) 4.226 14.442 ( -2.521 -0.319 -0.660) 2.625 14.487 ( -1.316 -4.078 -1.110) 4.426 ======================= Grid point 47 (28/260) ======================= q-point: ( 0.30 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.497 ( 15.284 34.267 11.370) 39.206 4.961 ( 19.566 9.827 7.865) 23.265 5.299 ( 19.006 -11.115 16.151) 27.306 5.670 ( 14.388 -24.191 11.061) 30.242 6.125 ( -6.472 25.806 -2.672) 26.739 6.598 ( -6.327 -14.804 -2.025) 16.226 6.804 ( 11.863 21.003 -7.811) 25.355 7.130 ( -0.961 -10.068 -6.875) 12.229 7.390 ( 9.818 31.435 2.431) 33.022 7.549 ( 2.181 0.640 -5.474) 5.927 7.893 ( -6.567 -13.192 -3.038) 15.046 8.116 ( -1.125 -20.875 5.781) 21.690 8.280 ( 5.261 14.918 -11.294) 19.436 8.577 ( -1.901 -11.340 -7.099) 13.513 8.815 ( -0.531 2.875 1.137) 3.137 8.934 ( -0.533 -5.980 3.091) 6.753 9.227 ( 5.140 0.932 7.413) 9.069 9.318 ( 5.810 -8.205 2.093) 10.269 10.366 ( -8.479 7.555 3.013) 11.750 10.502 ( -6.769 -5.568 -0.161) 8.766 10.778 ( -0.528 3.748 3.489) 5.148 10.831 ( -1.798 -1.134 -0.401) 2.163 11.142 ( -0.147 2.931 5.432) 6.174 11.235 ( 1.384 -5.976 8.135) 10.188 11.674 ( 1.799 5.382 -0.614) 5.708 11.763 ( 1.766 -3.006 -3.071) 4.646 12.013 ( -2.363 1.756 3.614) 4.661 12.088 ( -2.704 -5.500 3.146) 6.889 13.194 ( 0.321 2.134 0.550) 2.227 13.221 ( -0.369 -0.641 1.570) 1.736 13.683 ( -3.550 3.788 -0.872) 5.264 13.775 ( -4.651 -5.224 -2.717) 7.504 14.296 ( 3.756 7.096 -4.183) 9.053 14.352 ( 2.736 1.318 -1.654) 3.459 14.407 ( -0.914 -0.438 -0.087) 1.017 14.465 ( -0.109 -5.211 -0.959) 5.299 ======================= Grid point 48 (29/260) ======================= q-point: ( 0.40 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.807 ( 9.435 35.894 7.713) 37.907 5.368 ( 16.757 -5.797 5.547) 18.579 5.733 ( 12.699 0.438 10.845) 16.705 5.971 ( -3.032 27.001 1.410) 27.208 6.078 ( 14.883 -20.214 9.799) 26.947 6.451 ( -7.131 -10.163 2.472) 12.659 6.823 ( -7.608 4.127 -11.421) 14.330 6.984 ( -0.492 -2.367 -10.463) 10.739 7.480 ( 3.391 11.762 -2.828) 12.564 7.688 ( 11.968 -5.144 -2.309) 13.230 7.773 ( -4.951 0.648 0.096) 4.994 8.076 ( -8.333 -15.465 5.101) 18.293 8.318 ( 5.318 9.233 -4.450) 11.547 8.474 ( -1.961 -3.929 -4.685) 6.421 8.858 ( 4.924 5.912 -2.570) 8.112 8.971 ( 2.244 -2.526 0.555) 3.424 9.371 ( 2.931 4.560 7.780) 9.483 9.513 ( 10.505 -10.434 6.084) 16.007 10.153 ( -11.690 6.126 -2.582) 13.448 10.286 ( -11.966 -6.265 -5.721) 14.668 10.807 ( -0.092 1.850 2.719) 3.290 10.832 ( 0.036 -1.044 1.482) 1.813 11.201 ( 1.204 5.763 4.690) 7.527 11.321 ( 1.428 -5.481 5.026) 7.572 11.694 ( 0.753 2.992 0.364) 3.107 11.750 ( 0.323 -2.135 -4.086) 4.621 12.020 ( -0.102 0.106 2.788) 2.792 12.072 ( -2.107 -4.933 3.390) 6.346 13.194 ( -0.413 2.724 -0.146) 2.759 13.228 ( -0.051 -0.562 0.956) 1.110 13.626 ( -2.007 1.023 0.195) 2.261 13.675 ( -3.420 -3.851 -2.384) 5.676 14.319 ( 1.804 7.822 -2.508) 8.410 14.382 ( 1.391 1.310 -0.329) 1.938 14.403 ( 0.367 -0.375 -0.160) 0.549 14.463 ( 0.492 -5.739 -0.806) 5.817 ======================= Grid point 49 (30/260) ======================= q-point: (-0.50 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.936 ( 0.000 36.585 0.000) 36.585 5.574 ( 0.000 -19.917 0.000) 19.917 5.830 ( -0.000 23.116 0.000) 23.116 5.978 ( 0.000 19.724 -0.000) 19.724 6.413 ( -0.000 -15.533 -0.000) 15.533 6.430 ( 0.000 -25.491 -0.000) 25.491 6.539 ( 0.000 16.804 0.000) 16.804 6.899 ( 0.000 -15.431 -0.000) 15.431 7.530 ( 0.000 16.005 -0.000) 16.005 7.695 ( -0.000 8.965 0.000) 8.965 7.864 ( -0.000 -15.012 0.000) 15.012 7.949 ( 0.000 -12.793 -0.000) 12.793 8.354 ( 0.000 4.389 0.000) 4.389 8.444 ( 0.000 -2.853 -0.000) 2.853 8.905 ( 0.000 9.444 -0.000) 9.444 8.997 ( 0.000 0.535 -0.000) 0.535 9.443 ( 0.000 10.640 -0.000) 10.640 9.685 ( 0.000 -11.880 0.000) 11.880 10.022 ( 0.000 0.904 -0.000) 0.904 10.085 ( -0.000 -4.939 0.000) 4.939 10.816 ( 0.000 1.517 -0.000) 1.517 10.839 ( 0.000 -1.240 -0.000) 1.240 11.236 ( 0.000 6.659 -0.000) 6.659 11.357 ( -0.000 -4.744 0.000) 4.744 11.715 ( 0.000 0.368 -0.000) 0.368 11.719 ( 0.000 -0.547 0.000) 0.547 12.037 ( 0.000 -1.477 -0.000) 1.477 12.065 ( -0.000 -3.737 0.000) 3.737 13.187 ( 0.000 3.277 -0.000) 3.277 13.232 ( 0.000 -0.818 0.000) 0.818 13.618 ( -0.000 -1.277 -0.000) 1.277 13.622 ( 0.000 -2.141 0.000) 2.141 14.324 ( 0.000 7.892 0.000) 7.892 14.394 ( 0.000 1.140 -0.000) 1.140 14.407 ( 0.000 -0.093 -0.000) 0.093 14.464 ( 0.000 -5.816 0.000) 5.816 ======================= Grid point 99 (31/260) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.807 ( 27.912 0.000 40.250) 48.981 0.972 ( -14.357 0.000 48.486) 50.567 1.689 ( -19.150 0.000 84.293) 86.441 4.748 ( -3.333 0.000 -3.765) 5.028 5.026 ( -7.901 0.000 11.631) 14.061 6.159 ( -4.163 0.000 2.972) 5.115 6.224 ( -3.482 0.000 -0.203) 3.488 6.473 ( 3.287 0.000 7.632) 8.309 6.914 ( -1.382 0.000 5.830) 5.992 8.232 ( 1.844 0.000 2.234) 2.897 8.679 ( -0.741 0.000 -7.214) 7.252 8.725 ( 0.237 0.000 -4.927) 4.932 8.743 ( 4.415 0.000 0.127) 4.417 8.903 ( 2.291 0.000 -7.193) 7.549 9.260 ( -4.463 0.000 8.168) 9.308 9.713 ( -0.227 0.000 2.104) 2.117 9.741 ( -2.675 0.000 -12.912) 13.186 9.895 ( -1.594 0.000 -0.855) 1.809 10.033 ( -3.897 0.000 -1.773) 4.282 10.606 ( 2.992 0.000 -0.296) 3.007 10.643 ( -5.770 0.000 5.342) 7.863 11.060 ( 0.601 0.000 -1.896) 1.989 11.114 ( 0.533 0.000 -3.828) 3.865 11.433 ( 11.116 0.000 -0.506) 11.127 11.490 ( -2.661 0.000 3.127) 4.106 11.778 ( 5.404 0.000 -6.630) 8.554 12.145 ( -2.545 0.000 4.964) 5.578 12.290 ( 67.871 0.000 -1.807) 67.895 12.957 ( -1.779 0.000 1.540) 2.353 13.165 ( 1.298 0.000 0.212) 1.315 13.415 ( 8.999 0.000 2.323) 9.294 13.667 ( -2.816 0.000 2.621) 3.847 14.118 ( 3.786 0.000 -0.263) 3.795 14.336 ( -2.776 0.000 -1.278) 3.056 14.502 ( -44.631 0.000 -1.066) 44.644 14.590 ( 0.721 0.000 -3.338) 3.415 ======================= Grid point 100 (32/260) ======================= q-point: ( 0.10 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.455 ( 21.408 0.000 36.728) 42.512 1.781 ( 15.107 0.000 52.117) 54.262 2.487 ( 45.028 0.000 55.678) 71.607 4.782 ( 11.437 0.000 -6.704) 13.257 4.972 ( -8.686 0.000 11.043) 14.050 6.093 ( -4.251 0.000 0.734) 4.314 6.191 ( 2.373 0.000 -4.329) 4.937 6.654 ( 7.264 0.000 11.903) 13.944 6.984 ( 3.173 0.000 7.022) 7.705 8.293 ( 2.567 0.000 3.067) 4.000 8.576 ( -3.972 0.000 -6.372) 7.508 8.690 ( 0.355 0.000 -7.497) 7.505 8.785 ( -5.890 0.000 -1.593) 6.101 8.823 ( 0.580 0.000 -4.853) 4.888 9.271 ( -2.618 0.000 9.820) 10.163 9.619 ( -0.062 0.000 -13.433) 13.433 9.705 ( -2.253 0.000 -3.547) 4.202 9.910 ( -5.364 0.000 1.017) 5.459 9.947 ( 2.602 0.000 4.844) 5.498 10.557 ( -7.154 0.000 0.839) 7.203 10.687 ( 4.918 0.000 -3.046) 5.785 11.060 ( 0.822 0.000 0.984) 1.282 11.077 ( -0.440 0.000 -3.678) 3.705 11.324 ( -10.291 0.000 2.916) 10.697 11.618 ( 8.973 0.000 0.194) 8.975 11.819 ( 4.171 0.000 -4.407) 6.068 12.118 ( -4.555 0.000 3.931) 6.016 12.818 ( 4.951 0.000 -7.062) 8.625 12.994 ( 4.411 0.000 -0.842) 4.491 13.218 ( 3.608 0.000 1.516) 3.914 13.483 ( -8.843 0.000 8.336) 12.153 13.660 ( -1.129 0.000 2.365) 2.621 14.089 ( -0.402 0.000 1.473) 1.527 14.187 ( 1.820 0.000 2.473) 3.070 14.260 ( -2.293 0.000 -4.268) 4.845 14.580 ( 1.437 0.000 -3.472) 3.758 ======================= Grid point 101 (33/260) ======================= q-point: ( 0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.215 ( 31.001 0.000 26.103) 40.527 2.349 ( 0.098 0.000 57.585) 57.585 3.904 ( 60.831 0.000 36.138) 70.756 4.886 ( -9.829 0.000 9.993) 14.017 4.981 ( 11.257 0.000 -3.446) 11.772 6.062 ( 5.256 0.000 -5.374) 7.517 6.258 ( 10.957 0.000 -7.755) 13.424 6.929 ( 10.502 0.000 14.437) 17.853 7.145 ( 7.096 0.000 8.588) 11.140 8.341 ( -1.246 0.000 -2.243) 2.566 8.451 ( -3.529 0.000 -0.956) 3.656 8.547 ( -10.417 0.000 -11.245) 15.328 8.596 ( -2.945 0.000 -9.130) 9.593 8.813 ( -4.651 0.000 4.290) 6.327 9.253 ( -11.145 0.000 9.709) 14.781 9.475 ( -3.018 0.000 -15.199) 15.496 9.604 ( 0.575 0.000 -7.204) 7.227 9.898 ( 0.260 0.000 3.076) 3.087 10.045 ( 1.047 0.000 10.136) 10.190 10.387 ( -8.720 0.000 -6.202) 10.701 10.679 ( -1.094 0.000 -6.997) 7.082 11.048 ( -0.509 0.000 -1.409) 1.498 11.131 ( 4.027 0.000 4.412) 5.974 11.194 ( -6.226 0.000 2.485) 6.704 11.778 ( 8.592 0.000 -0.840) 8.633 11.856 ( 2.727 0.000 -1.938) 3.346 12.047 ( -5.454 0.000 1.225) 5.590 12.742 ( -7.551 0.000 -0.255) 7.555 13.033 ( 1.191 0.000 0.296) 1.227 13.317 ( 5.035 0.000 2.747) 5.736 13.394 ( -8.208 0.000 11.061) 13.774 13.679 ( 1.736 0.000 0.732) 1.884 14.127 ( -5.382 0.000 -3.289) 6.307 14.176 ( 7.609 0.000 -4.759) 8.975 14.274 ( 3.117 0.000 -0.098) 3.119 14.588 ( 2.151 0.000 -2.208) 3.083 ======================= Grid point 102 (34/260) ======================= q-point: ( 0.30 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.763 ( -5.269 0.000 51.346) 51.616 2.984 ( 31.466 0.000 19.948) 37.256 4.658 ( -15.007 0.000 20.401) 25.326 4.999 ( -10.696 0.000 3.691) 11.315 5.347 ( 57.127 0.000 18.199) 59.956 6.272 ( 26.267 0.000 -14.331) 29.922 6.467 ( 19.564 0.000 -8.664) 21.397 7.262 ( 11.820 0.000 14.154) 18.441 7.379 ( 9.232 0.000 11.668) 14.879 8.167 ( -11.263 0.000 -4.300) 12.056 8.257 ( -10.199 0.000 -11.115) 15.085 8.354 ( -9.542 0.000 -9.792) 13.672 8.531 ( 3.106 0.000 0.317) 3.122 8.702 ( -10.036 0.000 1.522) 10.150 9.034 ( -18.178 0.000 6.310) 19.242 9.253 ( -8.068 0.000 -12.577) 14.942 9.629 ( 4.616 0.000 -2.322) 5.168 9.929 ( 1.082 0.000 0.363) 1.141 10.092 ( -6.606 0.000 -1.726) 6.828 10.219 ( -0.370 0.000 2.418) 2.447 10.562 ( -4.440 0.000 -6.699) 8.037 11.026 ( -1.466 0.000 0.114) 1.470 11.138 ( -1.696 0.000 0.889) 1.915 11.242 ( 3.594 0.000 3.202) 4.813 11.884 ( 0.394 0.000 0.936) 1.016 11.910 ( 7.609 0.000 -3.343) 8.311 11.955 ( -3.083 0.000 -2.555) 4.004 12.579 ( -10.308 0.000 1.743) 10.455 13.063 ( 2.343 0.000 -0.881) 2.504 13.352 ( -5.384 0.000 7.283) 9.057 13.441 ( 5.362 0.000 3.508) 6.407 13.730 ( 2.715 0.000 1.333) 3.025 13.991 ( -5.527 0.000 -4.561) 7.165 14.261 ( 5.160 0.000 -2.580) 5.769 14.317 ( 2.042 0.000 -1.250) 2.395 14.622 ( 2.243 0.000 0.269) 2.259 ======================= Grid point 103 (35/260) ======================= q-point: ( 0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.989 ( -13.985 0.000 42.663) 44.897 3.681 ( 27.888 0.000 16.019) 32.161 4.519 ( -14.550 0.000 17.749) 22.950 4.694 ( -25.344 0.000 5.911) 26.024 6.360 ( 32.367 0.000 8.513) 33.468 6.667 ( 28.449 0.000 -18.823) 34.113 6.883 ( 34.023 0.000 -0.572) 34.028 7.525 ( 5.645 0.000 6.528) 8.630 7.675 ( 7.518 0.000 17.619) 19.156 7.881 ( -19.163 0.000 -5.372) 19.901 8.014 ( -12.684 0.000 -10.020) 16.164 8.034 ( -4.287 0.000 -5.248) 6.777 8.508 ( -9.368 0.000 -1.941) 9.567 8.613 ( 3.831 0.000 1.095) 3.985 8.734 ( -18.814 0.000 5.247) 19.532 9.013 ( -7.384 0.000 -6.963) 10.150 9.688 ( 3.446 0.000 -3.537) 4.938 9.886 ( -3.595 0.000 -16.514) 16.900 9.933 ( -0.381 0.000 -0.597) 0.708 10.325 ( 0.842 0.000 13.929) 13.954 10.449 ( -1.792 0.000 -4.141) 4.512 10.997 ( -1.454 0.000 -0.529) 1.547 11.125 ( -0.413 0.000 -0.750) 0.856 11.293 ( 0.631 0.000 -0.918) 1.114 11.847 ( -2.848 0.000 -1.423) 3.184 11.943 ( 1.966 0.000 -0.377) 2.002 11.994 ( 6.300 0.000 -7.278) 9.626 12.408 ( -9.380 0.000 0.883) 9.422 13.100 ( 2.887 0.000 -1.857) 3.433 13.308 ( -4.852 0.000 4.314) 6.492 13.550 ( 2.851 0.000 2.156) 3.575 13.794 ( 2.009 0.000 3.249) 3.820 13.871 ( -2.906 0.000 -3.192) 4.317 14.327 ( 3.301 0.000 0.254) 3.310 14.330 ( 1.308 0.000 -2.637) 2.943 14.665 ( 1.152 0.000 2.067) 2.367 ======================= Grid point 104 (36/260) ======================= q-point: (-0.50 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.943 ( -25.569 0.000 32.938) 41.697 4.100 ( -20.680 0.000 9.977) 22.961 4.368 ( 9.455 0.000 9.784) 13.606 4.466 ( -8.340 0.000 19.312) 21.036 6.590 ( -9.292 0.000 -3.534) 9.942 6.887 ( 12.390 0.000 -21.045) 24.421 7.335 ( -24.939 0.000 -8.825) 26.455 7.504 ( 21.194 0.000 -1.608) 21.255 7.534 ( -5.893 0.000 -0.567) 5.920 7.757 ( -17.065 0.000 13.772) 21.929 7.999 ( 16.742 0.000 6.143) 17.833 8.108 ( 9.393 0.000 6.642) 11.504 8.387 ( -0.714 0.000 -2.734) 2.826 8.560 ( -0.602 0.000 5.408) 5.441 8.627 ( -2.581 0.000 -2.381) 3.512 8.956 ( 6.192 0.000 -0.962) 6.266 9.662 ( -0.774 0.000 -7.160) 7.201 9.716 ( 1.285 0.000 -18.362) 18.407 9.934 ( 0.851 0.000 -0.283) 0.897 10.452 ( 4.106 0.000 -0.140) 4.109 10.454 ( -0.069 0.000 14.437) 14.437 10.962 ( -1.195 0.000 -2.449) 2.725 11.102 ( -0.407 0.000 -2.697) 2.728 11.251 ( -1.830 0.000 -5.718) 6.004 11.792 ( -1.154 0.000 -3.019) 3.232 11.982 ( 1.581 0.000 1.311) 2.054 12.017 ( 5.394 0.000 -13.007) 14.081 12.254 ( -7.985 0.000 0.390) 7.995 13.134 ( 2.663 0.000 -2.121) 3.404 13.249 ( -4.699 0.000 2.651) 5.396 13.537 ( -3.747 0.000 -2.265) 4.379 13.849 ( -0.068 0.000 5.142) 5.142 13.873 ( 3.841 0.000 0.453) 3.868 14.326 ( 0.730 0.000 -2.518) 2.622 14.390 ( 2.195 0.000 3.229) 3.905 14.691 ( -0.468 0.000 2.429) 2.474 ======================= Grid point 105 (37/260) ======================= q-point: (-0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.636 ( -34.492 0.000 27.312) 43.996 3.513 ( -41.621 0.000 8.358) 42.452 4.479 ( -9.491 0.000 15.102) 17.837 4.787 ( 16.784 0.000 10.474) 19.783 5.973 ( -45.938 0.000 -3.801) 46.095 6.796 ( -2.432 0.000 -17.584) 17.752 6.932 ( -16.484 0.000 -1.238) 16.530 7.346 ( -26.543 0.000 2.674) 26.677 7.389 ( -15.761 0.000 5.769) 16.784 7.798 ( 20.243 0.000 -8.046) 21.783 8.364 ( 11.681 0.000 5.413) 12.875 8.419 ( 8.722 0.000 5.653) 10.394 8.435 ( 7.378 0.000 -3.503) 8.167 8.564 ( 3.739 0.000 0.129) 3.741 8.735 ( 9.761 0.000 6.705) 11.843 9.179 ( 16.936 0.000 0.539) 16.945 9.607 ( 1.661 0.000 -4.341) 4.648 9.633 ( 5.322 0.000 -15.514) 16.402 9.926 ( -1.110 0.000 -2.099) 2.374 10.553 ( -1.615 0.000 12.339) 12.444 10.580 ( 8.007 0.000 2.556) 8.405 10.908 ( -0.724 0.000 -6.102) 6.145 11.079 ( 1.103 0.000 -3.265) 3.446 11.145 ( -2.849 0.000 -8.520) 8.984 11.751 ( 0.010 0.000 -4.486) 4.486 11.960 ( 2.319 0.000 -18.524) 18.669 12.021 ( 1.241 0.000 1.846) 2.225 12.139 ( -4.072 0.000 -0.271) 4.081 13.161 ( 1.783 0.000 -1.542) 2.357 13.185 ( -4.279 0.000 2.287) 4.851 13.426 ( -5.059 0.000 -3.102) 5.934 13.872 ( -2.750 0.000 6.226) 6.806 13.960 ( 4.938 0.000 -1.182) 5.078 14.322 ( 0.475 0.000 -0.397) 0.619 14.467 ( 1.709 0.000 6.759) 6.972 14.689 ( -1.634 0.000 1.751) 2.395 ======================= Grid point 106 (38/260) ======================= q-point: (-0.30 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.180 ( -40.120 0.000 28.923) 49.458 2.775 ( -47.455 0.000 10.916) 48.694 4.106 ( -44.352 0.000 -4.890) 44.621 5.093 ( 6.836 0.000 9.032) 11.327 5.259 ( -27.813 0.000 15.362) 31.774 6.566 ( -10.744 0.000 -7.149) 12.905 6.651 ( -14.293 0.000 1.447) 14.366 6.834 ( -25.559 0.000 0.787) 25.571 7.198 ( -10.957 0.000 2.257) 11.187 8.116 ( 20.867 0.000 -7.465) 22.162 8.372 ( -3.994 0.000 -4.985) 6.387 8.532 ( 6.236 0.000 -3.719) 7.261 8.606 ( 11.797 0.000 -0.975) 11.837 8.752 ( 5.372 0.000 5.554) 7.726 8.957 ( 8.013 0.000 6.776) 10.494 9.501 ( 15.890 0.000 -0.885) 15.914 9.655 ( 8.531 0.000 -9.361) 12.665 9.672 ( 6.450 0.000 1.318) 6.583 9.863 ( -3.449 0.000 -1.978) 3.976 10.594 ( -3.176 0.000 7.939) 8.551 10.748 ( 6.673 0.000 2.564) 7.148 10.849 ( 2.401 0.000 -10.181) 10.461 11.018 ( -2.497 0.000 -8.598) 8.953 11.098 ( 3.140 0.000 -1.672) 3.557 11.720 ( 1.834 0.000 -6.439) 6.695 11.798 ( -2.633 0.000 -17.947) 18.139 12.059 ( 1.066 0.000 2.378) 2.606 12.091 ( 1.199 0.000 -6.865) 6.969 13.118 ( -4.493 0.000 2.171) 4.990 13.190 ( 1.361 0.000 0.363) 1.408 13.314 ( -4.438 0.000 -2.639) 5.163 13.852 ( -5.078 0.000 6.248) 8.052 14.016 ( 3.784 0.000 -4.455) 5.845 14.341 ( 0.584 0.000 2.368) 2.439 14.572 ( 1.835 0.000 11.167) 11.317 14.665 ( -1.820 0.000 0.462) 1.878 ======================= Grid point 107 (39/260) ======================= q-point: (-0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.694 ( -42.490 0.000 37.459) 56.644 1.984 ( -51.156 0.000 17.245) 53.984 2.923 ( -72.773 0.000 -3.783) 72.872 5.107 ( -11.066 0.000 18.458) 21.521 5.148 ( -8.800 0.000 6.801) 11.121 6.309 ( -13.388 0.000 4.323) 14.068 6.442 ( -10.494 0.000 2.957) 10.903 6.518 ( -7.552 0.000 -5.174) 9.155 7.036 ( -9.073 0.000 3.470) 9.714 8.257 ( -2.655 0.000 -5.399) 6.017 8.422 ( 17.675 0.000 -5.803) 18.604 8.597 ( 5.504 0.000 -5.324) 7.658 8.776 ( 9.293 0.000 -4.689) 10.409 8.825 ( 0.120 0.000 0.683) 0.694 9.138 ( 4.440 0.000 8.751) 9.813 9.730 ( 10.278 0.000 2.919) 10.684 9.760 ( 8.957 0.000 -6.453) 11.039 9.782 ( -4.036 0.000 -0.326) 4.049 9.836 ( 8.358 0.000 3.765) 9.167 10.576 ( -2.730 0.000 0.607) 2.797 10.776 ( -4.204 0.000 -3.353) 5.378 10.831 ( 4.787 0.000 -12.069) 12.984 10.983 ( 4.397 0.000 -2.388) 5.003 11.149 ( 2.924 0.000 -0.889) 3.056 11.578 ( -4.882 0.000 -17.133) 17.815 11.714 ( 4.183 0.000 -8.044) 9.067 12.036 ( 0.413 0.000 -11.638) 11.646 12.099 ( 0.586 0.000 3.376) 3.427 13.054 ( -4.638 0.000 2.632) 5.333 13.224 ( -3.232 0.000 -1.937) 3.768 13.224 ( 1.314 0.000 2.285) 2.636 13.795 ( -6.292 0.000 5.373) 8.273 14.037 ( 3.247 0.000 -5.005) 5.966 14.371 ( -0.042 0.000 2.786) 2.786 14.635 ( -1.129 0.000 -1.069) 1.555 14.730 ( 3.535 0.000 15.364) 15.766 ======================= Grid point 108 (40/260) ======================= q-point: (-0.10 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.164 ( -53.120 0.000 16.475) 55.616 1.256 ( -48.058 0.000 32.050) 57.765 1.730 ( -59.882 0.000 53.149) 80.067 4.939 ( -14.794 0.000 1.918) 14.918 5.069 ( -8.660 0.000 14.346) 16.757 6.198 ( -4.409 0.000 4.538) 6.327 6.310 ( -6.945 0.000 2.677) 7.443 6.420 ( -1.608 0.000 0.914) 1.850 6.934 ( -5.614 0.000 4.727) 7.340 8.195 ( 0.227 0.000 -1.934) 1.947 8.658 ( 12.259 0.000 -6.393) 13.825 8.661 ( 5.923 0.000 -3.887) 7.085 8.784 ( -2.351 0.000 -4.010) 4.648 8.872 ( 6.172 0.000 -5.541) 8.294 9.248 ( -0.849 0.000 8.749) 8.790 9.722 ( -2.650 0.000 1.360) 2.979 9.802 ( 5.494 0.000 -10.523) 11.871 10.005 ( 6.064 0.000 2.163) 6.438 10.078 ( 15.385 0.000 1.365) 15.446 10.520 ( 4.769 0.000 12.442) 13.324 10.644 ( -5.001 0.000 -3.127) 5.898 10.754 ( -3.969 0.000 -3.557) 5.329 11.045 ( 2.988 0.000 -1.544) 3.363 11.160 ( -0.568 0.000 -1.323) 1.440 11.414 ( 0.868 0.000 -5.333) 5.403 11.737 ( 5.625 0.000 -8.117) 9.875 11.894 ( -5.874 0.000 -7.743) 9.719 12.133 ( -0.629 0.000 4.516) 4.560 12.996 ( -3.937 0.000 2.459) 4.642 13.169 ( -1.270 0.000 -0.994) 1.613 13.284 ( 2.575 0.000 4.249) 4.969 13.722 ( -5.730 0.000 3.987) 6.981 14.063 ( 3.597 0.000 -3.084) 4.738 14.376 ( -1.457 0.000 1.192) 1.883 14.608 ( -0.110 0.000 -2.439) 2.442 14.929 ( 3.885 0.000 4.504) 5.948 ======================= Grid point 109 (41/260) ======================= q-point: ( 0.00 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.308 ( 21.055 37.519 26.966) 50.775 1.654 ( -5.547 42.194 38.346) 57.285 2.356 ( -17.200 64.090 50.206) 83.211 4.878 ( -2.902 12.413 -4.206) 13.424 5.162 ( -8.489 13.011 11.444) 19.295 6.246 ( -2.313 4.216 1.566) 5.057 6.289 ( 1.707 -6.346 5.994) 8.894 6.355 ( -3.479 5.687 2.890) 7.267 6.877 ( -1.271 -6.928 2.153) 7.366 8.222 ( 2.736 -2.839 0.138) 3.946 8.601 ( -0.310 -5.366 -4.879) 7.259 8.676 ( 2.315 -1.840 -5.262) 6.035 8.753 ( 1.700 -1.376 2.039) 2.990 8.878 ( -0.819 -4.776 -6.991) 8.506 9.213 ( 1.021 -3.741 1.288) 4.086 9.641 ( -0.265 -5.348 0.451) 5.374 9.711 ( -1.914 -5.302 -7.620) 9.478 9.808 ( 1.397 -6.097 -0.929) 6.324 9.989 ( -4.426 -3.937 1.634) 6.145 10.545 ( 5.817 -3.044 2.150) 6.908 10.745 ( -7.682 7.445 1.012) 10.746 11.019 ( 0.258 -2.733 -2.819) 3.935 11.127 ( 1.105 -0.271 -3.106) 3.307 11.356 ( 25.958 -14.491 16.433) 33.969 11.473 ( 7.236 -0.494 1.700) 7.450 11.559 ( -9.083 -0.686 4.836) 10.313 12.004 ( 11.119 -1.419 -3.567) 11.763 12.358 ( 8.908 -0.548 1.938) 9.133 12.972 ( -1.856 1.849 1.042) 2.820 13.234 ( 0.833 3.513 -0.263) 3.620 13.424 ( 3.767 2.691 2.958) 5.493 13.717 ( -3.235 4.961 2.227) 6.327 14.093 ( -0.412 -0.481 1.145) 1.309 14.318 ( -2.787 -1.726 -1.305) 3.529 14.584 ( 0.957 -0.358 -3.516) 3.661 14.625 ( -15.328 3.666 -6.922) 17.213 ======================= Grid point 110 (42/260) ======================= q-point: ( 0.10 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.016 ( 12.294 36.566 34.481) 51.741 2.144 ( 21.703 32.177 36.030) 52.958 2.869 ( 33.094 42.166 46.300) 70.829 4.908 ( 11.252 11.931 -7.218) 17.918 5.099 ( -8.873 12.203 10.389) 18.319 6.196 ( -5.362 9.537 2.208) 11.162 6.294 ( 3.252 8.488 -4.044) 9.949 6.489 ( 7.682 -13.627 10.572) 18.881 6.916 ( 2.299 -7.287 5.958) 9.689 8.282 ( 3.081 -4.850 -0.259) 5.752 8.543 ( -1.179 -1.462 -3.498) 3.971 8.637 ( -2.095 -1.961 -5.408) 6.122 8.683 ( -7.752 -9.817 -6.732) 14.205 8.846 ( 0.151 1.212 1.588) 2.003 9.242 ( 0.471 -4.035 1.945) 4.503 9.584 ( -2.714 -4.417 -6.197) 8.080 9.662 ( -2.575 -3.768 -4.203) 6.205 9.803 ( -0.280 -7.982 -0.489) 8.002 9.959 ( 0.133 0.319 7.001) 7.009 10.610 ( -7.035 3.789 -0.301) 7.997 10.683 ( 5.843 0.774 -1.930) 6.202 10.963 ( -2.445 -4.379 -1.928) 5.373 11.114 ( 0.681 0.023 -1.777) 1.903 11.395 ( -8.648 5.300 2.853) 10.537 11.615 ( 8.526 -0.042 -0.587) 8.546 11.724 ( 6.032 -9.268 3.736) 11.672 12.089 ( -1.193 -1.894 1.644) 2.777 12.619 ( 9.548 -14.988 3.904) 18.194 12.958 ( 0.117 1.543 -0.031) 1.548 13.258 ( 1.030 2.159 1.767) 2.974 13.477 ( -2.655 1.727 6.282) 7.036 13.700 ( -0.009 4.573 0.749) 4.634 14.094 ( 1.107 0.719 0.799) 1.543 14.236 ( -3.829 -1.797 -3.846) 5.717 14.386 ( -3.663 10.300 -4.584) 11.855 14.577 ( 1.532 -0.284 -3.589) 3.913 ======================= Grid point 111 (43/260) ======================= q-point: ( 0.20 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.548 ( 8.946 24.310 40.806) 48.333 2.733 ( 16.879 37.358 31.583) 51.749 4.099 ( 55.368 20.475 34.100) 68.174 5.005 ( -9.191 11.598 8.759) 17.196 5.111 ( 13.205 12.281 -4.692) 18.633 6.127 ( 0.158 7.031 -2.844) 7.586 6.390 ( 12.785 10.961 -7.569) 18.463 6.769 ( 11.882 -13.928 13.010) 22.460 7.057 ( 6.225 -8.276 8.108) 13.152 8.283 ( -1.931 -8.474 -4.860) 9.958 8.430 ( -10.288 -10.679 -10.257) 18.030 8.507 ( -6.973 -1.501 -6.519) 9.663 8.532 ( 1.235 3.669 0.857) 3.965 8.837 ( -4.922 1.337 4.571) 6.849 9.220 ( -6.132 -5.104 1.389) 8.098 9.440 ( -5.770 -4.173 -9.410) 11.800 9.548 ( -2.756 -4.318 -2.991) 5.931 9.857 ( 3.094 -4.148 2.608) 5.795 10.051 ( 1.242 1.627 9.104) 9.332 10.431 ( -8.369 3.804 -7.018) 11.565 10.691 ( -1.208 1.176 -7.120) 7.317 10.954 ( 1.229 -5.256 2.106) 5.794 11.131 ( 1.047 -0.915 0.690) 1.552 11.290 ( -4.695 6.569 3.008) 8.617 11.753 ( 7.275 -1.933 -1.792) 7.738 11.814 ( 2.497 -4.379 2.032) 5.435 12.043 ( -3.564 -0.107 -0.063) 3.566 12.683 ( -4.662 -7.047 3.654) 9.206 12.983 ( 2.502 -1.358 -0.159) 2.851 13.295 ( -0.259 -0.343 4.699) 4.718 13.472 ( -2.220 4.844 5.860) 7.920 13.725 ( 2.245 4.533 0.019) 5.059 14.104 ( -4.781 -1.980 -3.200) 6.084 14.171 ( 4.996 0.125 -2.887) 5.771 14.346 ( 0.870 4.820 -2.619) 5.554 14.585 ( 2.054 -0.360 -2.185) 3.021 ======================= Grid point 112 (44/260) ======================= q-point: ( 0.30 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.964 ( -2.823 19.313 44.787) 48.856 3.344 ( 25.608 31.723 19.473) 45.181 4.762 ( -14.485 10.413 18.751) 25.882 5.167 ( -8.149 15.680 3.737) 18.062 5.477 ( 54.197 13.095 16.974) 58.283 6.243 ( 20.069 0.008 -11.861) 23.312 6.635 ( 21.306 12.397 -8.963) 26.229 7.130 ( 14.626 -12.532 14.230) 23.947 7.260 ( 7.658 -9.466 8.731) 14.982 8.107 ( -10.058 -11.468 -7.954) 17.203 8.192 ( -7.972 -2.029 -6.741) 10.635 8.268 ( -11.134 -6.272 -10.267) 16.393 8.589 ( 1.840 4.699 3.564) 6.178 8.728 ( -9.619 1.783 2.066) 9.999 9.043 ( -13.329 -1.693 2.000) 13.584 9.213 ( -10.540 -2.559 -10.102) 14.822 9.540 ( 1.637 -7.300 1.003) 7.549 9.917 ( 1.666 -1.309 -0.362) 2.150 10.107 ( -4.524 0.670 4.169) 6.189 10.250 ( -1.115 3.270 -6.068) 6.982 10.580 ( -3.768 1.925 -5.350) 6.821 10.993 ( 0.994 -2.627 1.037) 2.994 11.124 ( -2.244 -0.991 0.771) 2.572 11.295 ( 1.628 4.263 2.428) 5.169 11.835 ( 4.097 -4.030 -3.339) 6.646 11.856 ( -0.695 -3.476 2.034) 4.087 11.999 ( 1.478 2.003 -2.708) 3.678 12.571 ( -9.174 -1.509 2.341) 9.587 13.033 ( 3.153 -2.002 -0.808) 3.821 13.312 ( -2.980 -1.739 5.779) 6.730 13.514 ( 2.309 4.575 3.482) 6.196 13.777 ( 2.960 4.551 0.879) 5.499 13.969 ( -5.443 -2.143 -4.771) 7.548 14.252 ( 4.762 -0.120 -0.981) 4.863 14.346 ( 1.114 1.973 -2.467) 3.349 14.615 ( 2.052 -0.656 0.239) 2.167 ======================= Grid point 113 (45/260) ======================= q-point: ( 0.40 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.178 ( -12.569 18.042 37.936) 43.848 3.958 ( 25.076 25.346 15.001) 38.681 4.622 ( -13.838 10.648 16.291) 23.880 4.894 ( -24.192 18.208 6.319) 30.930 6.409 ( 28.105 4.088 1.020) 28.419 6.644 ( 31.869 0.975 -5.542) 32.362 7.014 ( 28.627 9.478 -5.955) 30.737 7.431 ( 2.906 -10.400 4.346) 11.640 7.502 ( 10.078 -12.151 13.718) 20.914 7.880 ( -13.994 -6.478 -4.986) 16.207 7.933 ( -6.965 -4.194 -4.429) 9.258 8.017 ( -6.109 -0.304 -6.442) 8.883 8.523 ( -9.728 0.943 -1.212) 9.848 8.656 ( -2.512 3.919 4.027) 6.155 8.794 ( -15.278 4.592 4.031) 16.455 8.936 ( -7.893 -6.744 -7.896) 13.043 9.573 ( 1.225 -8.992 -2.505) 9.414 9.901 ( -0.567 -0.476 -3.919) 3.988 9.978 ( -2.343 4.587 -11.431) 12.538 10.304 ( 1.988 -2.053 9.163) 9.598 10.499 ( -1.489 4.623 -1.441) 5.066 11.004 ( 0.038 0.075 -0.662) 0.667 11.087 ( -1.994 -2.645 -0.327) 3.329 11.330 ( 0.606 3.113 -1.016) 3.330 11.809 ( -1.476 -4.026 -3.882) 5.784 11.881 ( 1.822 -3.059 0.137) 3.563 12.042 ( 5.209 1.980 -4.790) 7.348 12.412 ( -9.194 -0.083 0.604) 9.214 13.081 ( 3.149 -1.673 -1.579) 3.900 13.286 ( -4.207 -1.311 4.194) 6.083 13.585 ( 1.884 2.638 1.389) 3.527 13.841 ( 1.999 3.877 2.445) 5.001 13.851 ( -2.561 -1.451 -2.852) 4.099 14.324 ( 3.201 0.148 0.603) 3.261 14.343 ( 0.902 0.842 -2.435) 2.730 14.655 ( 1.051 -0.960 1.991) 2.448 ======================= Grid point 114 (46/260) ======================= q-point: (-0.50 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.119 ( -23.865 17.062 27.942) 40.514 4.351 ( -22.210 23.039 9.131) 33.279 4.542 ( 7.131 14.745 10.898) 19.673 4.608 ( -3.340 15.132 17.190) 23.144 6.613 ( -2.443 1.641 -7.901) 8.431 6.890 ( 2.489 0.957 -13.909) 14.162 7.280 ( -15.886 -7.360 -8.730) 19.564 7.388 ( -8.793 -7.153 -2.711) 11.655 7.577 ( 15.848 2.086 1.759) 16.081 7.800 ( -6.656 2.720 11.962) 13.957 7.969 ( 5.126 -6.579 4.487) 9.471 8.061 ( 16.219 -1.041 7.927) 18.083 8.396 ( -0.929 1.237 -2.202) 2.691 8.519 ( -4.261 1.078 0.415) 4.415 8.667 ( -3.321 -0.184 -0.246) 3.335 8.910 ( 7.194 -3.997 -0.063) 8.230 9.524 ( -0.775 -9.137 -7.560) 11.884 9.810 ( -0.468 4.585 -14.673) 15.380 9.924 ( 1.391 -0.473 -0.315) 1.503 10.438 ( 4.846 -0.831 7.439) 8.917 10.500 ( -0.085 3.704 4.300) 5.676 10.983 ( -0.981 1.910 -2.908) 3.614 11.046 ( -0.933 -4.663 -2.187) 5.235 11.293 ( -1.548 3.586 -5.323) 6.603 11.751 ( -0.859 -4.356 -5.116) 6.774 11.908 ( 1.715 -3.145 -1.683) 3.958 12.079 ( 3.709 2.006 -7.583) 8.677 12.261 ( -6.826 0.448 0.134) 6.842 13.120 ( 2.575 -1.480 -1.733) 3.439 13.236 ( -4.301 -0.555 2.845) 5.187 13.559 ( -3.365 1.681 -3.054) 4.845 13.856 ( 3.627 -1.554 0.762) 4.019 13.896 ( 0.329 4.221 4.504) 6.181 14.332 ( 0.546 0.593 -2.412) 2.543 14.390 ( 2.017 0.080 3.487) 4.029 14.680 ( -0.435 -1.028 2.440) 2.683 ======================= Grid point 115 (47/260) ======================= q-point: (-0.40 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.808 ( -31.650 17.203 21.566) 41.985 3.788 ( -38.186 24.139 6.580) 45.653 4.612 ( -8.084 12.978 15.459) 21.743 4.969 ( 15.336 17.253 9.894) 25.115 6.085 ( -42.527 10.987 -2.909) 44.020 6.701 ( -5.748 -9.001 -16.500) 19.655 6.921 ( -17.330 -0.439 -0.037) 17.335 7.244 ( -8.034 -11.919 -0.863) 14.400 7.468 ( -27.022 9.763 5.964) 29.344 7.869 ( 16.387 5.690 -5.652) 18.244 8.162 ( 8.317 -13.528 5.705) 16.874 8.435 ( 8.474 -0.655 -1.542) 8.638 8.485 ( 9.569 -7.012 4.199) 12.584 8.515 ( 2.845 2.545 3.265) 5.023 8.745 ( 10.529 2.043 1.302) 10.804 9.120 ( 15.122 -5.010 -1.902) 16.043 9.487 ( 3.955 -7.910 -3.542) 9.527 9.706 ( 1.603 2.542 -11.082) 11.482 9.935 ( 0.003 1.179 -1.849) 2.193 10.539 ( 0.045 0.228 4.328) 4.334 10.609 ( 6.575 1.235 7.338) 9.930 10.912 ( -1.994 -0.457 -6.799) 7.100 11.034 ( 1.881 -2.636 -2.482) 4.080 11.198 ( -2.420 4.402 -7.865) 9.332 11.687 ( -0.458 -5.823 -7.305) 9.353 11.911 ( 2.249 -2.345 -7.144) 7.848 12.014 ( -4.331 -1.088 -4.530) 6.361 12.209 ( 1.391 3.901 -1.614) 4.445 13.140 ( -0.129 -1.687 0.022) 1.692 13.189 ( -2.058 0.777 1.499) 2.662 13.458 ( -3.920 2.483 -3.826) 6.014 13.915 ( -1.898 3.639 5.361) 6.752 13.949 ( 4.524 -0.722 -0.338) 4.593 14.325 ( 0.184 0.321 -0.380) 0.530 14.463 ( 1.529 -0.371 6.299) 6.492 14.680 ( -1.461 -0.792 1.942) 2.556 ======================= Grid point 116 (48/260) ======================= q-point: (-0.30 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.365 ( -35.583 19.330 21.448) 45.824 3.106 ( -42.108 26.905 6.089) 50.339 4.319 ( -38.337 21.121 0.177) 43.770 5.216 ( -0.001 12.140 8.042) 14.562 5.439 ( -21.929 17.116 15.235) 31.717 6.447 ( -9.705 -11.499 -8.352) 17.209 6.622 ( -15.458 -0.712 1.064) 15.511 6.997 ( -24.613 13.356 2.061) 28.079 7.085 ( -10.339 -10.432 2.497) 14.898 8.147 ( 18.321 2.549 -6.804) 19.709 8.300 ( 3.092 -10.431 -1.501) 10.983 8.491 ( 3.669 -3.422 -2.407) 5.565 8.540 ( 6.618 0.515 -5.331) 8.514 8.761 ( 5.465 -6.244 12.203) 14.756 8.934 ( 8.873 0.931 -1.064) 8.985 9.342 ( 12.438 -11.566 -5.489) 17.850 9.638 ( 10.920 -2.035 -1.139) 11.167 9.694 ( 3.211 -1.605 -0.580) 3.636 9.893 ( -2.270 3.096 -2.151) 4.401 10.556 ( -1.440 -2.080 3.088) 3.992 10.778 ( 4.092 -0.012 -0.802) 4.170 10.824 ( 1.877 -0.815 -4.725) 5.149 11.067 ( 2.992 1.632 -3.872) 5.159 11.094 ( -0.322 2.817 -6.140) 6.763 11.603 ( -0.928 -8.150 -10.982) 13.707 11.840 ( -0.412 1.963 -11.888) 12.056 11.933 ( -2.366 -4.757 0.463) 5.333 12.239 ( 3.425 5.420 -3.179) 7.157 13.106 ( -3.912 -0.448 2.562) 4.698 13.200 ( 1.418 0.981 0.687) 1.856 13.363 ( -2.929 4.005 -3.601) 6.130 13.900 ( -4.720 4.512 5.940) 8.827 14.014 ( 4.234 -0.320 -3.712) 5.640 14.337 ( 0.110 -0.388 2.305) 2.340 14.554 ( 1.329 -1.635 8.712) 8.963 14.667 ( -1.166 -0.057 1.615) 1.993 ======================= Grid point 117 (49/260) ======================= q-point: (-0.20 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.908 ( -35.553 23.722 27.438) 50.789 2.346 ( -45.822 26.611 3.178) 53.084 3.371 ( -58.588 42.273 6.866) 72.572 5.171 ( -9.168 9.007 11.692) 17.375 5.361 ( -11.444 17.558 13.044) 24.685 6.253 ( -6.207 -9.009 -0.386) 10.947 6.397 ( -9.101 -1.653 -0.235) 9.253 6.644 ( -15.534 13.098 2.679) 20.495 6.947 ( -7.091 -9.100 3.078) 11.940 8.249 ( -1.049 -3.101 -4.984) 5.963 8.426 ( 15.182 0.443 -5.634) 16.200 8.575 ( 6.360 -9.378 -4.083) 12.044 8.602 ( 4.997 0.122 -3.537) 6.123 8.901 ( 1.462 -3.160 5.317) 6.356 9.062 ( 6.167 -4.196 0.331) 7.467 9.522 ( 11.374 -13.843 -3.667) 18.288 9.722 ( 3.727 -3.139 -2.358) 5.414 9.789 ( -0.099 -0.308 2.040) 2.066 9.887 ( 3.404 -0.227 3.839) 5.136 10.553 ( 0.593 -1.376 -1.580) 2.177 10.670 ( -3.727 -5.169 -10.365) 12.167 10.940 ( 4.356 4.472 2.214) 6.624 11.033 ( 3.183 5.007 -8.342) 10.237 11.138 ( 3.219 -0.433 -0.826) 3.352 11.453 ( -4.166 -8.082 -11.843) 14.931 11.762 ( 0.094 2.067 -6.162) 6.500 11.896 ( -0.034 -3.993 -4.306) 5.873 12.269 ( 2.443 5.663 -2.643) 6.710 13.054 ( -4.105 0.508 2.781) 4.984 13.237 ( 0.928 0.970 2.060) 2.458 13.298 ( -0.468 6.343 -3.090) 7.071 13.847 ( -6.041 4.902 5.214) 9.366 14.048 ( 3.468 0.782 -4.344) 5.613 14.359 ( -0.462 -1.135 3.009) 3.249 14.609 ( -0.549 -2.121 1.155) 2.477 14.718 ( 2.248 -1.334 9.594) 9.944 ======================= Grid point 118 (50/260) ======================= q-point: (-0.10 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( -42.425 26.761 10.200) 51.186 1.648 ( -27.877 36.603 30.558) 55.233 2.566 ( -43.319 64.939 31.925) 84.337 5.043 ( -11.760 10.527 2.419) 15.968 5.233 ( -11.544 15.178 13.424) 23.320 6.217 ( 0.142 -10.306 3.187) 10.789 6.287 ( -3.879 2.372 1.272) 4.722 6.454 ( -9.057 11.020 3.507) 14.689 6.889 ( -2.174 -7.555 2.681) 8.306 8.201 ( 0.406 -1.454 -2.952) 3.315 8.597 ( 6.160 -5.408 -4.153) 9.189 8.641 ( 6.019 -4.969 -5.925) 9.799 8.679 ( 5.551 -0.114 -0.998) 5.641 8.921 ( 0.397 -2.703 -2.680) 3.827 9.163 ( 3.339 -5.974 2.130) 7.168 9.640 ( 2.788 -9.657 -2.879) 10.456 9.728 ( 2.884 -5.122 -3.724) 6.958 9.873 ( 0.528 -7.468 3.683) 8.343 9.961 ( 2.384 -4.681 2.520) 5.826 10.484 ( -0.881 -2.112 -4.611) 5.148 10.681 ( 11.045 0.850 8.682) 14.075 10.923 ( -5.939 9.384 -5.615) 12.445 11.044 ( 2.468 0.052 -1.555) 2.918 11.150 ( -0.062 -1.093 -1.314) 1.710 11.367 ( 3.283 -2.059 -2.310) 4.512 11.694 ( -5.950 -0.995 0.115) 6.034 11.888 ( 6.316 1.057 -8.635) 10.750 12.287 ( 1.261 5.128 -0.344) 5.292 13.006 ( -3.360 1.216 2.207) 4.200 13.236 ( -0.571 3.298 -0.653) 3.410 13.331 ( 3.788 5.395 1.333) 6.725 13.775 ( -5.655 5.116 3.842) 8.539 14.075 ( 2.498 0.731 -2.223) 3.423 14.359 ( -1.755 -1.538 1.458) 2.752 14.597 ( 0.199 -0.984 -2.160) 2.382 14.819 ( -1.276 -6.818 4.069) 8.042 ======================= Grid point 119 (51/260) ======================= q-point: ( 0.00 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.080 ( 9.519 38.279 24.881) 46.636 2.570 ( -1.217 47.879 24.146) 53.637 3.840 ( -8.774 75.040 23.199) 79.033 5.223 ( -2.496 20.508 -5.478) 21.373 5.512 ( -8.417 18.337 10.545) 22.766 5.858 ( 1.736 -22.570 8.715) 24.256 6.489 ( 0.509 4.926 -0.179) 4.955 6.624 ( -6.498 13.907 5.351) 16.256 6.650 ( 0.122 -4.559 2.059) 5.004 8.044 ( 2.765 -13.453 -5.426) 14.767 8.529 ( -4.993 -15.010 0.820) 15.840 8.581 ( 1.269 2.115 -1.445) 2.859 8.674 ( 1.069 -3.795 -4.226) 5.779 8.810 ( 3.466 -1.003 -0.316) 3.622 9.082 ( 4.200 -10.185 -7.005) 13.055 9.444 ( -3.115 -14.805 3.397) 15.505 9.537 ( 3.956 -10.679 -8.258) 14.068 9.727 ( -2.405 -3.159 -1.679) 4.311 9.899 ( -1.997 -3.101 6.643) 7.598 10.498 ( 7.928 -2.429 3.987) 9.201 10.882 ( -8.355 4.213 -0.592) 9.376 10.993 ( 5.033 1.309 -1.972) 5.562 11.092 ( 5.505 -2.868 1.498) 6.386 11.165 ( 5.848 -2.650 8.715) 10.824 11.461 ( 5.467 -0.627 0.922) 5.580 11.626 ( -3.693 3.747 -0.693) 5.306 12.009 ( 7.104 1.202 -4.671) 8.587 12.316 ( 0.073 -2.909 2.938) 4.135 13.023 ( -0.894 3.047 0.766) 3.266 13.274 ( -0.257 0.521 1.817) 1.908 13.525 ( 1.732 6.554 0.985) 6.850 13.857 ( -3.142 8.414 1.511) 9.108 14.099 ( 0.294 0.494 0.569) 0.808 14.272 ( -3.290 -2.327 -0.987) 4.149 14.568 ( 1.068 -1.315 -3.512) 3.900 14.631 ( -4.480 -1.960 -4.279) 6.497 ======================= Grid point 120 (52/260) ======================= q-point: ( 0.10 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.672 ( 17.777 29.769 33.944) 48.523 2.898 ( 16.658 41.595 25.036) 51.327 4.084 ( 14.501 68.470 25.085) 74.348 5.228 ( 9.525 17.995 -7.654) 21.752 5.446 ( -7.858 21.370 7.939) 24.113 6.024 ( 6.955 -23.282 11.661) 26.952 6.472 ( -5.609 11.209 3.175) 12.930 6.591 ( 3.938 10.961 -1.320) 11.721 6.713 ( 3.744 -4.888 3.768) 7.219 8.047 ( 2.600 -15.336 -6.599) 16.897 8.372 ( -9.504 -18.132 -4.832) 21.034 8.586 ( -0.762 2.881 0.105) 2.982 8.637 ( -1.006 -0.615 -3.664) 3.849 8.865 ( 0.086 0.799 4.066) 4.145 9.074 ( 1.708 -12.346 -6.929) 14.260 9.401 ( -3.421 -12.878 -0.208) 13.326 9.544 ( -3.796 -9.517 0.952) 10.290 9.619 ( 0.315 -9.660 -4.949) 10.858 10.008 ( 4.709 5.297 9.468) 11.827 10.668 ( 4.040 1.641 3.486) 5.583 10.727 ( -5.549 2.333 -2.989) 6.721 10.916 ( -3.568 0.083 -5.957) 6.944 11.115 ( 0.527 1.039 -1.249) 1.708 11.468 ( -0.868 -1.724 4.300) 4.713 11.511 ( 4.916 -6.825 11.884) 14.560 11.631 ( 6.374 1.540 -3.508) 7.437 12.067 ( 1.115 -0.294 -1.197) 1.662 12.389 ( 4.098 -8.026 4.889) 10.252 13.019 ( 0.081 3.829 -0.191) 3.835 13.286 ( -0.623 0.385 2.667) 2.765 13.552 ( -0.400 5.038 2.696) 5.728 13.834 ( 0.163 8.204 -0.284) 8.210 14.111 ( 0.189 -0.194 0.534) 0.599 14.192 ( -2.594 -1.271 -3.496) 4.535 14.496 ( -3.820 1.322 -4.731) 6.223 14.568 ( 1.303 -0.758 -3.812) 4.099 ======================= Grid point 121 (53/260) ======================= q-point: ( 0.20 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.141 ( 5.135 32.609 36.109) 48.924 3.517 ( 23.193 35.575 21.859) 47.763 4.781 ( 33.107 45.207 27.186) 62.280 5.341 ( -3.689 21.008 5.347) 21.989 5.439 ( 14.977 18.914 -7.338) 25.217 6.283 ( 6.207 -13.143 13.258) 19.674 6.373 ( -1.838 6.046 0.072) 6.319 6.737 ( 11.687 4.685 -0.272) 12.595 6.861 ( 10.204 -1.436 1.838) 10.468 8.003 ( -3.321 -16.625 -5.829) 17.928 8.137 ( -6.646 -17.379 -11.550) 21.900 8.486 ( -7.437 -0.446 -5.276) 9.130 8.627 ( -1.661 1.702 4.746) 5.309 8.859 ( -4.961 0.983 4.327) 6.656 9.033 ( -0.392 -12.088 -6.781) 13.866 9.285 ( -6.419 -9.660 -3.427) 12.094 9.451 ( -4.317 -6.005 2.870) 7.933 9.707 ( 6.155 -11.024 3.040) 12.987 10.154 ( 1.627 8.253 7.057) 10.980 10.517 ( -8.043 4.313 -7.263) 11.664 10.726 ( -1.797 2.076 -6.497) 7.054 10.871 ( 1.833 -2.941 3.319) 4.798 11.120 ( 0.559 0.321 -0.275) 0.701 11.402 ( -4.341 3.985 2.346) 6.342 11.690 ( 3.180 -7.011 7.378) 10.663 11.718 ( 5.455 -1.283 -3.391) 6.550 12.044 ( -1.716 0.121 -0.936) 1.959 12.490 ( 0.483 -10.176 5.985) 11.815 13.020 ( 0.746 3.890 -1.389) 4.197 13.294 ( -1.547 -0.245 3.831) 4.139 13.565 ( -0.434 4.336 2.877) 5.222 13.854 ( 2.352 7.643 -0.924) 8.050 14.043 ( -4.866 -3.939 -4.403) 7.654 14.195 ( 3.616 2.299 -0.338) 4.299 14.414 ( -1.356 1.633 -3.572) 4.155 14.570 ( 1.599 -1.258 -2.061) 2.896 ======================= Grid point 122 (54/260) ======================= q-point: ( 0.30 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.489 ( -0.287 30.778 34.792) 46.452 4.078 ( 21.126 36.456 17.092) 45.469 5.081 ( -13.819 20.769 14.576) 28.893 5.580 ( -0.849 23.373 1.896) 23.466 5.885 ( 44.372 26.528 13.774) 53.501 6.308 ( 9.596 6.423 -6.942) 13.473 6.652 ( 15.281 -17.076 10.500) 25.207 6.970 ( 9.457 -7.594 6.890) 13.949 7.118 ( 19.034 7.257 -6.096) 21.263 7.797 ( -10.380 -17.316 -5.123) 20.829 7.991 ( -0.925 -13.670 -13.340) 19.123 8.257 ( -12.086 0.617 -4.292) 12.840 8.604 ( -5.747 -4.562 3.880) 8.300 8.778 ( -5.642 1.684 3.502) 6.851 8.923 ( -6.019 -7.516 -6.141) 11.420 9.149 ( -7.052 -5.266 -2.709) 9.209 9.420 ( -3.521 -2.952 6.048) 7.596 9.846 ( 5.047 -6.926 2.562) 8.944 10.130 ( -6.546 2.780 2.438) 7.518 10.337 ( -3.056 4.540 -11.745) 12.957 10.645 ( -1.454 4.574 -2.071) 5.228 10.935 ( 1.304 -2.862 2.818) 4.223 11.113 ( -1.293 0.084 -0.339) 1.340 11.378 ( 0.002 3.254 1.202) 3.469 11.752 ( 1.480 -4.041 -3.919) 5.820 11.777 ( 1.407 -3.765 4.038) 5.697 12.021 ( 1.403 0.354 -2.286) 2.706 12.486 ( -5.299 -6.937 3.741) 9.497 13.030 ( 1.892 2.131 -1.726) 3.332 13.291 ( -2.526 -0.698 4.156) 4.913 13.593 ( 1.182 3.098 2.274) 4.021 13.882 ( -1.153 0.185 -2.934) 3.158 13.926 ( -0.870 3.149 -2.465) 4.092 14.268 ( 3.746 1.714 0.775) 4.192 14.378 ( 0.050 1.070 -2.853) 3.048 14.593 ( 1.598 -1.682 0.246) 2.333 ======================= Grid point 123 (55/260) ======================= q-point: ( 0.40 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.676 ( -9.314 29.872 28.510) 42.331 4.582 ( 20.146 32.652 12.339) 40.302 4.953 ( -10.881 21.880 14.854) 28.597 5.368 ( -22.345 27.006 4.873) 35.388 6.472 ( 20.508 1.731 -13.293) 24.500 6.789 ( 27.758 12.585 11.271) 32.495 7.008 ( 12.321 -17.466 3.331) 21.633 7.170 ( 8.584 -9.926 9.604) 16.262 7.354 ( 10.980 -3.257 -8.328) 14.161 7.694 ( 1.478 -5.324 0.853) 5.591 7.795 ( -7.261 -8.561 -8.627) 14.157 8.068 ( -2.719 3.059 -2.719) 4.914 8.502 ( -4.940 -4.534 -0.537) 6.727 8.710 ( -11.221 -2.026 -3.529) 11.936 8.753 ( -1.876 -4.400 4.396) 6.497 8.930 ( -15.537 5.203 0.858) 16.408 9.403 ( -2.380 -5.672 0.482) 6.170 9.884 ( 1.321 -1.393 -2.950) 3.519 10.057 ( -3.234 2.259 -7.768) 8.713 10.248 ( 2.086 -3.052 2.528) 4.478 10.620 ( -0.829 6.939 -0.761) 7.030 10.962 ( 0.049 -3.539 0.858) 3.642 11.074 ( -1.883 1.121 -1.604) 2.715 11.394 ( 0.819 2.605 -0.982) 2.901 11.711 ( -0.555 -4.670 -6.525) 8.043 11.826 ( 0.744 -2.657 3.091) 4.143 12.054 ( 4.483 -0.700 -4.096) 6.113 12.377 ( -7.841 -3.908 0.467) 8.773 13.058 ( 2.501 0.187 -1.334) 2.841 13.270 ( -3.108 -0.375 3.330) 4.570 13.631 ( 0.765 1.513 -0.082) 1.697 13.786 ( -2.071 -4.109 -3.070) 5.532 13.965 ( 2.271 7.313 1.504) 7.804 14.338 ( 2.610 1.307 1.865) 3.464 14.361 ( 0.372 0.966 -2.245) 2.472 14.626 ( 0.840 -1.932 2.005) 2.908 ======================= Grid point 124 (56/260) ======================= q-point: (-0.50 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.604 ( -19.690 29.642 18.442) 40.080 4.886 ( -7.831 21.658 10.883) 25.472 4.923 ( -21.988 27.831 6.284) 36.021 5.090 ( 13.634 30.576 13.953) 36.270 6.604 ( 4.302 -3.712 -16.001) 16.980 6.967 ( -11.467 -5.854 -3.400) 13.317 6.976 ( -3.926 -6.988 -4.748) 9.316 7.300 ( -15.367 -3.617 -0.383) 15.791 7.532 ( 11.213 -10.908 6.227) 16.837 7.738 ( 15.183 -7.946 8.549) 19.151 7.875 ( 3.416 3.864 0.879) 5.232 8.113 ( 3.786 3.993 3.049) 6.291 8.461 ( 0.567 5.677 -1.201) 5.831 8.507 ( -3.669 -9.277 -4.085) 10.780 8.700 ( -5.076 9.729 0.330) 10.979 8.822 ( 5.508 -4.873 6.224) 9.634 9.330 ( -2.570 -8.739 -5.518) 10.650 9.877 ( -3.790 1.769 -13.297) 13.939 9.921 ( 2.944 -0.151 0.029) 2.948 10.402 ( 7.050 -3.074 8.146) 11.203 10.598 ( -0.796 5.662 -0.690) 5.760 10.946 ( -1.949 -4.590 -1.483) 5.202 11.028 ( -0.260 2.237 -3.562) 4.214 11.373 ( -0.862 3.622 -4.145) 5.572 11.638 ( -0.672 -5.581 -7.836) 9.644 11.857 ( 0.720 -2.200 1.139) 2.579 12.083 ( 1.950 -1.456 -6.630) 7.062 12.244 ( -4.750 -2.755 -0.826) 5.553 13.094 ( 2.241 -0.334 -0.577) 2.338 13.236 ( -2.970 0.394 2.214) 3.725 13.586 ( -2.424 0.628 -4.413) 5.074 13.805 ( 3.732 -3.435 0.993) 5.168 14.014 ( 0.718 7.061 3.294) 7.824 14.348 ( 0.259 1.011 -2.023) 2.277 14.398 ( 1.216 0.724 3.936) 4.183 14.651 ( -0.408 -1.890 2.707) 3.326 ======================= Grid point 125 (57/260) ======================= q-point: (-0.40 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.310 ( -25.188 30.928 12.084) 41.678 4.344 ( -33.652 27.880 -0.228) 43.701 4.991 ( -3.710 23.690 15.835) 28.736 5.444 ( 11.947 28.208 9.417) 32.048 6.356 ( -19.944 3.144 -7.769) 21.634 6.489 ( -25.617 -1.172 -7.819) 26.810 6.859 ( -6.508 -10.622 -5.004) 13.425 7.025 ( -16.625 -1.973 6.040) 17.798 7.686 ( -13.270 7.333 2.022) 15.296 7.814 ( 3.464 -14.614 6.492) 16.362 8.012 ( 11.008 3.802 -2.436) 11.899 8.254 ( 9.067 -10.307 5.714) 14.869 8.487 ( 1.988 -5.125 3.005) 6.265 8.501 ( 4.981 2.877 -4.793) 7.488 8.775 ( 7.825 -0.090 0.854) 7.872 9.059 ( 12.616 1.018 -4.242) 13.349 9.289 ( 4.373 -11.212 2.465) 12.284 9.715 ( -2.316 -1.827 -10.323) 10.736 9.973 ( 2.427 2.299 -1.312) 3.591 10.575 ( -1.078 3.154 -0.986) 3.476 10.605 ( 7.794 -2.173 6.153) 10.165 10.867 ( -3.042 -2.803 -4.794) 6.332 11.021 ( 2.697 0.739 -3.279) 4.310 11.298 ( -1.951 4.401 -7.148) 8.618 11.556 ( -0.848 -5.769 -8.613) 10.401 11.871 ( 0.800 -1.708 -1.051) 2.159 11.987 ( -4.368 -1.640 -6.728) 8.187 12.229 ( 2.643 -2.234 -1.776) 3.890 13.125 ( 0.567 0.486 1.061) 1.298 13.207 ( -1.359 0.750 1.007) 1.850 13.508 ( -1.569 2.288 -4.622) 5.391 13.895 ( 5.090 -3.348 0.147) 6.095 14.041 ( -1.352 7.201 4.507) 8.602 14.337 ( -0.360 0.869 -0.382) 1.015 14.453 ( 0.697 -0.497 5.329) 5.397 14.656 ( -1.306 -1.633 2.580) 3.321 ======================= Grid point 126 (58/260) ======================= q-point: (-0.30 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.926 ( -26.585 33.795 11.015) 44.387 3.681 ( -36.800 28.265 -4.132) 46.586 4.918 ( -20.262 34.826 9.209) 41.331 5.583 ( -7.682 23.302 5.925) 25.241 5.911 ( -17.318 27.968 14.000) 35.751 6.114 ( -11.283 -20.064 -9.248) 24.807 6.649 ( -11.910 0.058 -0.692) 11.931 6.812 ( -11.591 -11.563 4.678) 17.028 7.313 ( -22.824 15.796 2.102) 27.837 7.972 ( 5.555 -19.124 1.949) 20.010 8.205 ( 14.229 1.841 -5.591) 15.399 8.430 ( 6.719 -6.037 -2.678) 9.422 8.558 ( 4.504 -0.317 -3.754) 5.872 8.581 ( 3.349 -6.164 9.410) 11.737 8.926 ( 7.005 -3.527 -0.953) 7.900 9.123 ( 7.639 -8.659 -9.605) 15.020 9.513 ( 5.901 -10.455 9.500) 15.309 9.636 ( 2.625 -3.515 -6.237) 7.626 9.975 ( -0.500 4.814 -2.934) 5.660 10.542 ( -0.751 0.775 -1.473) 1.826 10.699 ( -0.269 -5.894 -8.559) 10.395 10.850 ( 5.320 1.905 3.505) 6.650 11.068 ( 4.224 -0.044 -1.497) 4.482 11.202 ( 0.079 4.310 -9.324) 10.273 11.457 ( -2.692 -4.633 -8.069) 9.686 11.862 ( -3.555 -0.763 -4.475) 5.766 11.872 ( 1.700 -0.469 -3.981) 4.354 12.269 ( 2.820 -2.093 -1.443) 3.797 13.117 ( -2.657 1.437 2.058) 3.655 13.217 ( 1.340 0.389 0.746) 1.582 13.458 ( 0.154 5.187 -4.049) 6.582 13.977 ( 3.419 -1.229 -0.525) 3.671 14.041 ( -2.067 6.672 3.597) 7.856 14.332 ( -0.865 0.135 1.912) 2.103 14.514 ( 0.758 -2.173 5.589) 6.044 14.653 ( -1.027 -1.459 2.457) 3.037 ======================= Grid point 127 (59/260) ======================= q-point: (-0.20 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.538 ( -27.489 34.717 12.851) 46.110 2.965 ( -34.808 34.961 -3.746) 49.476 4.436 ( -35.150 57.197 11.321) 68.082 5.461 ( -9.260 18.078 8.530) 22.030 5.809 ( -14.410 24.827 15.336) 32.546 5.898 ( -6.698 -21.241 -4.554) 22.732 6.494 ( -3.853 6.690 0.557) 7.740 6.677 ( -7.507 -14.170 5.000) 16.797 6.964 ( -16.330 16.664 1.946) 23.412 8.040 ( 2.715 -15.951 -2.838) 16.428 8.411 ( 11.790 -3.705 -4.119) 13.027 8.489 ( 3.633 -0.360 -2.027) 4.176 8.605 ( 4.591 -0.451 -4.157) 6.210 8.719 ( 2.313 -9.636 7.450) 12.398 8.986 ( 4.043 -5.616 -5.055) 8.569 9.256 ( 12.746 -11.876 -6.849) 18.719 9.557 ( -2.101 -13.746 3.382) 14.311 9.737 ( 5.296 -5.066 3.601) 8.166 9.904 ( -4.888 3.183 -1.571) 6.040 10.532 ( 1.057 -2.411 -9.753) 10.102 10.584 ( -0.630 -1.769 -3.803) 4.241 10.988 ( 5.381 1.304 2.107) 5.924 11.103 ( 1.510 -0.276 -3.363) 3.696 11.200 ( 5.585 6.024 -5.612) 9.949 11.318 ( -5.350 -3.845 -5.134) 8.353 11.780 ( -2.754 0.254 -2.309) 3.603 11.878 ( 3.824 1.197 -5.712) 6.978 12.300 ( 1.208 -1.741 -0.239) 2.133 13.079 ( -3.005 1.734 1.666) 3.849 13.248 ( 0.689 -0.188 1.462) 1.627 13.449 ( 2.124 8.029 -2.972) 8.821 13.977 ( -4.592 6.918 4.367) 9.382 14.058 ( 3.023 0.511 -2.500) 3.956 14.334 ( -1.412 -0.907 3.149) 3.569 14.559 ( 0.481 -2.776 1.806) 3.347 14.675 ( 0.459 -2.863 3.955) 4.904 ======================= Grid point 128 (60/260) ======================= q-point: (-0.10 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( -26.024 36.116 11.441) 45.962 2.545 ( -14.831 48.070 13.953) 52.205 3.987 ( -25.886 70.846 18.709) 77.713 5.354 ( -8.184 19.094 2.211) 20.892 5.624 ( -14.602 18.503 10.425) 25.773 5.813 ( -2.692 -20.558 4.343) 21.183 6.481 ( 0.504 7.382 0.002) 7.400 6.627 ( -3.242 -10.369 6.157) 12.487 6.750 ( -9.577 15.126 2.277) 18.047 8.045 ( 1.920 -13.260 -4.790) 14.229 8.526 ( 3.113 -7.301 -0.245) 7.940 8.559 ( 4.692 0.360 -2.293) 5.235 8.658 ( 3.327 -3.765 -1.629) 5.282 8.772 ( 1.114 -6.854 -0.207) 6.947 9.035 ( 6.146 -8.220 -5.716) 11.748 9.413 ( 8.815 -11.742 -5.776) 15.778 9.542 ( -1.274 -14.878 0.763) 14.952 9.791 ( -5.945 0.509 0.622) 5.999 9.862 ( 3.439 -6.390 5.176) 8.914 10.414 ( -0.305 -4.630 -5.936) 7.534 10.704 ( 10.773 1.977 4.865) 11.985 11.033 ( -2.560 0.841 -3.809) 4.665 11.099 ( 0.680 1.260 -4.517) 4.738 11.134 ( -4.143 4.815 2.602) 6.864 11.340 ( 7.501 -0.961 -2.206) 7.878 11.707 ( -4.291 1.500 -0.144) 4.548 11.924 ( 6.804 2.356 -6.560) 9.740 12.309 ( -0.541 -1.594 1.333) 2.148 13.042 ( -2.173 2.260 1.269) 3.382 13.264 ( -0.143 0.012 1.617) 1.623 13.480 ( 2.955 8.308 -1.216) 8.901 13.916 ( -5.277 8.297 3.471) 10.427 14.085 ( 1.669 0.101 -1.331) 2.137 14.322 ( -2.508 -1.750 1.890) 3.595 14.570 ( 1.087 -1.817 -1.994) 2.909 14.702 ( -1.165 -5.001 1.209) 5.276 ======================= Grid point 129 (61/260) ======================= q-point: ( 0.00 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.867 ( 4.369 39.398 19.911) 44.359 3.538 ( 0.384 46.645 14.552) 48.864 5.159 ( -0.835 -11.039 9.379) 14.509 5.206 ( -2.828 27.499 12.315) 30.263 5.700 ( 1.375 21.333 -5.081) 21.973 6.062 ( -9.454 23.862 9.733) 27.450 6.237 ( -1.386 -3.458 6.683) 7.652 6.872 ( 1.994 8.560 -3.475) 9.451 6.928 ( -5.219 13.504 7.451) 16.283 7.787 ( 4.345 -8.583 -9.690) 13.654 8.203 ( -10.675 -13.743 4.159) 17.892 8.489 ( 2.988 -15.620 -1.530) 15.977 8.635 ( 1.104 -1.725 -0.621) 2.140 8.760 ( 4.524 -7.883 -3.852) 9.872 8.846 ( 1.621 -7.191 -3.451) 8.139 9.101 ( -2.801 -17.029 4.185) 17.758 9.323 ( 3.409 -8.420 -6.980) 11.456 9.579 ( -5.711 -10.149 -4.016) 12.318 9.947 ( 4.494 6.504 9.023) 11.996 10.416 ( 8.344 -5.760 7.202) 12.436 10.934 ( -4.185 1.885 -1.026) 4.703 11.002 ( 8.848 -1.260 1.584) 9.076 11.074 ( 0.681 1.853 -1.232) 2.327 11.201 ( -1.926 3.510 0.190) 4.009 11.463 ( 5.219 1.401 -0.306) 5.412 11.666 ( -1.414 -0.026 -2.623) 2.980 12.045 ( 4.072 2.299 -2.661) 5.380 12.249 ( -1.306 -3.621 2.371) 4.521 13.092 ( 0.029 3.665 0.641) 3.720 13.263 ( -0.130 -1.440 2.076) 2.530 13.667 ( 0.353 7.190 0.166) 7.201 14.038 ( -2.886 8.978 0.901) 9.473 14.069 ( 0.307 -4.094 -0.596) 4.148 14.258 ( -3.069 1.268 0.275) 3.332 14.530 ( 1.075 -2.296 -3.517) 4.336 14.574 ( -1.512 -3.256 -2.999) 4.677 ======================= Grid point 130 (62/260) ======================= q-point: ( 0.10 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.294 ( 17.473 32.068 26.497) 45.120 3.764 ( 9.271 42.480 18.363) 47.198 5.287 ( 6.107 -13.648 10.111) 18.050 5.364 ( 7.711 36.007 15.078) 39.790 5.786 ( 12.191 14.935 -4.980) 19.912 5.966 ( -8.451 23.955 6.485) 26.217 6.319 ( 3.262 -2.077 8.445) 9.288 6.861 ( -5.541 12.651 5.084) 14.717 6.945 ( 6.490 10.981 -2.790) 13.057 7.777 ( 4.264 -7.681 -11.410) 14.401 8.000 ( -12.103 -16.004 -2.041) 20.169 8.540 ( 1.520 -12.627 2.138) 12.897 8.574 ( -6.123 -5.825 -2.005) 8.686 8.773 ( 3.514 -16.266 -10.720) 19.795 8.885 ( 1.348 1.290 5.013) 5.349 9.126 ( 0.450 -12.013 4.829) 12.956 9.294 ( -1.966 -11.839 -0.513) 12.012 9.431 ( -3.776 -8.947 -5.734) 11.278 10.157 ( 7.764 8.675 10.924) 15.965 10.626 ( 6.301 -4.917 6.208) 10.121 10.808 ( -6.964 5.025 -1.877) 8.791 10.941 ( -3.953 1.661 -7.065) 8.264 11.166 ( -0.521 3.201 -1.482) 3.566 11.304 ( 8.303 -7.308 10.578) 15.305 11.520 ( -0.612 1.621 3.250) 3.683 11.653 ( 4.096 0.037 -5.177) 6.602 12.073 ( 0.404 0.903 -1.004) 1.410 12.260 ( 0.332 -5.270 3.013) 6.079 13.103 ( 0.489 4.271 0.514) 4.329 13.275 ( -0.695 -1.241 2.645) 3.003 13.663 ( -0.956 5.665 0.386) 5.758 13.999 ( -1.660 4.373 -1.270) 4.847 14.053 ( -0.731 -1.132 -1.987) 2.400 14.225 ( 0.053 3.036 -0.276) 3.049 14.486 ( -2.172 -1.600 -3.768) 4.634 14.536 ( 0.551 -2.407 -3.317) 4.135 ======================= Grid point 131 (63/260) ======================= q-point: ( 0.20 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.802 ( 10.661 31.607 27.945) 43.515 4.195 ( 20.338 32.879 18.496) 42.857 5.549 ( 11.313 -3.821 10.599) 15.966 5.670 ( 4.624 20.760 14.366) 25.666 5.927 ( 7.132 23.789 5.482) 25.433 6.029 ( 16.857 7.200 -2.763) 18.537 6.481 ( 5.112 7.355 8.664) 12.462 6.775 ( -7.797 13.653 7.324) 17.345 7.103 ( 14.763 7.243 -7.601) 18.116 7.705 ( -10.977 -10.531 -2.168) 15.366 7.792 ( 3.890 -11.597 -16.374) 20.439 8.398 ( -10.518 -10.736 -3.224) 15.372 8.551 ( -3.548 -9.075 4.007) 10.535 8.746 ( 3.037 -14.023 -9.862) 17.411 8.898 ( -4.779 0.029 3.124) 5.709 9.114 ( -4.080 -5.956 1.084) 7.300 9.309 ( 1.248 -7.233 6.566) 9.848 9.435 ( 6.684 -13.895 1.033) 15.454 10.340 ( 1.177 9.013 6.460) 11.152 10.589 ( -7.301 2.007 -7.069) 10.359 10.770 ( -0.647 2.503 -0.477) 2.629 10.841 ( -0.164 0.216 1.039) 1.074 11.148 ( -0.585 2.190 -0.320) 2.290 11.421 ( -1.878 -3.337 3.642) 5.284 11.583 ( 3.823 -1.628 6.560) 7.765 11.696 ( 4.286 -1.164 -5.063) 6.735 12.051 ( -1.662 0.739 -0.347) 1.851 12.302 ( 0.263 -8.214 4.196) 9.227 13.112 ( 0.297 4.776 -0.536) 4.815 13.280 ( -1.363 -1.020 3.027) 3.473 13.645 ( -1.117 3.584 0.275) 3.764 13.920 ( -4.197 -4.650 -4.585) 7.763 14.046 ( 1.903 7.554 -1.942) 8.028 14.254 ( 2.488 3.040 0.715) 3.993 14.422 ( -1.295 -0.485 -2.998) 3.301 14.529 ( 0.957 -2.792 -1.603) 3.359 ======================= Grid point 132 (64/260) ======================= q-point: ( 0.30 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.153 ( 3.354 33.529 25.968) 42.541 4.733 ( 20.958 27.986 15.668) 38.314 5.570 ( -11.881 26.194 8.872) 30.100 5.933 ( 13.416 -1.020 4.947) 14.335 6.287 ( 12.815 -6.198 4.904) 15.056 6.337 ( 10.454 5.152 8.851) 14.634 6.578 ( 8.964 18.300 4.964) 20.973 6.849 ( 8.555 10.901 7.030) 15.539 7.259 ( 4.047 -6.740 -9.967) 12.694 7.533 ( 3.148 -5.120 -2.536) 6.523 7.777 ( 6.522 -0.236 -14.721) 16.102 8.156 ( -11.490 -12.713 -3.409) 17.472 8.484 ( -5.820 -5.329 1.922) 8.122 8.682 ( -5.235 -10.189 -2.072) 11.641 8.808 ( -3.428 -5.154 -3.081) 6.914 9.064 ( -3.135 -2.121 2.321) 4.440 9.395 ( 0.860 -0.550 7.059) 7.133 9.630 ( 9.396 -13.058 6.267) 17.265 10.223 ( -11.729 5.699 -2.680) 13.313 10.406 ( -5.791 1.815 -11.028) 12.588 10.759 ( 0.607 5.884 1.166) 6.029 10.888 ( 0.133 -1.603 3.926) 4.243 11.135 ( -0.587 2.395 -0.587) 2.535 11.406 ( -0.411 -0.833 0.153) 0.941 11.684 ( 1.551 -2.182 1.006) 2.859 11.716 ( 2.210 -2.367 -0.867) 3.353 12.025 ( -0.037 0.347 -1.551) 1.589 12.316 ( -2.742 -9.041 3.490) 10.072 13.105 ( 0.153 4.679 -1.730) 4.991 13.277 ( -1.793 -0.714 3.039) 3.600 13.635 ( -0.195 1.064 0.450) 1.171 13.794 ( -4.358 -5.326 -5.628) 8.890 14.078 ( 2.857 8.320 -1.257) 8.886 14.314 ( 2.741 2.326 1.471) 3.884 14.390 ( -0.021 0.345 -1.950) 1.981 14.545 ( 1.136 -3.004 0.708) 3.289 ======================= Grid point 133 (65/260) ======================= q-point: ( 0.40 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.338 ( -5.273 34.321 19.949) 40.047 5.180 ( 14.078 25.828 9.956) 31.055 5.476 ( -4.167 27.296 11.960) 30.091 5.902 ( -19.058 21.306 2.873) 28.730 6.471 ( 15.074 -3.527 -8.985) 17.899 6.573 ( 4.504 -17.500 6.905) 19.345 6.910 ( 1.932 -12.773 0.282) 12.921 7.007 ( 15.153 -7.703 7.533) 18.592 7.258 ( 3.011 6.948 2.037) 7.842 7.653 ( 0.999 -2.396 -3.711) 4.529 7.803 ( 11.309 9.353 -5.528) 15.682 8.030 ( 3.052 -8.198 -3.341) 9.364 8.403 ( -1.937 -1.442 -3.883) 4.572 8.577 ( -4.970 -9.910 6.289) 12.746 8.711 ( -4.517 -1.179 -3.652) 5.927 9.014 ( -5.440 2.689 3.041) 6.788 9.400 ( -6.783 4.525 3.286) 8.792 9.811 ( 5.457 -6.713 0.877) 8.695 10.058 ( -3.241 -0.863 -1.634) 3.731 10.202 ( -4.364 -1.743 -6.436) 7.969 10.759 ( -1.197 5.925 -0.837) 6.102 10.899 ( -1.275 -2.404 1.546) 3.129 11.114 ( -0.439 3.240 -2.453) 4.087 11.408 ( 0.739 -1.556 -1.590) 2.343 11.653 ( -0.148 -0.673 -6.773) 6.808 11.777 ( 0.993 -2.130 4.723) 5.275 12.025 ( 2.372 -1.706 -3.991) 4.947 12.255 ( -5.479 -7.604 0.317) 9.377 13.098 ( 0.906 3.533 -1.487) 3.938 13.265 ( -1.958 -0.212 2.404) 3.108 13.637 ( -0.301 -0.888 -1.864) 2.087 13.692 ( -1.254 -4.810 -2.753) 5.683 14.124 ( 2.537 7.953 -0.036) 8.348 14.366 ( 1.876 0.653 -0.890) 2.176 14.388 ( 0.169 2.088 2.021) 2.911 14.576 ( 0.558 -3.005 2.614) 4.022 ======================= Grid point 134 (66/260) ======================= q-point: (-0.50 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.271 ( -15.277 35.104 10.338) 39.655 5.351 ( -5.549 24.397 9.983) 26.938 5.463 ( -17.970 24.498 -0.704) 30.390 5.721 ( 9.831 25.774 12.458) 30.268 6.427 ( -11.609 -14.273 -11.784) 21.848 6.558 ( 0.240 -16.248 -9.800) 18.976 7.068 ( 8.812 -16.826 10.884) 21.891 7.208 ( -5.635 9.805 -3.785) 11.926 7.278 ( -1.845 -8.762 10.276) 13.630 7.655 ( 6.292 0.027 4.902) 7.976 7.999 ( 7.075 5.989 -2.816) 9.688 8.113 ( 6.295 -8.400 0.794) 10.527 8.297 ( -4.487 -5.631 -6.088) 9.429 8.590 ( -6.543 0.040 2.027) 6.850 8.731 ( 11.338 2.623 7.912) 14.072 8.926 ( -3.727 9.454 2.016) 10.360 9.240 ( -6.518 1.467 -6.338) 9.209 9.838 ( -7.051 -6.132 -6.226) 11.228 9.936 ( 3.683 1.931 -3.510) 5.442 10.304 ( 8.734 -6.642 6.982) 13.006 10.714 ( -1.460 5.187 -3.157) 6.245 10.873 ( -1.833 -2.586 -0.656) 3.237 11.075 ( -0.449 2.847 -4.542) 5.379 11.383 ( -0.840 -3.493 -5.188) 6.311 11.592 ( -0.093 2.118 -6.396) 6.739 11.822 ( 0.486 -1.245 2.886) 3.181 12.026 ( 1.211 -3.794 -6.184) 7.355 12.150 ( -3.560 -6.041 -1.934) 7.274 13.117 ( 1.903 2.408 -0.453) 3.102 13.245 ( -2.050 0.274 1.417) 2.507 13.581 ( -0.783 -0.824 -4.774) 4.907 13.721 ( 3.402 -4.627 0.800) 5.799 14.167 ( 1.480 7.621 1.415) 7.892 14.369 ( 0.618 0.806 -2.052) 2.289 14.421 ( -0.475 1.631 4.835) 5.125 14.602 ( -0.650 -2.911 3.603) 4.677 ======================= Grid point 135 (67/260) ======================= q-point: (-0.40 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.002 ( -19.875 36.149 4.849) 41.537 4.873 ( -30.138 24.456 -5.917) 39.260 5.521 ( 0.823 27.303 12.963) 30.236 5.913 ( -5.417 -5.088 -0.301) 7.438 6.136 ( -4.384 4.769 -4.193) 7.717 6.392 ( -7.250 -14.360 -5.076) 16.868 7.012 ( -14.920 24.007 1.214) 28.292 7.097 ( -16.587 6.289 8.236) 19.558 7.359 ( 8.037 -21.601 8.070) 24.419 7.838 ( -5.969 -2.896 1.673) 6.842 7.996 ( 8.460 -3.850 2.292) 9.573 8.188 ( -0.401 2.353 -2.834) 3.705 8.304 ( 8.277 -10.007 2.476) 13.220 8.540 ( 0.864 0.630 -0.594) 1.223 8.809 ( -1.593 4.117 2.966) 5.318 9.076 ( -0.245 -7.324 -0.839) 7.376 9.136 ( 9.388 3.997 -1.642) 10.334 9.619 ( -7.177 -8.048 -7.379) 13.066 10.032 ( 6.425 4.064 -2.116) 7.891 10.512 ( 7.927 -6.755 2.430) 10.694 10.656 ( -1.762 4.529 -3.885) 6.222 10.833 ( -0.823 -0.813 -1.133) 1.619 11.039 ( 1.328 1.081 -4.426) 4.746 11.291 ( -2.178 -5.236 -9.436) 11.009 11.544 ( -0.004 4.861 -5.277) 7.175 11.847 ( 0.212 -0.741 1.652) 1.823 11.942 ( -2.221 -2.617 -7.743) 8.469 12.137 ( 2.504 -6.092 -1.463) 6.747 13.151 ( 1.460 1.667 0.257) 2.230 13.217 ( -1.576 0.309 0.489) 1.679 13.550 ( 1.483 2.066 -3.990) 4.732 13.807 ( 5.279 -5.145 0.369) 7.381 14.198 ( -0.079 7.789 2.800) 8.278 14.360 ( -0.296 1.297 -0.724) 1.514 14.447 ( -1.160 -0.011 5.039) 5.171 14.611 ( -1.738 -2.934 3.700) 5.032 ======================= Grid point 136 (68/260) ======================= q-point: (-0.30 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.654 ( -21.998 36.550 3.504) 42.803 4.257 ( -29.823 29.146 -7.335) 42.340 5.559 ( -11.666 5.122 3.264) 13.152 5.630 ( -10.408 -1.848 0.173) 10.572 6.018 ( -9.319 -2.606 -1.182) 9.748 6.385 ( 0.943 18.303 6.972) 19.609 6.704 ( -19.981 28.311 5.485) 35.083 6.851 ( -15.015 6.755 7.940) 18.279 7.487 ( -6.957 -10.323 1.358) 12.523 7.638 ( -3.729 -2.934 2.734) 5.476 8.200 ( 6.473 -2.589 -2.617) 7.447 8.259 ( 10.518 -9.859 0.654) 14.430 8.435 ( 0.859 -6.274 8.951) 10.965 8.595 ( 6.702 1.246 -5.364) 8.674 8.837 ( 2.816 -3.404 -0.777) 4.486 9.010 ( 2.590 -2.264 -8.728) 9.382 9.251 ( -2.858 -14.610 5.055) 15.721 9.518 ( 0.547 -8.613 -0.661) 8.656 10.092 ( 2.333 6.816 -5.762) 9.225 10.552 ( -0.952 -5.467 -7.386) 9.238 10.604 ( 0.882 2.599 -4.816) 5.543 10.882 ( 5.108 0.689 3.070) 5.999 11.063 ( 3.689 -0.438 -1.636) 4.059 11.173 ( -0.281 -5.544 -10.648) 12.008 11.494 ( -1.303 6.689 -4.301) 8.058 11.830 ( -2.314 -2.193 -2.117) 3.828 11.889 ( 2.860 1.781 -4.552) 5.663 12.183 ( 2.860 -5.715 -0.078) 6.391 13.151 ( -1.636 1.624 0.312) 2.326 13.213 ( 0.735 -0.642 0.146) 0.987 13.567 ( 3.236 5.473 -2.838) 6.962 13.909 ( 5.596 -4.745 -0.543) 7.357 14.206 ( -2.292 8.567 3.799) 9.648 14.348 ( -1.187 1.427 1.203) 2.212 14.470 ( -0.298 -2.065 3.879) 4.405 14.605 ( -1.815 -3.326 3.089) 4.889 ======================= Grid point 137 (69/260) ======================= q-point: (-0.20 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.246 ( -25.647 34.889 3.354) 43.431 3.743 ( -20.108 40.454 -1.302) 45.194 5.292 ( -11.836 -25.981 -0.513) 28.555 5.460 ( -15.563 29.600 7.111) 34.190 5.896 ( -4.856 9.446 1.096) 10.678 6.336 ( -14.110 16.411 10.941) 24.251 6.422 ( -15.486 21.296 6.196) 27.050 6.777 ( -0.011 11.303 5.746) 12.679 7.227 ( -14.775 5.317 0.234) 15.704 7.716 ( 5.507 -12.148 -1.841) 13.464 8.284 ( 2.094 -6.844 2.896) 7.721 8.410 ( 5.576 -9.987 0.437) 11.447 8.514 ( 2.007 -7.909 3.287) 8.797 8.659 ( 5.249 1.827 -5.632) 7.912 8.847 ( 1.228 -6.493 -4.418) 7.949 9.077 ( 10.617 -4.365 -6.696) 13.290 9.207 ( -4.364 -19.555 4.660) 20.571 9.571 ( 2.644 -11.203 4.023) 12.194 10.004 ( -5.640 6.180 -5.067) 9.781 10.423 ( -3.495 -6.632 -11.306) 13.566 10.634 ( 5.930 5.121 -2.417) 8.199 11.005 ( 5.212 -0.586 1.243) 5.390 11.075 ( 0.341 -1.596 -4.635) 4.914 11.174 ( 5.678 -3.955 -2.603) 7.393 11.423 ( -2.577 9.052 -3.578) 10.069 11.774 ( -1.430 -1.291 -2.980) 3.549 11.924 ( 4.143 3.262 -3.051) 6.092 12.229 ( 1.543 -4.780 0.986) 5.118 13.119 ( -1.768 2.100 0.113) 2.747 13.230 ( 0.626 -1.388 0.695) 1.673 13.609 ( 3.256 7.615 -1.829) 8.482 13.993 ( 4.076 -3.711 -0.871) 5.580 14.173 ( -4.644 8.660 3.642) 10.480 14.337 ( -1.981 1.334 2.726) 3.624 14.498 ( 1.056 -3.097 1.036) 3.432 14.604 ( -0.550 -4.117 1.984) 4.603 ======================= Grid point 138 (70/260) ======================= q-point: (-0.10 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.869 ( -17.307 39.069 9.171) 43.704 3.516 ( -8.546 46.798 7.748) 48.199 5.154 ( -5.411 -27.095 4.848) 28.052 5.257 ( -12.736 37.578 10.265) 40.983 5.792 ( -5.804 18.141 -2.889) 19.265 6.167 ( -13.268 20.977 12.861) 27.955 6.264 ( -7.166 4.541 5.108) 9.903 6.844 ( 1.628 13.407 3.380) 13.922 7.014 ( -9.026 7.402 1.681) 11.793 7.774 ( 4.670 -9.984 -6.383) 12.738 8.302 ( -5.381 -10.206 7.645) 13.841 8.469 ( 1.441 -16.224 -1.862) 16.394 8.575 ( 5.041 -3.189 -1.904) 6.262 8.707 ( 4.455 -1.373 -3.449) 5.798 8.844 ( 2.495 -8.031 -4.694) 9.631 9.140 ( -3.337 -17.459 2.702) 17.979 9.253 ( 9.395 -8.202 -5.485) 13.625 9.647 ( 0.783 -12.404 1.555) 12.525 9.883 ( -3.248 6.039 1.517) 7.022 10.306 ( 0.020 -5.959 -3.353) 6.837 10.771 ( 9.816 4.460 0.809) 10.812 11.026 ( -1.646 -2.371 -3.404) 4.463 11.084 ( 2.202 1.042 -0.986) 2.628 11.232 ( -0.072 -0.106 0.120) 0.176 11.383 ( 3.306 6.975 -3.457) 8.458 11.721 ( -2.105 -0.724 -2.042) 3.020 11.984 ( 5.036 3.529 -3.193) 6.929 12.251 ( -0.394 -3.868 1.727) 4.255 13.095 ( -0.897 2.897 0.327) 3.050 13.247 ( 0.255 -1.568 1.409) 2.123 13.648 ( 2.042 8.022 -0.803) 8.316 14.042 ( 1.861 -2.036 -0.118) 2.761 14.107 ( -4.810 7.358 2.141) 9.048 14.310 ( -3.385 0.876 2.253) 4.160 14.523 ( 1.999 -2.647 -2.054) 3.901 14.607 ( -0.412 -4.468 -0.282) 4.496 ======================= Grid point 139 (71/260) ======================= q-point: ( 0.00 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.668 ( 2.072 39.263 14.877) 42.038 4.390 ( -1.276 6.215 7.918) 10.147 4.501 ( 3.203 -2.161 13.426) 13.970 5.192 ( 0.644 -30.385 7.831) 31.384 6.211 ( 0.523 24.943 -3.837) 25.241 6.458 ( -8.034 13.732 7.879) 17.753 6.755 ( 1.320 6.020 0.761) 6.210 6.977 ( -5.264 12.368 3.229) 13.824 7.018 ( -1.120 15.591 6.533) 16.941 7.807 ( 4.089 -0.883 -6.583) 7.800 7.915 ( -1.158 -21.901 0.062) 21.932 8.105 ( -5.429 -7.668 4.550) 10.439 8.440 ( -0.792 -6.346 -5.171) 8.224 8.585 ( -6.836 -11.951 -1.992) 13.911 8.811 ( 3.686 0.580 2.097) 4.280 8.857 ( 3.573 -5.263 3.447) 7.235 9.263 ( 0.521 2.339 -6.148) 6.598 9.381 ( -2.202 -8.501 -5.486) 10.354 10.106 ( 6.192 8.455 8.992) 13.809 10.274 ( 7.363 -7.918 8.656) 13.850 10.958 ( -0.441 0.792 -1.911) 2.115 10.976 ( 3.966 -1.099 -0.453) 4.141 11.148 ( 1.127 4.479 -0.240) 4.624 11.220 ( 0.280 -1.890 -0.484) 1.971 11.532 ( 2.303 4.906 -2.565) 5.995 11.626 ( -0.036 -3.727 -3.256) 4.949 12.101 ( 1.342 3.205 -0.442) 3.503 12.173 ( -0.598 -3.795 1.255) 4.042 13.165 ( 0.483 3.341 0.849) 3.481 13.223 ( 0.279 -2.398 1.514) 2.849 13.812 ( -0.467 7.067 -0.357) 7.092 13.953 ( -0.542 -6.712 -0.786) 6.779 14.201 ( -2.590 6.596 0.681) 7.119 14.279 ( -2.564 -0.678 0.909) 2.804 14.490 ( 0.885 -0.889 -3.441) 3.662 14.511 ( -0.071 -2.580 -2.860) 3.852 ======================= Grid point 140 (72/260) ======================= q-point: ( 0.10 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.964 ( 13.216 33.568 19.651) 41.081 4.513 ( 5.690 10.662 11.271) 16.526 4.764 ( 10.893 -5.147 17.953) 21.620 5.332 ( 5.773 -28.604 11.520) 31.372 6.250 ( 8.113 22.175 -5.773) 24.308 6.377 ( -7.245 16.823 5.376) 19.090 6.839 ( 6.842 -6.270 -1.557) 9.410 6.924 ( -4.558 4.390 4.782) 7.932 7.078 ( 2.968 33.028 6.202) 33.736 7.795 ( -1.661 -2.135 -5.675) 6.287 7.886 ( -0.536 3.902 -3.644) 5.366 8.073 ( -0.658 -23.468 5.759) 24.173 8.347 ( -5.871 -11.310 -4.927) 13.663 8.443 ( -1.356 -15.709 -9.484) 18.400 8.920 ( 3.646 2.046 5.710) 7.077 8.973 ( 3.942 -3.848 6.192) 8.288 9.179 ( -3.402 0.562 -3.849) 5.167 9.266 ( -4.010 -6.898 -5.288) 9.572 10.337 ( 7.924 8.687 10.912) 16.042 10.500 ( 6.742 -7.258 9.060) 13.424 10.901 ( -3.416 3.917 -2.811) 5.909 10.957 ( -3.045 -1.023 -4.753) 5.737 11.205 ( -1.484 0.277 3.515) 3.825 11.215 ( 2.521 -1.268 4.489) 5.302 11.567 ( 2.765 2.954 -1.568) 4.339 11.626 ( 3.865 -2.468 -4.892) 6.705 12.105 ( -0.824 2.292 0.311) 2.456 12.168 ( -1.121 -3.859 1.659) 4.347 13.184 ( 0.466 3.480 1.344) 3.760 13.241 ( -0.108 -2.177 2.146) 3.059 13.780 ( -2.131 5.943 -1.378) 6.462 13.906 ( -3.019 -6.410 -2.461) 7.501 14.183 ( 0.609 6.594 -0.920) 6.686 14.262 ( 0.367 -0.590 -0.109) 0.703 14.457 ( -1.055 -0.446 -3.237) 3.433 14.482 ( -0.244 -2.493 -2.754) 3.723 ======================= Grid point 141 (73/260) ======================= q-point: ( 0.20 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.413 ( 15.226 28.535 20.659) 38.378 4.781 ( 12.491 12.487 12.773) 21.797 5.181 ( 16.411 -7.259 20.268) 27.071 5.589 ( 10.184 -25.699 14.123) 31.042 6.270 ( -8.637 21.425 3.798) 23.411 6.396 ( 12.905 15.299 -7.037) 21.216 6.827 ( -7.519 -3.857 3.203) 9.037 6.968 ( 7.450 -14.911 -6.111) 17.753 7.263 ( 9.600 42.484 9.234) 44.523 7.614 ( -11.644 5.873 -3.044) 13.392 7.889 ( 5.156 7.962 -7.608) 12.160 8.113 ( -4.557 -13.519 -2.117) 14.423 8.196 ( -1.424 -21.146 2.592) 21.351 8.398 ( 5.426 -18.962 -12.025) 23.100 8.928 ( -6.532 3.690 0.334) 7.509 9.024 ( -3.345 -4.648 1.684) 5.969 9.205 ( 5.654 -1.866 7.281) 9.406 9.237 ( 4.786 -5.053 1.665) 7.156 10.492 ( -0.522 5.832 3.463) 6.803 10.579 ( -3.473 -2.698 -1.974) 4.820 10.834 ( -1.289 3.094 1.646) 3.734 10.860 ( -2.360 0.590 -1.195) 2.710 11.204 ( -0.804 3.530 3.280) 4.885 11.304 ( 0.610 -6.265 6.705) 9.197 11.609 ( 3.426 2.647 -1.296) 4.519 11.662 ( 3.951 -2.281 -5.051) 6.806 12.082 ( -2.022 2.552 0.942) 3.389 12.162 ( -1.412 -5.462 2.398) 6.130 13.199 ( 0.036 3.605 0.991) 3.739 13.253 ( -0.608 -1.792 2.286) 2.968 13.717 ( -2.778 3.803 -2.491) 5.328 13.809 ( -4.114 -5.333 -4.436) 8.065 14.201 ( 2.391 6.627 -1.847) 7.284 14.286 ( 2.236 -1.072 -0.441) 2.518 14.417 ( -0.668 0.887 -1.481) 1.851 14.464 ( 0.127 -3.209 -0.784) 3.306 ======================= Grid point 142 (74/260) ======================= q-point: ( 0.30 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.804 ( 8.759 29.500 18.843) 36.084 5.163 ( 16.458 6.338 12.427) 21.574 5.654 ( 15.051 -7.136 18.508) 24.900 5.919 ( 12.809 -17.928 12.733) 25.448 6.136 ( -8.371 22.386 4.001) 24.232 6.562 ( 6.858 -8.372 -2.009) 11.007 6.711 ( -3.474 10.472 -1.191) 11.097 6.957 ( -4.027 -7.876 -10.486) 13.719 7.416 ( -2.251 7.650 -3.750) 8.812 7.524 ( 6.899 15.557 6.756) 18.310 7.864 ( -4.161 -3.636 0.617) 5.560 8.040 ( 7.939 17.454 -11.984) 22.612 8.255 ( 0.534 -19.968 6.117) 20.891 8.400 ( 2.222 -16.841 -7.733) 18.664 8.805 ( -3.716 5.785 -2.337) 7.262 8.972 ( -0.996 -8.228 -0.181) 8.290 9.385 ( 5.702 -0.207 7.968) 9.800 9.421 ( 8.551 -5.342 9.005) 13.519 10.336 ( -12.206 4.895 -5.578) 14.285 10.406 ( -9.125 -1.815 -8.384) 12.525 10.844 ( -0.364 2.217 2.268) 3.192 10.868 ( -0.774 -0.671 3.699) 3.839 11.224 ( 0.321 6.115 1.498) 6.304 11.345 ( 0.173 -4.951 1.746) 5.253 11.665 ( 2.681 0.009 -0.106) 2.683 11.679 ( 2.264 -1.282 -3.352) 4.243 12.052 ( -1.680 2.769 -0.024) 3.239 12.149 ( -2.286 -6.821 1.913) 7.444 13.198 ( -0.553 4.058 -0.184) 4.099 13.256 ( -0.973 -1.653 1.861) 2.673 13.649 ( -2.041 0.961 -2.280) 3.208 13.696 ( -3.571 -3.820 -4.923) 7.182 14.234 ( 2.958 6.538 -2.146) 7.490 14.325 ( 2.652 -2.081 -1.474) 3.679 14.413 ( 0.171 2.379 1.532) 2.835 14.476 ( 0.526 -3.530 1.873) 4.030 ======================= Grid point 143 (75/260) ======================= q-point: ( 0.40 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.027 ( -0.472 32.491 13.791) 35.300 5.525 ( 10.938 -5.148 10.183) 15.806 5.868 ( -1.659 9.718 4.955) 11.034 6.085 ( -5.270 12.946 6.766) 15.529 6.258 ( 13.153 -12.238 6.191) 19.003 6.563 ( -4.743 -17.163 4.961) 18.484 6.633 ( -11.643 10.229 -6.494) 16.804 6.819 ( 7.954 -5.459 -1.867) 9.826 7.405 ( 3.414 5.960 -3.885) 7.891 7.643 ( 7.567 -15.499 -1.660) 17.327 7.862 ( -4.063 17.239 7.832) 19.366 8.081 ( 2.404 5.256 -5.747) 8.151 8.318 ( -3.673 -10.166 4.209) 11.600 8.360 ( 6.266 -6.677 -4.305) 10.119 8.800 ( 5.812 10.017 -2.978) 11.958 8.995 ( 2.066 -5.984 1.193) 6.442 9.512 ( -0.805 5.554 5.980) 8.200 9.640 ( 6.816 -8.042 6.202) 12.231 10.076 ( -8.388 2.782 -4.742) 10.029 10.149 ( -9.322 -3.623 -7.027) 12.223 10.834 ( -1.794 1.839 0.011) 2.569 10.862 ( -1.826 -1.391 1.183) 2.582 11.220 ( -0.252 6.654 -3.316) 7.439 11.342 ( -0.142 -4.775 -3.080) 5.684 11.673 ( 1.368 2.240 -2.808) 3.844 11.729 ( 1.897 -2.833 2.930) 4.496 12.017 ( -0.890 1.677 -3.001) 3.551 12.103 ( -3.262 -6.514 -0.945) 7.346 13.183 ( -0.315 4.290 -0.781) 4.372 13.249 ( -1.056 -1.855 1.031) 2.370 13.607 ( -1.254 -1.313 -3.694) 4.117 13.616 ( -0.379 -2.204 -1.710) 2.815 14.270 ( 2.748 6.040 -1.761) 6.865 14.353 ( 2.231 -2.111 -2.402) 3.899 14.441 ( -0.241 2.942 4.305) 5.220 14.507 ( -0.031 -3.578 3.991) 5.360 ======================= Grid point 144 (76/260) ======================= q-point: (-0.50 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.988 ( -11.755 34.724 5.025) 37.002 5.618 ( -10.120 -21.954 3.836) 24.476 5.894 ( -9.335 18.527 1.666) 20.813 5.931 ( -2.345 21.162 -0.930) 21.312 6.259 ( -15.432 -14.387 -11.500) 24.029 6.335 ( 2.589 -8.288 -1.053) 8.747 6.783 ( 10.816 2.597 15.455) 19.042 7.045 ( 7.960 -14.258 11.731) 20.106 7.489 ( 7.208 15.052 -2.453) 16.868 7.750 ( -3.775 4.574 2.726) 6.527 7.833 ( 6.087 -11.102 -0.447) 12.669 7.989 ( -9.917 -8.672 2.019) 13.328 8.315 ( 4.080 6.003 -2.640) 7.723 8.462 ( 3.714 -7.597 1.335) 8.561 8.921 ( 4.640 9.681 1.984) 10.917 9.027 ( -0.957 0.016 2.620) 2.789 9.388 ( -9.788 11.488 -5.090) 15.927 9.643 ( -9.172 -12.296 -4.208) 15.907 10.004 ( 5.302 5.184 -0.494) 7.432 10.146 ( 8.211 -8.227 4.046) 12.308 10.791 ( -1.542 2.499 -2.363) 3.769 10.831 ( -1.452 -1.820 -0.890) 2.493 11.161 ( -1.364 5.553 -6.598) 8.731 11.280 ( -1.722 -5.798 -7.304) 9.483 11.680 ( 1.089 5.492 -1.521) 5.802 11.783 ( 0.998 -3.657 2.903) 4.775 11.970 ( -0.151 -0.214 -5.837) 5.843 12.028 ( -1.831 -5.183 -3.502) 6.517 13.180 ( 0.564 3.416 -0.683) 3.529 13.235 ( -1.042 -1.603 0.146) 1.917 13.575 ( 1.254 0.944 -2.973) 3.362 13.629 ( 2.579 -4.028 -0.541) 4.814 14.303 ( 2.180 5.313 -1.044) 5.837 14.368 ( 1.608 -1.247 -2.207) 3.002 14.465 ( -1.923 2.759 5.803) 6.707 14.534 ( -1.474 -3.721 5.181) 6.547 ======================= Grid point 145 (77/260) ======================= q-point: (-0.40 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.733 ( -17.451 35.031 0.188) 39.138 5.294 ( -22.858 2.867 -2.718) 23.197 5.494 ( -18.980 -9.679 -11.069) 24.009 5.850 ( -17.203 -20.707 -9.224) 28.457 6.086 ( 5.225 24.088 8.470) 26.063 6.483 ( 8.383 -5.876 5.266) 11.512 7.070 ( 4.444 2.195 12.965) 13.880 7.181 ( -3.209 -0.163 9.247) 9.789 7.519 ( -3.896 21.629 2.070) 22.074 7.732 ( -3.347 -2.091 2.210) 4.523 7.832 ( -2.337 -10.706 4.258) 11.757 7.976 ( 7.703 -16.452 -4.168) 18.638 8.387 ( 3.709 9.475 1.797) 10.333 8.532 ( 3.698 -3.458 1.216) 5.206 8.890 ( -7.718 5.301 0.867) 9.404 9.003 ( -5.146 -2.962 3.387) 6.836 9.224 ( -3.245 5.913 -6.245) 9.192 9.407 ( -8.595 -11.342 -4.597) 14.955 10.158 ( 9.741 8.349 -2.152) 13.009 10.345 ( 9.185 -9.307 -0.385) 13.081 10.745 ( -0.903 3.944 -3.195) 5.156 10.808 ( 0.303 -2.129 -0.997) 2.370 11.079 ( -0.733 3.255 -6.476) 7.285 11.171 ( -2.214 -5.583 -8.969) 10.794 11.673 ( 0.303 6.849 -3.352) 7.632 11.799 ( -0.764 -4.917 -0.537) 5.005 11.927 ( 1.455 2.178 -4.658) 5.344 12.012 ( 2.247 -5.649 -1.775) 6.333 13.186 ( 0.562 1.713 -0.865) 1.999 13.214 ( -1.003 -0.833 -0.577) 1.426 13.605 ( 4.032 3.608 -1.897) 5.733 13.698 ( 5.063 -5.335 -0.212) 7.358 14.334 ( 1.786 4.786 -0.230) 5.113 14.377 ( 1.113 -0.063 -1.466) 1.842 14.463 ( -3.888 2.180 6.411) 7.808 14.537 ( -3.035 -4.223 5.414) 7.507 ======================= Grid point 146 (78/260) ======================= q-point: (-0.30 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.369 ( -21.588 33.533 -1.639) 39.915 4.850 ( -20.320 22.280 -3.462) 30.353 5.051 ( -19.962 -20.996 -8.126) 30.089 5.510 ( -13.227 -28.502 -4.680) 31.768 6.230 ( 2.723 26.027 7.412) 27.198 6.669 ( 6.368 -9.918 5.176) 12.873 6.989 ( -16.835 14.725 10.356) 24.648 7.238 ( -3.948 -7.208 4.667) 9.451 7.406 ( -10.342 31.977 3.845) 33.827 7.645 ( -2.908 2.261 3.846) 5.326 7.957 ( 7.035 -15.009 2.521) 16.767 8.041 ( 2.153 -17.758 -1.554) 17.955 8.463 ( -0.086 10.147 6.687) 12.153 8.630 ( 6.760 -0.644 -1.710) 7.003 8.772 ( -2.791 -1.437 -3.020) 4.356 8.909 ( -6.279 -12.867 1.064) 14.356 9.105 ( -2.582 6.733 -4.579) 8.542 9.306 ( -2.139 -11.291 0.563) 11.506 10.245 ( 2.666 7.990 -7.659) 11.384 10.406 ( 0.913 -7.762 -8.312) 11.409 10.716 ( 1.971 6.852 -3.835) 8.095 10.846 ( 4.327 -4.759 -0.603) 6.460 11.057 ( 2.558 0.040 -2.408) 3.513 11.079 ( 0.069 -2.666 -6.146) 6.700 11.641 ( -0.084 6.936 -4.534) 8.287 11.760 ( -0.568 -4.717 -4.077) 6.261 11.952 ( 3.153 4.373 -1.048) 5.492 12.060 ( 3.190 -6.032 0.308) 6.830 13.178 ( -0.558 1.081 -0.982) 1.563 13.197 ( 0.005 -0.822 -0.702) 1.081 13.679 ( 5.112 5.695 -1.220) 7.750 13.798 ( 5.762 -5.900 -0.360) 8.255 14.365 ( 1.004 6.034 1.063) 6.208 14.383 ( -0.220 1.845 0.210) 1.870 14.436 ( -3.764 -0.480 5.033) 6.303 14.517 ( -3.306 -5.309 4.323) 7.603 ======================= Grid point 147 (79/260) ======================= q-point: (-0.20 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.953 ( -21.329 34.812 0.226) 40.828 4.542 ( -12.275 29.460 1.361) 31.944 4.668 ( -16.047 -24.120 -2.807) 29.106 5.287 ( -9.024 -31.232 -0.223) 32.510 6.299 ( -0.645 26.646 3.935) 26.943 6.727 ( -13.237 -0.181 8.962) 15.987 6.816 ( -0.993 6.423 3.263) 7.272 7.081 ( -12.765 1.406 5.091) 13.814 7.245 ( -11.432 29.759 4.489) 32.194 7.697 ( 4.714 7.277 0.070) 8.671 8.022 ( -2.395 -24.118 -0.209) 24.238 8.086 ( 3.359 -17.453 2.746) 17.985 8.484 ( -3.330 9.222 7.033) 12.066 8.711 ( 4.291 2.886 -5.691) 7.690 8.736 ( 0.395 -7.527 -1.100) 7.618 8.825 ( -3.354 -14.094 0.933) 14.518 9.111 ( 6.361 6.870 -2.998) 9.831 9.318 ( 2.644 -12.503 1.513) 12.869 10.140 ( -5.067 7.054 -7.361) 11.385 10.284 ( -4.266 -7.029 -9.254) 12.379 10.766 ( 6.372 7.471 -3.736) 10.506 10.917 ( 4.945 -6.899 -3.911) 9.346 11.081 ( 2.641 1.479 -0.538) 3.074 11.116 ( 4.350 -1.995 -0.327) 4.797 11.595 ( -0.962 7.485 -4.142) 8.608 11.717 ( -0.665 -4.438 -3.925) 5.962 12.009 ( 3.480 5.016 -0.306) 6.113 12.120 ( 2.507 -5.703 1.025) 6.313 13.160 ( -0.428 1.970 -0.652) 2.119 13.198 ( 0.359 -1.716 -0.175) 1.762 13.756 ( 3.926 6.889 -0.842) 7.974 13.889 ( 4.331 -6.113 -0.524) 7.510 14.336 ( -5.423 6.545 3.709) 9.274 14.381 ( -3.087 2.495 3.602) 5.360 14.441 ( 2.282 -1.933 -0.651) 3.060 14.506 ( -0.163 -5.503 1.299) 5.657 ======================= Grid point 148 (80/260) ======================= q-point: (-0.10 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.666 ( -11.911 39.212 7.114) 41.594 4.418 ( -5.281 41.545 5.195) 42.200 4.444 ( -8.263 -37.068 5.280) 38.343 5.178 ( -4.451 -31.456 3.880) 32.005 6.270 ( -3.403 25.991 -0.834) 26.226 6.556 ( -11.750 13.891 10.144) 20.831 6.788 ( -3.825 1.414 -1.036) 4.208 6.988 ( -3.795 0.070 8.797) 9.581 7.084 ( -8.918 29.181 2.953) 30.656 7.771 ( 4.755 3.566 -3.876) 7.096 7.957 ( -3.724 -27.159 0.382) 27.416 8.135 ( -0.982 -12.647 3.290) 13.104 8.476 ( -1.721 3.521 1.740) 4.288 8.689 ( -2.710 -6.422 -1.332) 7.097 8.757 ( 2.331 -1.855 -1.438) 3.308 8.802 ( -0.055 -9.638 1.503) 9.755 9.229 ( 7.778 4.521 -4.409) 10.019 9.396 ( 3.936 -11.182 -1.519) 11.952 10.024 ( -2.068 7.432 0.015) 7.714 10.173 ( -0.754 -7.067 -1.338) 7.232 10.869 ( 7.034 4.841 -1.536) 8.676 10.959 ( 2.572 -3.915 -2.745) 5.430 11.128 ( 2.260 2.817 -0.649) 3.669 11.189 ( 3.615 -2.996 -0.775) 4.759 11.544 ( -0.664 7.566 -3.461) 8.347 11.668 ( -1.317 -4.486 -3.099) 5.609 12.065 ( 2.881 4.490 -0.474) 5.356 12.161 ( 0.918 -4.780 1.134) 4.998 13.155 ( 0.127 2.846 0.049) 2.849 13.207 ( 0.429 -2.269 0.655) 2.401 13.803 ( 1.753 7.318 -0.406) 7.536 13.943 ( 2.035 -6.351 -0.441) 6.684 14.262 ( -5.289 6.377 2.697) 8.713 14.332 ( -4.554 -0.149 2.802) 5.349 14.480 ( 2.771 -0.672 -2.400) 3.727 14.520 ( 1.065 -3.889 -1.261) 4.225 ======================= Grid point 189 (81/260) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.585 ( 25.014 0.000 38.014) 45.506 1.910 ( -13.438 0.000 45.944) 47.869 3.320 ( -17.274 0.000 79.768) 81.617 4.618 ( -6.202 0.000 -9.595) 11.425 5.233 ( -5.031 0.000 5.207) 7.241 6.271 ( -7.516 0.000 8.682) 11.484 6.304 ( -13.473 0.000 10.959) 17.367 6.685 ( 5.603 0.000 13.353) 14.481 7.072 ( -2.086 0.000 9.840) 10.058 8.283 ( 3.285 0.000 1.846) 3.768 8.486 ( 4.804 0.000 -12.087) 13.006 8.595 ( -2.030 0.000 -6.810) 7.106 8.650 ( 8.518 0.000 -8.565) 12.080 8.869 ( -2.441 0.000 2.043) 3.183 9.367 ( -0.534 0.000 0.843) 0.998 9.412 ( 1.262 0.000 -18.984) 19.026 9.733 ( -2.260 0.000 -0.620) 2.344 9.892 ( 7.347 0.000 0.076) 7.347 10.036 ( -4.734 0.000 3.870) 6.115 10.573 ( 2.226 0.000 -3.687) 4.307 10.704 ( -6.905 0.000 -0.704) 6.941 11.031 ( 2.665 0.000 -0.327) 2.685 11.034 ( -0.091 0.000 -3.360) 3.361 11.415 ( 7.920 0.000 -1.486) 8.058 11.559 ( -6.100 0.000 3.418) 6.992 11.658 ( 6.586 0.000 -4.755) 8.123 12.230 ( -2.409 0.000 3.295) 4.081 12.251 ( 38.377 0.000 -1.733) 38.416 12.998 ( -3.334 0.000 2.485) 4.158 13.171 ( 2.634 0.000 0.312) 2.652 13.485 ( 4.292 0.000 4.710) 6.373 13.735 ( -4.182 0.000 3.957) 5.758 14.107 ( 6.083 0.000 -0.954) 6.157 14.294 ( -3.996 0.000 -3.134) 5.078 14.472 ( -21.360 0.000 -1.814) 21.437 14.504 ( 1.172 0.000 -4.820) 4.961 ======================= Grid point 190 (82/260) ======================= q-point: ( 0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.246 ( 8.174 0.000 41.282) 42.084 2.608 ( 42.539 0.000 34.733) 54.917 3.810 ( 2.618 0.000 72.024) 72.071 4.593 ( 13.675 0.000 -12.740) 18.690 5.213 ( -4.093 0.000 8.856) 9.756 6.159 ( -8.582 0.000 4.222) 9.565 6.175 ( -10.540 0.000 7.802) 13.113 6.930 ( 7.844 0.000 15.464) 17.339 7.167 ( 2.933 0.000 11.383) 11.755 8.315 ( 0.378 0.000 -4.334) 4.350 8.453 ( 1.089 0.000 -6.150) 6.246 8.514 ( -0.943 0.000 -6.441) 6.510 8.579 ( -6.526 0.000 -12.028) 13.684 8.890 ( 1.687 0.000 3.743) 4.106 9.273 ( 1.354 0.000 -19.875) 19.921 9.393 ( 3.671 0.000 -2.103) 4.231 9.624 ( -9.757 0.000 0.518) 9.771 9.977 ( -4.566 0.000 4.325) 6.289 10.056 ( 7.458 0.000 5.417) 9.217 10.518 ( -10.733 0.000 -5.363) 11.998 10.575 ( 2.374 0.000 -7.482) 7.850 11.011 ( 0.620 0.000 -2.571) 2.645 11.106 ( 3.985 0.000 3.450) 5.271 11.366 ( -8.516 0.000 1.082) 8.585 11.614 ( 7.810 0.000 -0.691) 7.840 11.739 ( 5.751 0.000 -3.172) 6.568 12.175 ( -5.814 0.000 1.446) 5.991 12.661 ( 11.260 0.000 -7.698) 13.640 12.995 ( 1.449 0.000 0.805) 1.657 13.249 ( 4.969 0.000 1.541) 5.202 13.576 ( 0.539 0.000 4.350) 4.383 13.726 ( -1.389 0.000 3.766) 4.014 14.163 ( -2.496 0.000 -5.283) 5.843 14.171 ( -10.210 0.000 3.943) 10.944 14.213 ( 1.901 0.000 -0.389) 1.941 14.508 ( 3.145 0.000 -3.071) 4.396 ======================= Grid point 191 (83/260) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.824 ( 19.069 0.000 33.795) 38.803 3.459 ( 9.799 0.000 50.177) 51.125 4.678 ( 38.201 0.000 41.904) 56.703 4.856 ( 22.837 0.000 -10.140) 24.986 5.201 ( -10.638 0.000 19.565) 22.270 6.033 ( -8.967 0.000 3.376) 9.581 6.105 ( 4.615 0.000 -5.603) 7.259 7.216 ( 9.589 0.000 13.502) 16.561 7.376 ( 7.856 0.000 15.181) 17.094 8.221 ( -3.894 0.000 -8.722) 9.551 8.310 ( -9.948 0.000 -12.476) 15.957 8.358 ( -3.836 0.000 -12.632) 13.201 8.505 ( 1.036 0.000 3.038) 3.210 8.889 ( -6.573 0.000 2.767) 7.132 9.127 ( 0.363 0.000 -18.771) 18.774 9.404 ( -7.780 0.000 -4.198) 8.841 9.467 ( 0.144 0.000 2.169) 2.173 9.944 ( -1.644 0.000 1.352) 2.129 10.226 ( -11.836 0.000 -9.760) 15.341 10.242 ( 3.951 0.000 9.057) 9.881 10.523 ( -0.979 0.000 -8.014) 8.073 11.011 ( 1.195 0.000 -2.040) 2.364 11.214 ( 3.783 0.000 3.726) 5.310 11.232 ( -6.628 0.000 0.987) 6.701 11.736 ( 7.087 0.000 -3.547) 7.925 11.814 ( 4.731 0.000 -1.618) 5.000 12.049 ( -7.561 0.000 -1.435) 7.696 12.663 ( -1.978 0.000 -5.961) 6.281 13.026 ( 1.345 0.000 -0.519) 1.442 13.370 ( 6.146 0.000 2.460) 6.620 13.566 ( -6.714 0.000 6.477) 9.329 13.730 ( 0.029 0.000 3.856) 3.856 14.032 ( -5.269 0.000 -5.621) 7.704 14.158 ( 3.483 0.000 1.873) 3.955 14.252 ( 2.475 0.000 -2.703) 3.665 14.568 ( 4.241 0.000 0.434) 4.263 ======================= Grid point 192 (84/260) ======================= q-point: ( 0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.466 ( 22.253 0.000 27.595) 35.450 3.865 ( -12.848 0.000 56.293) 57.740 5.077 ( -15.760 0.000 20.663) 25.987 5.086 ( -0.068 0.000 3.277) 3.278 5.795 ( 42.119 0.000 23.998) 48.476 6.003 ( 12.662 0.000 -11.072) 16.820 6.285 ( 23.824 0.000 -6.731) 24.757 7.480 ( 8.171 0.000 8.689) 11.927 7.700 ( 11.075 0.000 18.818) 21.835 8.045 ( -7.662 0.000 -7.479) 10.707 8.056 ( -6.435 0.000 -8.623) 10.759 8.106 ( -11.408 0.000 -14.579) 18.512 8.565 ( 2.972 0.000 2.215) 3.707 8.701 ( -13.033 0.000 -1.329) 13.101 8.978 ( -1.378 0.000 -14.180) 14.247 9.165 ( -18.435 0.000 6.199) 19.449 9.520 ( 6.870 0.000 -9.674) 11.865 9.872 ( -13.514 0.000 -13.338) 18.987 9.940 ( -0.358 0.000 1.294) 1.343 10.419 ( 4.401 0.000 10.432) 11.322 10.419 ( -2.349 0.000 -7.333) 7.700 11.007 ( -0.235 0.000 -1.809) 1.824 11.143 ( -3.314 0.000 -0.928) 3.441 11.275 ( 0.467 0.000 -0.122) 0.483 11.805 ( 5.256 0.000 -7.277) 8.976 11.886 ( 3.873 0.000 -0.178) 3.878 11.900 ( -5.819 0.000 -3.249) 6.664 12.536 ( -6.370 0.000 -4.489) 7.793 13.045 ( 1.531 0.000 -0.808) 1.731 13.473 ( -7.589 0.000 4.507) 8.826 13.501 ( 5.394 0.000 2.234) 5.838 13.800 ( 2.665 0.000 5.338) 5.966 13.892 ( -4.586 0.000 -5.136) 6.885 14.259 ( 4.952 0.000 2.030) 5.352 14.264 ( 1.949 0.000 -3.342) 3.869 14.653 ( 3.280 0.000 2.402) 4.066 ======================= Grid point 193 (85/260) ======================= q-point: ( 0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.936 ( -27.694 0.000 48.808) 56.118 4.078 ( 20.942 0.000 23.206) 31.258 4.881 ( -26.400 0.000 12.446) 29.187 4.986 ( -15.047 0.000 28.062) 31.842 6.260 ( 25.377 0.000 -21.723) 33.405 6.382 ( 20.807 0.000 -6.154) 21.698 6.993 ( 38.011 0.000 11.937) 39.841 7.599 ( -0.595 0.000 1.185) 1.326 7.668 ( -21.553 0.000 -13.908) 25.651 7.884 ( -2.436 0.000 -4.456) 5.079 7.977 ( 4.286 0.000 6.106) 7.460 8.073 ( 7.244 0.000 14.829) 16.504 8.457 ( -10.089 0.000 -2.770) 10.462 8.631 ( 1.271 0.000 0.597) 1.404 8.844 ( -20.089 0.000 5.213) 20.755 8.855 ( 0.039 0.000 -8.839) 8.839 9.529 ( 3.798 0.000 -11.882) 12.474 9.552 ( -6.837 0.000 -16.070) 17.464 9.931 ( -1.201 0.000 -0.282) 1.233 10.367 ( 2.728 0.000 -3.563) 4.487 10.571 ( 2.785 0.000 9.763) 10.153 10.969 ( -2.051 0.000 -2.274) 3.062 11.079 ( -1.754 0.000 -4.323) 4.665 11.219 ( -3.120 0.000 -6.642) 7.338 11.796 ( -2.785 0.000 -3.010) 4.100 11.804 ( 3.044 0.000 -11.077) 11.487 11.952 ( 2.934 0.000 0.863) 3.058 12.378 ( -7.009 0.000 -3.004) 7.626 13.073 ( 2.229 0.000 -0.740) 2.349 13.377 ( -6.132 0.000 2.611) 6.664 13.564 ( -0.523 0.000 -0.852) 1.000 13.813 ( 0.785 0.000 -2.952) 3.055 13.897 ( 2.177 0.000 6.622) 6.970 14.274 ( 1.782 0.000 -2.128) 2.775 14.366 ( 4.296 0.000 3.480) 5.529 14.716 ( 1.168 0.000 2.638) 2.885 ======================= Grid point 194 (86/260) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.703 ( -36.674 0.000 39.647) 54.008 4.375 ( -34.249 0.000 17.233) 38.340 4.644 ( 14.813 0.000 17.624) 23.022 4.983 ( -14.359 0.000 30.772) 33.957 6.444 ( 14.439 0.000 -23.006) 27.162 6.531 ( -8.634 0.000 -1.387) 8.744 7.132 ( -15.034 0.000 -11.240) 18.772 7.429 ( 5.816 0.000 -4.741) 7.504 7.537 ( -6.581 0.000 1.420) 6.733 8.013 ( -20.774 0.000 11.417) 23.705 8.154 ( 27.181 0.000 8.764) 28.559 8.207 ( 6.297 0.000 2.077) 6.630 8.342 ( 0.207 0.000 -1.544) 1.558 8.558 ( -5.865 0.000 -4.474) 7.376 8.716 ( 2.410 0.000 10.022) 10.308 8.905 ( 10.830 0.000 -4.767) 11.832 9.377 ( 1.912 0.000 -14.864) 14.986 9.486 ( 3.137 0.000 -9.710) 10.204 9.905 ( -0.103 0.000 -2.607) 2.609 10.455 ( 7.518 0.000 0.588) 7.541 10.678 ( 1.100 0.000 6.795) 6.883 10.885 ( -4.141 0.000 -5.495) 6.880 11.011 ( 0.042 0.000 -6.369) 6.370 11.076 ( -3.340 0.000 -11.796) 12.259 11.731 ( -2.033 0.000 -2.837) 3.490 11.734 ( 0.732 0.000 -13.316) 13.336 12.006 ( 2.084 0.000 1.120) 2.366 12.241 ( -5.901 0.000 -1.482) 6.084 13.112 ( 2.432 0.000 0.032) 2.433 13.295 ( -4.933 0.000 2.176) 5.392 13.484 ( -4.871 0.000 -2.893) 5.665 13.849 ( 4.336 0.000 -3.276) 5.434 13.978 ( -0.048 0.000 7.287) 7.287 14.298 ( 1.802 0.000 0.134) 1.807 14.478 ( 4.102 0.000 5.343) 6.736 14.736 ( -1.053 0.000 1.829) 2.111 ======================= Grid point 195 (87/260) ======================= q-point: (-0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.313 ( -39.759 0.000 36.297) 53.836 3.785 ( -43.639 0.000 18.420) 47.367 4.856 ( -28.414 0.000 21.483) 35.621 5.060 ( 12.053 0.000 16.529) 20.457 6.036 ( -36.284 0.000 9.587) 37.529 6.439 ( 5.281 0.000 -17.536) 18.314 6.905 ( -10.752 0.000 0.570) 10.767 7.354 ( -17.771 0.000 1.475) 17.832 7.567 ( -27.707 0.000 8.107) 28.869 7.589 ( 20.941 0.000 -12.739) 24.511 8.343 ( 7.404 0.000 -4.681) 8.760 8.389 ( -5.513 0.000 -6.202) 8.298 8.432 ( 8.122 0.000 1.280) 8.222 8.651 ( 14.621 0.000 6.126) 15.852 8.913 ( 7.389 0.000 9.263) 11.849 9.140 ( 18.423 0.000 -4.688) 19.010 9.368 ( 8.848 0.000 -10.933) 14.065 9.535 ( 7.975 0.000 -2.179) 8.267 9.879 ( -0.682 0.000 -2.091) 2.199 10.625 ( 9.190 0.000 1.888) 9.382 10.711 ( 0.217 0.000 -7.359) 7.362 10.733 ( -5.437 0.000 -1.953) 5.777 10.919 ( -1.595 0.000 -14.187) 14.277 11.000 ( 3.588 0.000 -4.289) 5.592 11.616 ( -1.444 0.000 -12.910) 12.990 11.666 ( -2.093 0.000 -3.678) 4.232 12.051 ( 1.896 0.000 1.291) 2.294 12.136 ( -4.890 0.000 -0.453) 4.910 13.160 ( 1.965 0.000 1.329) 2.372 13.234 ( -3.998 0.000 2.757) 4.856 13.369 ( -4.879 0.000 -2.791) 5.621 13.888 ( 3.895 0.000 -5.525) 6.760 14.010 ( -3.177 0.000 7.260) 7.925 14.340 ( 1.817 0.000 1.648) 2.453 14.610 ( 4.671 0.000 7.174) 8.561 14.712 ( -2.530 0.000 0.508) 2.581 ======================= Grid point 196 (88/260) ======================= q-point: (-0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.875 ( -40.697 0.000 33.856) 52.938 3.121 ( -47.234 0.000 22.894) 52.490 4.202 ( -56.999 0.000 17.887) 59.739 5.324 ( 1.826 0.000 13.683) 13.805 5.636 ( -21.151 0.000 17.890) 27.702 6.391 ( 2.084 0.000 -8.195) 8.456 6.719 ( -13.072 0.000 8.670) 15.686 6.871 ( -29.693 0.000 1.668) 29.739 7.297 ( -12.954 0.000 6.948) 14.700 7.907 ( 24.122 0.000 -13.477) 27.632 8.250 ( -3.175 0.000 -6.299) 7.054 8.402 ( 5.865 0.000 -8.716) 10.505 8.600 ( 8.308 0.000 1.510) 8.444 8.819 ( 1.998 0.000 1.062) 2.263 9.122 ( 7.621 0.000 7.358) 10.593 9.429 ( 18.001 0.000 -6.193) 19.036 9.495 ( 11.205 0.000 -7.833) 13.672 9.705 ( 9.186 0.000 1.891) 9.378 9.849 ( -1.819 0.000 1.064) 2.107 10.552 ( -2.136 0.000 -12.941) 13.116 10.730 ( 1.500 0.000 0.357) 1.542 10.758 ( -0.007 0.000 -5.693) 5.693 10.828 ( 7.651 0.000 -6.197) 9.845 11.052 ( 5.027 0.000 -3.198) 5.958 11.473 ( -3.542 0.000 -9.665) 10.293 11.599 ( -0.878 0.000 -5.258) 5.331 12.047 ( -4.612 0.000 -0.582) 4.649 12.101 ( 2.219 0.000 1.869) 2.902 13.168 ( -3.616 0.000 2.940) 4.661 13.230 ( 1.214 0.000 3.440) 3.648 13.265 ( -3.973 0.000 -2.382) 4.633 13.907 ( 3.830 0.000 -6.018) 7.134 13.983 ( -6.039 0.000 6.574) 8.926 14.383 ( 1.284 0.000 1.210) 1.764 14.658 ( -2.906 0.000 -0.985) 3.069 14.765 ( 5.344 0.000 7.364) 9.099 ======================= Grid point 197 (89/260) ======================= q-point: (-0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.308 ( -49.489 0.000 19.030) 53.022 2.478 ( -46.332 0.000 30.564) 55.505 3.375 ( -55.282 0.000 49.397) 74.136 5.292 ( -15.852 0.000 6.915) 17.295 5.453 ( -14.035 0.000 11.985) 18.456 6.376 ( -3.452 0.000 3.006) 4.578 6.482 ( -9.868 0.000 1.811) 10.033 6.578 ( -13.104 0.000 13.793) 19.025 7.151 ( -9.804 0.000 7.756) 12.501 8.138 ( 5.782 0.000 -7.402) 9.393 8.259 ( 15.407 0.000 -8.277) 17.489 8.443 ( 7.636 0.000 -9.524) 12.207 8.749 ( 6.123 0.000 2.178) 6.499 8.791 ( -2.734 0.000 -3.473) 4.420 9.295 ( 4.881 0.000 5.405) 7.283 9.564 ( 5.808 0.000 -12.058) 13.384 9.716 ( 17.920 0.000 -9.088) 20.093 9.791 ( -1.751 0.000 0.863) 1.952 9.911 ( 6.586 0.000 3.575) 7.494 10.501 ( 6.404 0.000 2.072) 6.731 10.663 ( -1.936 0.000 -6.889) 7.155 10.781 ( 2.086 0.000 1.585) 2.620 10.944 ( 5.756 0.000 -1.817) 6.036 11.115 ( 4.284 0.000 -2.794) 5.115 11.346 ( -2.658 0.000 -4.474) 5.204 11.561 ( 2.566 0.000 -6.648) 7.127 11.949 ( -5.450 0.000 -1.348) 5.614 12.161 ( 2.084 0.000 2.813) 3.501 13.116 ( -4.819 0.000 3.575) 6.001 13.187 ( -2.481 0.000 -1.776) 3.051 13.293 ( 1.887 0.000 4.553) 4.929 13.906 ( -7.653 0.000 5.495) 9.422 13.939 ( 4.807 0.000 -4.701) 6.724 14.400 ( -0.030 0.000 -0.292) 0.293 14.595 ( -2.242 0.000 -2.591) 3.427 14.899 ( 3.421 0.000 1.911) 3.918 ======================= Grid point 198 (90/260) ======================= q-point: (-0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.506 ( -45.116 0.000 24.483) 51.331 2.005 ( -36.032 0.000 40.714) 54.368 3.118 ( -32.918 0.000 74.567) 81.509 4.937 ( -20.732 0.000 -2.680) 20.904 5.316 ( -9.303 0.000 6.571) 11.390 6.315 ( -5.662 0.000 7.839) 9.670 6.452 ( -13.939 0.000 14.186) 19.888 6.512 ( 3.138 0.000 8.153) 8.736 7.072 ( -6.347 0.000 8.843) 10.885 8.192 ( 4.565 0.000 0.666) 4.614 8.446 ( 11.987 0.000 -12.874) 17.590 8.532 ( 10.254 0.000 -8.433) 13.276 8.696 ( -2.996 0.000 -5.591) 6.343 8.852 ( 2.530 0.000 2.701) 3.701 9.373 ( -0.121 0.000 2.547) 2.550 9.527 ( 3.293 0.000 -16.491) 16.817 9.759 ( -1.857 0.000 0.986) 2.103 9.820 ( 5.790 0.000 -11.109) 12.527 10.032 ( 3.159 0.000 1.728) 3.601 10.589 ( -1.715 0.000 -2.131) 2.735 10.790 ( -2.996 0.000 1.796) 3.493 10.954 ( 21.964 0.000 8.144) 23.425 11.000 ( 2.867 0.000 -2.664) 3.914 11.187 ( 9.902 0.000 5.585) 11.368 11.386 ( 11.825 0.000 3.626) 12.368 11.587 ( 5.936 0.000 -6.269) 8.634 11.838 ( -3.019 0.000 -1.031) 3.190 12.215 ( 0.573 0.000 3.570) 3.616 13.055 ( -5.015 0.000 3.338) 6.024 13.151 ( -0.165 0.000 -0.861) 0.876 13.376 ( 2.771 0.000 5.262) 5.947 13.808 ( -7.228 0.000 4.478) 8.503 14.008 ( 5.983 0.000 -2.543) 6.501 14.372 ( -2.093 0.000 -1.822) 2.774 14.538 ( -0.681 0.000 -4.191) 4.246 14.836 ( -9.626 0.000 -7.583) 12.254 ======================= Grid point 199 (91/260) ======================= q-point: ( 0.00 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.896 ( 23.238 28.014 31.670) 48.247 2.402 ( -8.729 38.884 37.423) 54.669 3.615 ( -17.387 30.137 69.928) 78.105 4.742 ( -5.910 11.859 -9.637) 16.384 5.375 ( -6.219 13.540 6.205) 16.140 6.290 ( -6.949 4.064 5.263) 9.618 6.448 ( -6.161 4.545 11.479) 13.798 6.545 ( -1.399 -6.083 14.872) 16.129 6.996 ( -1.682 -7.782 8.876) 11.924 8.196 ( 3.437 -10.375 -4.257) 11.729 8.493 ( 5.830 1.017 -9.829) 11.473 8.529 ( 1.100 -0.513 -3.279) 3.496 8.721 ( 0.639 0.397 -8.348) 8.381 8.821 ( -0.947 -3.621 3.189) 4.917 9.146 ( 3.388 -12.076 -9.655) 15.828 9.562 ( 1.230 3.759 -5.781) 7.004 9.648 ( 0.568 -5.964 -2.793) 6.610 9.782 ( 0.004 -9.290 0.266) 9.294 10.054 ( -1.200 0.523 5.680) 5.829 10.558 ( 3.965 -0.766 -1.741) 4.397 10.744 ( -7.118 3.505 -2.539) 8.331 10.954 ( 0.478 -3.944 -2.356) 4.619 11.073 ( 1.315 0.855 -1.696) 2.310 11.420 ( 9.821 0.039 -2.285) 10.083 11.560 ( -1.696 -0.937 4.262) 4.682 11.624 ( 5.086 -3.054 0.160) 5.935 12.012 ( 16.760 -8.183 3.550) 18.986 12.369 ( 8.560 1.780 -0.530) 8.760 13.007 ( -3.659 1.233 2.375) 4.533 13.226 ( 2.493 4.373 -0.488) 5.058 13.501 ( 3.632 1.728 4.720) 6.201 13.778 ( -4.847 4.267 3.709) 7.447 14.103 ( 3.546 -0.114 -0.250) 3.557 14.276 ( -4.393 -1.692 -3.106) 5.640 14.499 ( 1.199 -0.453 -4.664) 4.837 14.514 ( -13.667 2.482 -4.436) 14.582 ======================= Grid point 200 (92/260) ======================= q-point: ( 0.10 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.667 ( 10.286 32.529 33.489) 47.806 2.839 ( 35.731 23.493 32.269) 53.572 4.039 ( 2.356 23.739 65.938) 70.121 4.711 ( 12.866 11.337 -12.712) 21.346 5.338 ( -5.892 11.928 9.924) 16.597 6.206 ( -3.504 6.767 -0.268) 7.625 6.337 ( -13.124 12.822 10.513) 21.146 6.758 ( 7.363 -15.570 15.766) 23.349 7.085 ( 2.488 -7.938 10.672) 13.531 8.192 ( 2.018 -12.691 -8.936) 15.652 8.464 ( -0.631 -0.074 -10.855) 10.873 8.519 ( -9.132 -6.631 -9.269) 14.604 8.540 ( 0.297 4.306 2.505) 4.990 8.905 ( 3.147 1.429 2.655) 4.358 9.117 ( 3.348 -10.168 -13.268) 17.048 9.491 ( -1.458 1.425 -11.727) 11.903 9.584 ( -5.720 -2.354 5.010) 7.960 9.849 ( 2.293 -9.070 4.159) 10.238 10.099 ( 1.543 2.008 5.984) 6.497 10.545 ( -10.309 2.539 -6.347) 12.370 10.587 ( 2.326 1.450 -6.847) 7.375 10.954 ( 0.617 -4.169 0.803) 4.290 11.103 ( 2.562 -0.418 0.795) 2.715 11.423 ( -6.303 4.419 -0.268) 7.702 11.595 ( 7.093 -1.488 -0.898) 7.302 11.737 ( 5.624 -0.817 -0.905) 5.755 12.127 ( -3.182 -4.071 1.497) 5.379 12.599 ( 11.787 -6.298 -4.012) 13.953 12.976 ( -1.172 0.146 1.579) 1.972 13.288 ( 3.849 2.881 1.224) 4.961 13.585 ( 0.327 0.923 4.905) 5.002 13.746 ( -2.207 2.858 3.571) 5.078 14.128 ( -1.041 -1.053 -0.362) 1.525 14.156 ( -4.956 -1.182 -2.205) 5.551 14.320 ( -3.152 5.905 -3.178) 7.410 14.506 ( 3.175 -0.197 -2.931) 4.326 ======================= Grid point 201 (93/260) ======================= q-point: ( 0.20 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.166 ( 16.042 29.432 29.778) 44.836 3.629 ( 10.776 16.180 45.559) 49.533 4.845 ( 35.462 17.025 39.066) 55.440 4.961 ( 23.049 10.205 -10.393) 27.265 5.297 ( -12.093 9.341 19.776) 24.992 6.156 ( -11.772 11.694 5.795) 17.576 6.213 ( 7.534 10.259 -7.941) 15.002 7.059 ( 11.220 -15.236 15.363) 24.372 7.259 ( 5.658 -9.447 12.286) 16.499 8.122 ( -0.474 -11.497 -11.038) 15.945 8.215 ( -11.445 -8.808 -10.630) 17.932 8.333 ( -5.724 -0.388 -10.345) 11.830 8.599 ( 1.755 7.709 4.351) 9.025 8.905 ( -6.111 0.764 1.497) 6.338 9.034 ( 0.485 -7.819 -14.948) 16.877 9.354 ( -4.084 -4.817 -6.009) 8.717 9.546 ( -3.889 4.848 4.887) 7.906 9.888 ( 0.428 -4.408 0.137) 4.431 10.209 ( 4.054 -2.196 2.914) 5.455 10.258 ( -12.806 2.542 -7.025) 14.826 10.547 ( -0.272 2.320 -6.247) 6.669 10.981 ( 1.250 -2.255 0.486) 2.624 11.153 ( 0.510 -2.622 1.177) 2.919 11.328 ( -3.116 5.219 0.748) 6.125 11.699 ( 5.801 -2.788 -3.563) 7.357 11.823 ( 4.573 -0.110 -0.420) 4.593 12.028 ( -6.215 -1.566 -1.762) 6.647 12.650 ( -0.817 -2.351 -4.947) 5.537 12.991 ( 1.297 -2.001 0.621) 2.465 13.377 ( 3.307 0.349 3.179) 4.600 13.583 ( -4.521 1.537 4.995) 6.910 13.760 ( 1.056 3.240 3.245) 4.706 14.007 ( -5.300 -2.447 -5.673) 8.140 14.175 ( 3.296 1.694 2.310) 4.367 14.287 ( 1.169 2.699 -3.833) 4.831 14.564 ( 4.057 -0.428 0.247) 4.087 ======================= Grid point 202 (94/260) ======================= q-point: ( 0.30 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.719 ( 16.777 21.811 27.509) 38.909 4.028 ( -8.826 16.528 49.099) 52.553 5.137 ( -12.653 8.290 15.850) 21.910 5.249 ( 2.619 12.716 4.246) 13.660 5.889 ( 32.617 9.319 18.235) 38.513 6.067 ( 13.120 7.400 0.703) 15.079 6.414 ( 23.462 11.378 -11.120) 28.347 7.392 ( 10.338 -9.237 10.080) 17.141 7.486 ( 7.745 -16.556 14.443) 23.296 7.956 ( -7.310 -8.837 -6.369) 13.118 7.985 ( -4.462 -9.615 -12.510) 16.397 8.101 ( -9.967 2.195 -7.775) 12.830 8.656 ( -1.322 4.884 1.851) 5.388 8.743 ( -7.812 4.277 0.068) 8.907 8.895 ( -2.959 -6.884 -11.881) 14.046 9.193 ( -14.675 0.953 3.787) 15.186 9.515 ( 0.500 0.246 -4.840) 4.872 9.891 ( -1.402 -3.187 -1.797) 3.918 9.915 ( -9.127 3.225 -13.643) 16.728 10.330 ( 2.581 -4.697 2.754) 6.026 10.507 ( 0.303 4.685 0.425) 4.714 10.995 ( 0.228 -0.952 -0.828) 1.282 11.121 ( -2.857 -1.868 -1.445) 3.707 11.314 ( -0.285 3.165 -0.828) 3.284 11.736 ( 2.530 -4.985 -6.374) 8.479 11.881 ( -0.834 -1.167 0.005) 1.434 11.927 ( 1.429 1.787 -3.804) 4.439 12.537 ( -6.255 -0.494 -4.365) 7.643 13.022 ( 1.976 -1.693 -0.293) 2.618 13.420 ( -3.423 -2.534 4.619) 6.282 13.564 ( 0.835 3.271 1.289) 3.613 13.832 ( 2.685 2.786 3.809) 5.430 13.871 ( -4.062 -1.759 -4.322) 6.187 14.266 ( 3.370 1.082 0.582) 3.587 14.287 ( 2.645 1.774 -1.349) 3.459 14.643 ( 3.154 -0.889 2.201) 3.947 ======================= Grid point 203 (95/260) ======================= q-point: ( 0.40 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.013 ( -23.305 9.067 42.384) 49.212 4.332 ( 15.685 22.182 22.139) 35.045 5.035 ( -19.281 13.722 19.558) 30.701 5.114 ( -19.587 12.996 19.989) 30.856 6.179 ( 22.164 -3.322 -17.710) 28.564 6.565 ( 20.502 13.085 -10.190) 26.371 7.021 ( 32.577 2.044 9.496) 33.995 7.494 ( -2.777 -8.930 1.279) 9.439 7.609 ( -10.753 -6.164 -6.586) 14.036 7.858 ( 4.880 -7.964 4.688) 10.451 7.922 ( 5.582 -2.408 1.906) 6.371 7.968 ( 1.258 -4.961 4.734) 6.972 8.478 ( -9.982 1.695 -2.857) 10.520 8.727 ( -8.067 0.949 0.514) 8.139 8.776 ( 4.076 -0.778 -5.004) 6.500 8.883 ( -19.517 3.304 3.794) 20.155 9.453 ( -1.920 -4.695 -8.487) 9.887 9.644 ( -2.122 5.722 -17.210) 18.260 9.901 ( 0.256 -2.465 -0.396) 2.510 10.364 ( 3.568 -0.379 -2.916) 4.624 10.580 ( 2.024 1.033 8.124) 8.435 10.972 ( -1.345 0.317 -2.635) 2.975 11.046 ( -2.705 -2.906 -4.230) 5.801 11.258 ( -2.614 3.344 -6.431) 7.705 11.693 ( -0.133 -6.465 -7.439) 9.856 11.838 ( 0.116 0.718 -4.749) 4.805 11.977 ( 3.320 1.440 -0.541) 3.659 12.377 ( -7.142 -0.499 -3.327) 7.894 13.059 ( 2.427 -1.160 -0.506) 2.737 13.360 ( -5.497 -1.241 3.141) 6.451 13.575 ( -1.308 0.712 -2.250) 2.698 13.798 ( 1.161 -1.534 -2.451) 3.115 13.930 ( 2.412 3.171 5.741) 6.988 14.283 ( 1.640 0.797 -2.171) 2.835 14.379 ( 3.778 1.369 4.094) 5.736 14.705 ( 1.188 -1.031 2.630) 3.065 ======================= Grid point 204 (96/260) ======================= q-point: (-0.50 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.774 ( -35.103 8.203 34.921) 50.189 4.589 ( -34.953 18.438 14.132) 41.969 4.812 ( 14.406 15.644 16.862) 27.140 5.110 ( -11.792 12.907 30.678) 35.310 6.354 ( 11.059 -4.804 -17.910) 21.590 6.676 ( -6.518 9.939 -5.975) 13.303 7.086 ( -10.535 -6.297 -10.252) 15.992 7.346 ( -5.948 -4.392 -1.536) 7.552 7.589 ( 1.640 3.323 0.362) 3.724 8.012 ( -10.118 -0.931 9.011) 13.581 8.072 ( 8.172 -6.904 4.911) 11.772 8.241 ( 23.076 -0.818 8.389) 24.567 8.357 ( 0.135 1.944 -1.275) 2.329 8.512 ( -9.089 0.445 -0.922) 9.146 8.685 ( -0.579 -5.477 2.262) 5.954 8.870 ( 7.071 -0.873 -4.511) 8.432 9.356 ( 1.120 -2.565 -8.315) 8.774 9.537 ( 3.447 3.649 -12.057) 13.060 9.902 ( 0.860 -0.048 -2.027) 2.203 10.446 ( 6.979 -0.517 -1.219) 7.103 10.676 ( 1.000 -0.301 7.107) 7.183 10.880 ( -4.201 -0.367 -8.145) 9.171 10.976 ( 0.038 -2.649 -4.718) 5.411 11.131 ( -2.726 4.530 -10.842) 12.062 11.616 ( -1.199 -6.765 -8.031) 10.569 11.795 ( -0.026 1.950 -6.464) 6.752 12.018 ( 1.000 0.413 0.119) 1.088 12.243 ( -4.627 -0.170 -1.758) 4.953 13.102 ( 2.508 -0.863 0.125) 2.655 13.290 ( -4.679 -0.321 2.622) 5.373 13.489 ( -4.129 0.253 -3.783) 5.606 13.839 ( 4.287 -1.125 -2.836) 5.262 14.009 ( 0.377 3.017 6.453) 7.133 14.302 ( 1.629 0.400 -0.216) 1.691 14.485 ( 3.348 0.690 5.714) 6.659 14.727 ( -0.900 -0.773 2.053) 2.371 ======================= Grid point 205 (97/260) ======================= q-point: (-0.40 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.379 ( -37.981 8.498 32.595) 50.766 3.991 ( -41.610 16.962 12.833) 46.731 5.007 ( -21.386 14.209 22.935) 34.428 5.230 ( 7.809 16.660 16.100) 24.448 6.157 ( -31.027 10.894 8.850) 34.054 6.372 ( -0.445 -5.755 -15.504) 16.544 6.908 ( -10.551 -0.509 0.587) 10.580 7.237 ( -6.227 -10.637 -0.410) 12.333 7.542 ( -16.606 4.938 -0.152) 17.325 7.767 ( 0.364 9.538 -2.637) 9.903 8.227 ( 5.122 -11.221 0.275) 12.338 8.366 ( 0.360 -0.122 -4.973) 4.988 8.418 ( 4.356 -2.589 -2.360) 5.590 8.729 ( 13.956 5.472 6.603) 16.380 8.810 ( 6.478 -8.133 7.332) 12.722 9.005 ( 14.686 -9.952 -8.186) 19.538 9.381 ( 8.853 0.476 -8.096) 12.006 9.587 ( 8.167 1.827 -0.803) 8.407 9.892 ( -0.084 1.617 -2.009) 2.580 10.563 ( 5.067 -3.917 -0.644) 6.437 10.697 ( -4.413 -2.987 -9.927) 11.267 10.747 ( 2.804 2.280 -0.872) 3.718 10.966 ( 1.702 0.759 -6.889) 7.136 11.003 ( 0.458 3.223 -8.749) 9.335 11.518 ( -2.160 -6.009 -7.746) 10.039 11.726 ( -1.236 2.748 -6.953) 7.578 12.006 ( -2.583 -3.004 0.771) 4.036 12.194 ( 0.208 3.163 -0.648) 3.236 13.150 ( 1.783 -0.691 1.380) 2.359 13.237 ( -3.439 0.435 2.961) 4.559 13.384 ( -3.760 1.274 -3.557) 5.330 13.884 ( 4.204 -0.535 -5.024) 6.572 14.045 ( -2.593 3.311 6.603) 7.829 14.337 ( 1.630 -0.282 1.158) 2.019 14.598 ( 3.131 -1.030 6.696) 7.463 14.712 ( -1.863 0.028 1.307) 2.276 ======================= Grid point 206 (98/260) ======================= q-point: (-0.30 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.961 ( -37.817 10.617 33.631) 51.709 3.292 ( -46.322 14.441 12.239) 50.040 4.520 ( -47.829 29.049 21.272) 59.867 5.429 ( -1.731 10.504 12.562) 16.466 5.807 ( -17.867 16.055 17.563) 29.757 6.278 ( -0.038 -10.817 -7.138) 12.960 6.683 ( -16.940 -0.839 6.722) 18.244 7.020 ( -19.698 8.498 2.197) 21.565 7.187 ( -14.277 -6.951 5.797) 16.904 7.963 ( 19.859 4.571 -11.164) 23.236 8.227 ( -1.137 -4.965 -4.928) 7.087 8.355 ( 5.826 -3.303 -8.969) 11.194 8.525 ( 5.403 -3.525 1.998) 6.753 8.886 ( 3.644 3.232 -1.497) 5.096 8.992 ( 6.093 -10.078 6.931) 13.665 9.229 ( 14.395 -14.869 -5.172) 21.332 9.511 ( 11.214 1.190 -6.965) 13.255 9.773 ( 8.499 -0.140 3.270) 9.108 9.872 ( -0.759 3.652 0.232) 3.737 10.521 ( -3.007 -3.163 -10.880) 11.723 10.597 ( 1.094 -5.617 -3.747) 6.840 10.843 ( 7.280 1.377 -5.465) 9.206 10.890 ( 1.855 6.100 -6.047) 8.787 11.046 ( 5.097 -0.299 -2.239) 5.575 11.412 ( -3.357 -3.985 -5.453) 7.542 11.645 ( -0.708 2.828 -7.091) 7.667 11.953 ( -3.790 -4.206 1.173) 5.782 12.216 ( 2.175 5.177 -0.331) 5.626 13.160 ( -3.046 -0.491 2.935) 4.258 13.240 ( 1.289 1.138 3.074) 3.522 13.297 ( -2.752 2.711 -2.864) 4.809 13.915 ( 4.348 0.544 -5.702) 7.191 14.024 ( -5.478 3.890 6.117) 9.086 14.373 ( 1.197 -0.879 0.871) 1.722 14.641 ( -2.354 -1.602 0.313) 2.865 14.753 ( 3.429 -1.153 6.085) 7.079 ======================= Grid point 207 (99/260) ======================= q-point: (-0.20 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.437 ( -48.868 13.703 13.148) 52.428 2.648 ( -36.278 17.309 35.210) 53.436 3.850 ( -48.199 41.269 39.576) 74.784 5.353 ( -14.592 7.571 6.606) 17.717 5.659 ( -15.396 17.903 11.858) 26.423 6.259 ( 0.441 -12.673 2.141) 12.860 6.446 ( -11.661 1.304 5.476) 12.949 6.750 ( -14.714 12.967 10.546) 22.268 7.050 ( -8.182 -9.759 6.843) 14.458 8.135 ( 3.706 -2.061 -6.588) 7.835 8.271 ( 15.412 0.605 -8.959) 17.836 8.400 ( 7.665 -3.243 -9.259) 12.450 8.626 ( 3.321 -4.459 2.510) 6.100 8.893 ( 0.339 2.931 -3.356) 4.469 9.128 ( 3.737 -13.182 2.784) 13.982 9.407 ( 10.758 -14.902 -8.496) 20.248 9.657 ( 8.511 -0.763 -4.549) 9.680 9.852 ( -0.210 1.838 3.893) 4.310 9.922 ( 4.220 -1.099 -1.390) 4.577 10.443 ( 1.832 -5.059 -2.202) 5.813 10.603 ( 4.043 -2.063 0.283) 4.547 10.873 ( 4.761 4.914 -6.585) 9.496 10.964 ( 4.441 1.814 -1.126) 4.928 11.119 ( 4.312 0.608 -1.597) 4.638 11.313 ( -3.048 -2.352 -1.919) 4.302 11.602 ( 2.998 2.984 -7.341) 8.473 11.886 ( -4.553 -3.067 0.914) 5.565 12.257 ( 2.214 5.157 0.260) 5.618 13.115 ( -4.384 -0.134 3.159) 5.406 13.236 ( -1.378 4.471 -2.282) 5.205 13.308 ( 2.406 1.433 4.196) 5.045 13.952 ( -4.931 4.001 3.008) 7.027 13.958 ( 2.841 1.902 -2.435) 4.197 14.387 ( -0.049 -1.158 -0.457) 1.246 14.586 ( -2.297 -0.824 -2.061) 3.194 14.848 ( 1.457 -4.460 2.197) 5.181 ======================= Grid point 208 (100/260) ======================= q-point: (-0.10 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( -32.953 24.801 22.371) 46.920 2.401 ( -25.090 30.149 38.237) 54.777 3.521 ( -33.003 38.793 59.838) 78.579 5.042 ( -18.656 10.217 -2.918) 21.470 5.477 ( -11.305 15.145 7.148) 20.206 6.335 ( 2.667 -13.523 8.753) 16.328 6.355 ( -5.927 3.906 6.660) 9.733 6.609 ( -12.801 11.755 13.910) 22.261 6.990 ( -5.026 -8.466 7.539) 12.400 8.155 ( 3.290 -5.610 -2.328) 6.907 8.439 ( 11.126 -0.963 -12.566) 16.811 8.483 ( 7.809 -1.834 -5.797) 9.897 8.687 ( 2.968 -0.051 -1.098) 3.165 8.867 ( -1.403 -0.926 -0.817) 1.869 9.166 ( 1.554 -14.253 -4.420) 15.003 9.510 ( 9.088 -9.373 -8.127) 15.379 9.676 ( -1.207 -0.700 -2.991) 3.300 9.838 ( -2.408 -2.318 -3.476) 4.822 10.003 ( 3.636 -1.940 2.760) 4.960 10.497 ( 2.349 -6.163 1.727) 6.817 10.841 ( 2.974 2.261 0.615) 3.786 10.902 ( 9.699 -1.333 0.893) 9.831 11.024 ( 5.759 0.248 -0.450) 5.782 11.183 ( 5.956 0.002 5.845) 8.345 11.340 ( 7.651 -2.707 0.870) 8.162 11.627 ( 4.431 2.329 -5.146) 7.179 11.817 ( -1.536 -0.019 0.163) 1.545 12.298 ( 1.818 4.280 0.864) 4.730 13.059 ( -4.414 0.503 3.017) 5.370 13.209 ( 0.269 5.035 -1.526) 5.267 13.397 ( 3.211 2.033 4.706) 6.049 13.857 ( -7.117 4.718 4.202) 9.517 14.026 ( 5.513 1.433 -2.509) 6.224 14.358 ( -2.224 -1.344 -1.859) 3.195 14.532 ( -0.747 -0.616 -3.885) 4.004 14.783 ( -8.102 -4.476 -5.083) 10.560 ======================= Grid point 209 (101/260) ======================= q-point: ( 0.00 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.576 ( 16.477 36.411 25.076) 47.181 3.196 ( -3.581 37.966 34.630) 51.512 4.516 ( -12.963 54.708 43.319) 70.976 5.073 ( -5.473 19.867 -9.013) 22.492 5.739 ( -8.606 19.833 9.325) 23.545 6.076 ( 2.825 -21.527 12.588) 25.097 6.492 ( -1.768 9.833 1.526) 10.107 6.721 ( -5.144 -5.469 8.548) 11.377 6.840 ( -7.973 9.279 13.975) 18.574 7.897 ( 2.358 -17.305 -9.226) 19.752 8.484 ( 1.371 -5.355 -6.816) 8.776 8.545 ( -0.597 -4.311 -2.869) 5.213 8.592 ( -3.262 -1.682 -2.182) 4.270 8.825 ( 6.877 1.669 1.698) 7.278 8.896 ( 4.692 -13.421 -11.416) 18.233 9.410 ( 6.342 -11.343 -3.887) 13.564 9.537 ( -1.746 -14.234 4.574) 15.053 9.648 ( -5.099 -2.059 -5.435) 7.732 10.059 ( 1.766 1.278 8.759) 9.026 10.558 ( 7.628 0.494 0.832) 7.689 10.822 ( -6.694 3.004 -5.506) 9.174 10.894 ( -0.399 -1.027 -4.240) 4.381 11.084 ( 1.832 0.692 -0.532) 2.029 11.396 ( 11.120 -3.522 5.308) 12.815 11.456 ( 10.254 -5.346 2.259) 11.783 11.617 ( -3.603 0.964 0.162) 3.733 11.956 ( 8.030 1.262 -0.249) 8.133 12.350 ( 2.071 -2.753 0.381) 3.466 13.048 ( -2.165 2.685 1.797) 3.889 13.304 ( 0.616 2.466 0.843) 2.678 13.560 ( 3.129 4.176 2.569) 5.816 13.900 ( -5.366 7.467 2.781) 9.606 14.101 ( 2.123 -0.775 -0.742) 2.379 14.239 ( -4.623 -1.080 -2.358) 5.301 14.483 ( 0.864 -1.188 -4.437) 4.673 14.534 ( -5.868 -0.662 -5.061) 7.777 ======================= Grid point 210 (102/260) ======================= q-point: ( 0.10 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.252 ( 27.336 27.496 25.785) 46.564 3.516 ( 8.489 36.228 33.280) 49.921 4.794 ( 4.459 47.733 41.762) 63.580 5.035 ( 9.825 20.574 -8.627) 24.377 5.667 ( -9.594 19.464 11.556) 24.585 6.261 ( 6.277 -16.665 9.707) 20.282 6.503 ( 3.831 8.148 -0.082) 9.004 6.658 ( -11.916 12.497 12.749) 21.464 6.877 ( 0.534 -8.266 11.340) 14.043 7.859 ( 2.998 -18.718 -11.724) 22.289 8.267 ( -13.445 -15.471 -6.259) 21.431 8.482 ( -0.856 1.141 -8.767) 8.882 8.645 ( 3.681 3.141 2.304) 5.360 8.866 ( 3.220 -12.742 -11.745) 17.626 8.947 ( 2.508 0.229 2.914) 3.852 9.369 ( -6.020 -9.957 -5.097) 12.703 9.517 ( -0.043 -7.073 -1.488) 7.228 9.660 ( 3.771 -10.158 8.185) 13.579 10.169 ( 2.878 5.896 4.906) 8.192 10.608 ( -7.929 3.069 -7.478) 11.323 10.641 ( 0.513 3.722 -6.412) 7.431 10.880 ( 1.029 -2.621 2.774) 3.953 11.100 ( 1.010 0.500 -0.430) 1.206 11.500 ( -3.179 2.360 -3.151) 5.060 11.564 ( 5.873 -1.466 -0.297) 6.061 11.679 ( 5.655 -4.915 4.733) 8.862 12.056 ( 0.651 -1.957 0.222) 2.075 12.443 ( 7.185 -7.895 0.308) 10.679 13.023 ( -1.731 3.927 0.739) 4.355 13.335 ( 1.313 1.208 1.922) 2.622 13.617 ( -0.050 2.216 3.543) 4.179 13.850 ( -2.037 6.900 1.805) 7.418 14.072 ( -3.891 -4.392 -4.876) 7.629 14.176 ( -0.202 2.861 1.862) 3.420 14.396 ( -2.695 1.563 -5.210) 6.071 14.499 ( 2.909 -0.647 -2.834) 4.112 ======================= Grid point 211 (103/260) ======================= q-point: ( 0.20 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.806 ( 11.396 30.282 28.240) 42.946 4.071 ( 15.139 25.959 33.850) 45.264 5.225 ( 23.260 16.775 -11.999) 31.087 5.420 ( 23.166 36.815 27.325) 51.368 5.572 ( -12.312 18.071 23.234) 31.905 6.434 ( 4.839 4.022 -1.219) 6.409 6.479 ( -8.710 17.728 6.084) 20.668 6.718 ( 12.343 -9.224 9.170) 17.931 7.026 ( 4.588 -12.684 11.469) 17.706 7.808 ( 2.590 -17.882 -12.887) 22.194 7.959 ( -13.138 -15.325 -6.944) 21.347 8.350 ( -5.783 0.879 -8.324) 10.174 8.717 ( 0.691 1.790 2.892) 3.470 8.797 ( -0.539 -12.967 -11.443) 17.303 8.941 ( -4.272 0.614 1.170) 4.472 9.232 ( -3.419 -6.559 -3.431) 8.154 9.543 ( -0.707 -5.236 6.666) 8.506 9.795 ( 3.643 -6.466 4.733) 8.803 10.207 ( 1.152 3.584 -4.505) 5.871 10.327 ( -12.673 4.000 -9.309) 16.225 10.617 ( 0.988 4.739 -2.931) 5.659 10.942 ( 1.610 -1.395 3.157) 3.808 11.112 ( 0.391 -1.182 -0.731) 1.443 11.413 ( -3.043 2.683 -1.602) 4.362 11.642 ( 3.932 -2.613 -3.825) 6.076 11.790 ( 3.308 -3.048 3.148) 5.491 12.007 ( -3.281 -0.299 -2.748) 4.290 12.536 ( 1.877 -8.438 -1.299) 8.741 13.004 ( -0.478 3.318 -0.050) 3.353 13.373 ( -0.101 -0.816 3.648) 3.740 13.620 ( -1.766 1.794 2.439) 3.505 13.856 ( 0.948 4.924 0.588) 5.048 13.940 ( -4.442 -2.991 -4.966) 7.303 14.227 ( 2.838 3.288 3.025) 5.293 14.335 ( 0.028 1.751 -4.288) 4.632 14.548 ( 3.563 -1.214 -0.110) 3.766 ======================= Grid point 212 (104/260) ======================= q-point: ( 0.30 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.200 ( 1.855 24.343 32.777) 40.870 4.520 ( 6.372 29.028 28.646) 41.278 5.398 ( -12.679 16.809 15.196) 25.966 5.553 ( 16.044 16.139 -5.650) 23.448 6.159 ( -3.536 16.223 6.628) 17.878 6.355 ( 25.928 21.711 20.695) 39.647 6.663 ( 18.598 9.136 -13.061) 24.494 7.077 ( 15.609 -15.503 11.582) 24.862 7.197 ( 3.287 -13.536 9.198) 16.692 7.729 ( -5.637 -12.312 -1.377) 13.611 7.733 ( 0.515 -13.938 -12.404) 18.666 8.146 ( -8.668 1.312 -6.685) 11.025 8.628 ( -8.582 -8.333 -2.446) 12.209 8.703 ( -1.009 -6.500 -10.461) 12.358 8.899 ( -2.902 4.854 6.440) 8.570 9.152 ( -5.833 -4.423 0.613) 7.346 9.538 ( -7.906 1.132 5.281) 9.574 9.827 ( 0.664 -2.191 -3.810) 4.445 10.014 ( -7.840 5.590 -15.978) 18.655 10.230 ( 2.908 -4.861 2.732) 6.289 10.618 ( 0.207 6.468 -0.604) 6.499 10.973 ( -0.020 -1.214 0.863) 1.489 11.084 ( -1.913 -1.313 -2.754) 3.601 11.371 ( -0.306 1.710 -2.433) 2.989 11.636 ( 0.161 -4.362 -6.472) 7.806 11.852 ( 0.073 -1.609 2.560) 3.024 11.946 ( 1.652 0.189 -4.746) 5.029 12.483 ( -4.825 -5.389 -3.353) 7.973 13.011 ( 1.312 1.291 -0.194) 1.851 13.377 ( -3.170 -1.870 4.168) 5.561 13.614 ( 0.145 1.491 -0.568) 1.603 13.791 ( -3.362 -4.700 -4.819) 7.524 13.938 ( 2.877 6.137 2.568) 7.248 14.297 ( 1.818 1.579 -1.028) 2.618 14.334 ( 2.641 2.971 1.803) 4.365 14.618 ( 2.902 -1.625 2.000) 3.881 ======================= Grid point 213 (105/260) ======================= q-point: ( 0.40 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.308 ( -21.066 19.500 32.812) 43.597 4.869 ( 12.408 28.225 16.150) 34.806 5.375 ( -7.980 19.489 25.993) 33.454 5.502 ( -23.478 23.345 7.676) 33.987 6.160 ( 16.714 1.304 -16.566) 23.569 6.796 ( 10.635 1.842 -17.305) 20.395 7.038 ( 10.705 3.646 9.875) 15.014 7.341 ( 10.732 -4.526 7.953) 14.103 7.397 ( 7.307 -14.593 5.962) 17.376 7.668 ( 4.146 -6.794 0.363) 7.967 7.782 ( 6.097 -6.853 5.765) 10.834 8.007 ( 2.535 3.759 -2.978) 5.424 8.473 ( -4.938 -6.748 -2.313) 8.676 8.551 ( -5.926 -5.617 -8.771) 11.983 8.912 ( -3.789 3.239 8.518) 9.869 8.966 ( -15.682 5.457 1.431) 16.666 9.356 ( -8.337 -3.167 -4.638) 10.052 9.765 ( -3.319 5.797 -15.946) 17.289 9.856 ( 3.234 -1.646 -1.827) 4.063 10.337 ( 5.668 -2.889 1.404) 6.515 10.621 ( -0.093 3.320 2.397) 4.096 10.961 ( -1.277 -2.455 -1.234) 3.030 11.003 ( -2.740 0.168 -5.718) 6.343 11.327 ( -1.025 2.557 -6.556) 7.111 11.562 ( -1.026 -5.618 -7.732) 9.612 11.843 ( -0.128 -0.048 -2.203) 2.207 11.981 ( 3.416 -1.284 -1.550) 3.965 12.336 ( -6.938 -4.030 -3.923) 8.931 13.043 ( 2.299 0.167 -0.162) 2.311 13.337 ( -4.251 -1.073 3.205) 5.431 13.577 ( -2.200 -0.822 -4.689) 5.244 13.749 ( 1.898 -3.317 -1.455) 4.089 14.020 ( 2.799 5.416 3.639) 7.100 14.304 ( 1.331 1.222 -2.096) 2.768 14.421 ( 2.518 2.710 5.347) 6.502 14.678 ( 1.261 -1.554 2.915) 3.536 ======================= Grid point 214 (106/260) ======================= q-point: (-0.50 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.059 ( -30.388 19.641 25.688) 44.374 5.004 ( -34.207 20.545 5.356) 40.260 5.206 ( 7.876 21.483 16.535) 28.230 5.517 ( -2.354 26.337 27.174) 37.916 6.263 ( 6.562 -4.633 -17.586) 19.334 6.795 ( 4.771 -13.854 -10.790) 18.197 6.931 ( -18.151 7.452 -0.370) 19.625 7.324 ( -9.882 1.226 2.278) 10.214 7.634 ( 8.075 -1.180 2.927) 8.670 7.861 ( 3.840 -11.953 5.172) 13.578 7.951 ( 7.470 -3.887 5.204) 9.899 8.202 ( 4.667 -0.184 5.094) 6.912 8.429 ( 3.049 -7.080 -2.141) 8.000 8.451 ( 2.122 0.253 -0.463) 2.186 8.700 ( -4.370 11.243 -0.634) 12.079 8.903 ( -2.278 3.493 0.370) 4.187 9.241 ( -0.053 -8.708 -1.460) 8.830 9.602 ( -0.027 2.592 -13.808) 14.049 9.912 ( 3.133 0.863 -0.974) 3.392 10.442 ( 6.649 -0.398 -3.432) 7.493 10.660 ( -0.193 -1.200 5.555) 5.686 10.860 ( -4.047 -1.437 -8.234) 9.287 10.948 ( 0.657 0.289 -3.434) 3.508 11.223 ( -1.830 3.469 -11.416) 12.071 11.481 ( -0.937 -5.567 -6.895) 8.912 11.818 ( 0.199 0.499 -4.488) 4.520 12.001 ( -0.977 -2.177 -1.111) 2.633 12.210 ( -2.533 -3.526 -2.259) 4.894 13.090 ( 2.758 0.043 0.342) 2.780 13.286 ( -3.834 -0.198 2.646) 4.663 13.488 ( -2.357 -0.415 -5.160) 5.688 13.797 ( 4.207 -3.145 -2.049) 5.638 14.093 ( 1.382 4.985 4.301) 6.727 14.315 ( 1.225 0.847 -0.934) 1.758 14.507 ( 1.351 1.508 6.513) 6.820 14.708 ( -0.605 -1.023 2.916) 3.149 ======================= Grid point 215 (107/260) ======================= q-point: (-0.40 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.688 ( -32.024 21.447 24.209) 45.515 4.371 ( -38.435 19.617 2.830) 43.244 5.377 ( -7.681 20.938 20.826) 30.514 5.709 ( 1.161 28.736 17.266) 33.544 6.132 ( -4.404 -12.590 -12.666) 18.393 6.505 ( -25.488 12.550 5.954) 29.028 6.795 ( -3.244 -7.535 -0.671) 8.231 7.118 ( -14.368 1.846 4.302) 15.111 7.683 ( -8.259 6.264 -1.642) 10.494 7.940 ( -2.442 -2.274 3.991) 5.202 7.946 ( 3.227 -5.777 -1.863) 6.875 8.265 ( 5.648 -9.528 -3.020) 11.481 8.423 ( 1.646 3.608 -2.652) 4.771 8.605 ( 10.022 -11.950 5.576) 16.563 8.822 ( 2.825 2.182 2.240) 4.215 8.888 ( 7.132 0.869 -7.852) 10.644 9.362 ( 12.139 -2.553 0.048) 12.405 9.549 ( 2.802 -4.724 -3.694) 6.618 9.944 ( 1.525 2.720 -1.425) 3.429 10.510 ( 3.959 -1.357 -4.656) 6.260 10.616 ( -4.669 -4.535 -8.371) 10.604 10.795 ( 2.913 2.253 -0.338) 3.698 10.964 ( 4.031 0.169 -2.740) 4.877 11.082 ( -1.428 2.431 -13.457) 13.749 11.415 ( -0.999 -3.156 -4.660) 5.716 11.765 ( -0.833 1.201 -6.845) 6.999 11.942 ( -3.691 -3.283 0.421) 4.958 12.209 ( 2.475 -1.989 -0.689) 3.249 13.144 ( 2.025 0.172 1.140) 2.330 13.246 ( -2.644 0.165 2.651) 3.748 13.415 ( -0.992 1.873 -4.579) 5.045 13.857 ( 4.949 -2.420 -3.816) 6.702 14.136 ( -0.980 5.327 4.671) 7.152 14.333 ( 1.181 0.035 -0.035) 1.182 14.577 ( 0.151 -0.864 6.326) 6.387 14.710 ( -1.498 -0.311 2.895) 3.274 ======================= Grid point 216 (108/260) ======================= q-point: (-0.30 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.318 ( -31.384 23.375 25.411) 46.658 3.667 ( -40.286 22.511 3.885) 46.312 5.227 ( -27.835 36.050 20.993) 50.151 5.760 ( -9.272 22.178 11.077) 26.467 5.959 ( -5.177 -18.490 -5.111) 19.869 6.245 ( -11.587 22.991 14.779) 29.686 6.663 ( -12.144 -4.400 4.507) 13.680 6.913 ( -11.650 -4.858 5.158) 13.635 7.352 ( -21.544 13.359 2.700) 25.493 7.976 ( 1.045 -15.209 -1.845) 15.356 8.067 ( 14.430 3.102 -7.285) 16.460 8.333 ( 6.229 -1.327 -6.656) 9.212 8.479 ( 5.252 -1.326 -1.375) 5.589 8.774 ( 3.687 -8.234 3.839) 9.805 8.926 ( 6.461 -4.352 -0.813) 7.833 8.927 ( 5.503 -10.458 -5.244) 12.929 9.511 ( 6.939 -2.355 -6.107) 9.539 9.672 ( 6.505 -7.983 6.184) 12.012 9.951 ( -0.371 3.257 0.290) 3.291 10.444 ( -3.517 -3.922 -10.471) 11.721 10.522 ( 2.206 -2.003 -4.015) 5.000 10.876 ( 6.487 1.533 -4.835) 8.235 10.978 ( 2.666 2.221 -9.058) 9.700 11.046 ( 5.351 0.211 -1.198) 5.488 11.359 ( -2.470 -0.514 -1.954) 3.191 11.689 ( -0.110 1.405 -7.664) 7.792 11.894 ( -2.597 -1.618 1.523) 3.418 12.257 ( 2.868 -1.135 -0.354) 3.104 13.153 ( -2.308 -0.234 1.561) 2.797 13.256 ( 0.900 -0.078 3.115) 3.244 13.379 ( 1.009 5.467 -3.715) 6.687 13.915 ( 5.430 -0.908 -4.678) 7.224 14.131 ( -3.810 6.348 4.614) 8.724 14.354 ( 0.962 -0.778 -0.012) 1.237 14.599 ( -2.062 -2.333 2.556) 4.029 14.723 ( -0.250 -1.718 4.401) 4.732 ======================= Grid point 217 (109/260) ======================= q-point: (-0.20 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.846 ( -38.266 25.287 12.179) 47.456 3.162 ( -25.093 32.097 26.522) 48.614 4.830 ( -33.762 50.894 27.183) 66.851 5.611 ( -14.004 17.308 5.181) 22.858 5.874 ( -3.514 -21.128 3.193) 21.655 6.135 ( -17.084 24.615 13.327) 32.793 6.520 ( -4.494 2.228 3.462) 6.095 6.789 ( -7.069 -10.132 5.903) 13.692 7.055 ( -15.871 14.399 9.199) 23.320 7.960 ( 0.691 -14.353 -4.951) 15.199 8.272 ( 14.360 -0.177 -9.080) 16.991 8.401 ( 7.304 2.575 -5.567) 9.538 8.574 ( 5.329 -2.047 0.957) 5.788 8.855 ( 5.515 -9.569 -4.508) 11.929 8.874 ( -6.214 -7.571 3.035) 10.254 9.109 ( 13.021 -12.821 -7.824) 19.878 9.569 ( 2.323 -9.517 -1.147) 9.863 9.815 ( 5.176 -5.980 2.966) 8.447 9.912 ( -4.454 1.895 1.712) 5.134 10.339 ( 0.481 -4.795 -5.801) 7.541 10.586 ( 7.084 0.053 1.786) 7.306 10.940 ( 7.446 1.473 -8.648) 11.506 10.995 ( 2.324 0.994 -2.988) 3.914 11.144 ( 6.587 1.258 -2.041) 7.009 11.286 ( -4.758 0.688 1.258) 4.969 11.652 ( 3.035 1.642 -7.314) 8.087 11.865 ( -1.989 1.033 1.555) 2.728 12.301 ( 1.959 -0.804 -0.065) 2.118 13.113 ( -3.124 0.080 1.705) 3.560 13.291 ( -0.239 -0.127 2.470) 2.484 13.399 ( 3.719 7.708 -1.563) 8.700 13.979 ( 5.564 0.268 -3.953) 6.830 14.076 ( -6.038 7.361 4.096) 10.364 14.360 ( -0.117 -1.149 -0.820) 1.416 14.560 ( -2.435 -1.817 -0.765) 3.133 14.746 ( -1.383 -5.086 2.200) 5.711 ======================= Grid point 218 (110/260) ======================= q-point: (-0.10 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.401 ( -18.678 36.842 18.527) 45.271 3.068 ( -14.195 35.505 34.022) 51.182 4.539 ( -25.718 56.391 36.034) 71.693 5.337 ( -15.322 18.215 -3.804) 24.104 5.834 ( -9.605 3.122 10.342) 14.455 5.983 ( -4.783 -3.574 9.292) 11.045 6.508 ( -1.854 6.673 3.429) 7.728 6.741 ( -4.349 -10.573 6.293) 13.050 6.905 ( -11.863 14.411 14.036) 23.354 7.929 ( 1.387 -15.143 -6.741) 16.634 8.417 ( 10.010 -1.603 -8.887) 13.481 8.500 ( 6.340 2.219 -3.016) 7.363 8.689 ( 5.980 -0.552 1.809) 6.272 8.752 ( -8.052 -9.942 -0.523) 12.804 8.896 ( 4.923 -11.519 -8.895) 15.364 9.274 ( 11.896 -11.464 -6.855) 17.887 9.564 ( -2.858 -12.704 1.983) 13.172 9.782 ( -4.839 -2.226 -3.735) 6.506 9.964 ( 2.519 -1.948 6.380) 7.131 10.395 ( 6.781 -3.719 2.464) 8.117 10.818 ( 13.111 -2.023 2.853) 13.570 10.954 ( -2.366 3.498 -4.640) 6.274 11.005 ( 4.263 -1.594 -2.583) 5.233 11.211 ( -0.495 3.200 4.970) 5.932 11.292 ( 7.993 -2.295 -2.330) 8.636 11.657 ( 1.604 0.658 -4.097) 4.449 11.862 ( 1.791 3.977 -0.017) 4.362 12.327 ( 0.884 -1.139 0.344) 1.482 13.076 ( -2.643 1.133 1.976) 3.489 13.296 ( -0.414 2.036 1.084) 2.343 13.474 ( 4.277 6.116 0.976) 7.526 13.988 ( -6.769 7.752 3.561) 10.890 14.049 ( 4.638 0.350 -2.301) 5.189 14.326 ( -2.581 -1.323 -1.790) 3.408 14.512 ( -0.750 -1.450 -3.218) 3.608 14.683 ( -5.346 -5.014 -2.671) 7.801 ======================= Grid point 219 (111/260) ======================= q-point: ( 0.00 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.315 ( 9.206 36.142 23.207) 43.927 3.964 ( -1.000 37.957 27.242) 46.732 5.334 ( -2.238 -12.737 3.899) 13.507 5.563 ( -2.983 35.962 18.611) 40.603 5.661 ( -0.252 3.487 9.557) 10.177 6.269 ( -11.737 26.231 9.219) 30.180 6.433 ( -1.884 0.835 12.875) 13.039 6.779 ( -0.372 6.331 -4.679) 7.881 7.144 ( -6.968 13.960 13.369) 20.546 7.565 ( 1.542 -12.867 -11.834) 17.549 8.254 ( -14.181 -10.553 0.553) 17.685 8.453 ( 6.603 -7.933 -2.259) 10.566 8.568 ( 4.120 -18.659 -11.542) 22.324 8.611 ( -0.201 0.012 -3.310) 3.316 8.855 ( 6.181 0.881 2.348) 6.670 9.179 ( -1.044 -12.728 -1.015) 12.811 9.242 ( 4.644 -11.136 4.429) 12.853 9.502 ( -6.899 -10.863 -3.353) 13.298 10.145 ( 6.252 6.769 9.619) 13.321 10.545 ( 9.083 -2.521 4.881) 10.615 10.836 ( -1.608 0.457 -8.512) 8.675 10.931 ( -2.369 2.090 -4.547) 5.536 11.104 ( 5.664 1.216 0.224) 5.797 11.297 ( 4.563 -3.932 8.656) 10.546 11.419 ( 8.943 0.517 -4.096) 9.850 11.619 ( -2.011 -1.129 -1.263) 2.629 12.013 ( 3.579 3.726 -0.647) 5.207 12.278 ( 0.011 -4.147 0.342) 4.161 13.112 ( -0.220 3.572 1.420) 3.851 13.313 ( -0.089 -1.354 2.666) 2.991 13.666 ( 1.653 5.957 -0.419) 6.196 14.037 ( -0.557 -4.459 -2.868) 5.331 14.065 ( -4.509 7.594 1.682) 8.990 14.261 ( -2.975 2.689 -0.159) 4.013 14.448 ( 0.710 -2.264 -4.085) 4.724 14.498 ( -2.355 -2.523 -4.255) 5.478 ======================= Grid point 220 (112/260) ======================= q-point: ( 0.10 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.814 ( 20.801 28.000 24.272) 42.495 4.236 ( 5.084 34.773 28.252) 45.091 5.367 ( 8.384 8.259 -5.116) 12.832 5.776 ( 7.385 19.733 20.470) 29.376 5.844 ( 6.399 1.140 18.590) 19.693 6.132 ( -12.119 23.319 9.005) 27.780 6.553 ( 1.936 1.987 15.101) 15.354 6.779 ( 7.030 8.695 -8.732) 14.187 7.101 ( -10.847 16.393 14.040) 24.156 7.497 ( 4.059 -13.822 -15.557) 21.203 7.966 ( -16.144 -11.377 -2.336) 19.888 8.480 ( -2.891 -2.870 -6.790) 7.918 8.526 ( 4.096 -17.912 -12.638) 22.301 8.615 ( 1.961 -9.678 3.756) 10.565 8.960 ( 1.423 0.059 1.342) 1.957 9.158 ( -0.502 -9.632 -1.145) 9.713 9.348 ( 0.136 -8.041 -0.617) 8.065 9.409 ( 1.044 -12.990 10.612) 16.807 10.323 ( 5.329 8.336 3.027) 10.347 10.639 ( -4.217 -0.670 -5.122) 6.669 10.727 ( 0.665 4.668 -5.889) 7.544 10.866 ( -0.424 1.209 1.968) 2.349 11.136 ( 0.503 3.070 -1.528) 3.466 11.473 ( 2.212 -5.891 1.283) 6.423 11.535 ( 6.860 -1.017 -2.112) 7.250 11.594 ( 1.347 -2.112 4.212) 4.901 12.054 ( 0.706 1.430 -0.883) 1.823 12.299 ( 2.341 -6.312 0.509) 6.751 13.116 ( -0.631 4.933 0.841) 5.043 13.332 ( -0.268 -1.282 2.790) 3.082 13.672 ( -0.949 3.069 0.259) 3.223 13.948 ( -4.637 -4.098 -4.794) 7.828 14.024 ( -1.153 6.332 -0.093) 6.437 14.246 ( 0.422 3.386 2.014) 3.962 14.399 ( -1.208 -0.902 -4.527) 4.771 14.474 ( 2.283 -1.809 -2.644) 3.934 ======================= Grid point 221 (113/260) ======================= q-point: ( 0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.362 ( 13.177 24.999 25.993) 38.395 4.628 ( 13.172 27.938 25.607) 40.122 5.565 ( 19.004 13.866 -9.038) 25.201 5.950 ( -14.293 21.139 11.261) 27.892 6.127 ( 12.411 -17.076 12.101) 24.332 6.223 ( 14.387 22.390 25.054) 36.551 6.724 ( 0.715 8.858 15.059) 17.486 6.895 ( 14.120 11.508 -12.050) 21.841 6.974 ( -12.512 13.257 11.203) 21.396 7.466 ( 6.279 -12.190 -15.187) 20.461 7.663 ( -12.598 -10.302 -2.305) 16.437 8.311 ( -9.108 -6.565 -5.616) 12.554 8.480 ( 2.255 -17.672 -11.526) 21.219 8.670 ( -1.027 -5.106 2.646) 5.841 8.927 ( -3.943 -4.104 0.674) 5.731 9.103 ( -2.168 -6.121 -2.601) 6.995 9.421 ( 4.500 -5.003 6.854) 9.605 9.590 ( 5.711 -11.890 12.081) 17.886 10.322 ( -1.739 5.876 -10.344) 12.022 10.405 ( -11.498 3.222 -9.560) 15.296 10.741 ( 2.111 7.126 0.858) 7.481 10.925 ( 1.446 -0.422 4.125) 4.392 11.122 ( -0.283 2.511 -2.299) 3.416 11.424 ( -2.344 -1.705 -3.839) 4.810 11.598 ( 2.544 -1.550 -3.211) 4.380 11.714 ( 3.805 -4.208 5.601) 7.972 12.019 ( -2.125 1.604 -2.814) 3.874 12.349 ( 1.583 -9.202 0.079) 9.337 13.100 ( -1.170 5.645 -0.425) 5.780 13.346 ( -1.179 -1.745 3.317) 3.929 13.647 ( -1.367 0.779 -0.336) 1.608 13.808 ( -4.936 -5.608 -6.366) 9.815 14.029 ( 1.558 7.623 0.194) 7.783 14.290 ( 1.832 2.024 2.049) 3.413 14.362 ( 0.707 1.462 -2.137) 2.684 14.514 ( 3.033 -2.112 0.124) 3.698 ======================= Grid point 222 (114/260) ======================= q-point: ( 0.30 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.708 ( -0.229 25.570 28.236) 38.094 5.077 ( 13.217 24.480 19.051) 33.717 5.784 ( -10.002 19.823 10.085) 24.386 5.868 ( 19.540 14.250 -9.109) 25.843 6.379 ( -4.432 -7.724 7.128) 11.407 6.596 ( 0.918 2.691 11.346) 11.697 6.822 ( 9.990 4.333 14.353) 18.016 6.902 ( 4.009 -5.330 -2.919) 7.280 7.135 ( 11.476 17.454 2.672) 21.059 7.445 ( 5.759 -10.364 -6.349) 13.450 7.607 ( 6.884 4.069 0.303) 8.003 8.086 ( -9.824 -9.080 -3.713) 13.883 8.402 ( -1.889 -11.758 -8.586) 14.681 8.615 ( -2.607 -1.658 -4.538) 5.490 8.862 ( -7.216 -8.898 7.680) 13.792 9.079 ( 0.808 -3.394 -1.068) 3.648 9.545 ( -0.230 -0.002 8.029) 8.033 9.757 ( 2.396 -6.098 4.493) 7.945 10.114 ( -9.060 3.734 -11.587) 15.175 10.176 ( -2.392 0.528 -6.801) 7.229 10.765 ( -0.466 7.236 -0.881) 7.305 10.950 ( -1.547 -1.022 1.896) 2.652 11.085 ( -0.770 1.796 -4.279) 4.704 11.365 ( -0.005 -2.358 -5.202) 5.712 11.583 ( -0.266 -0.460 -4.765) 4.795 11.808 ( 1.871 -3.079 4.640) 5.875 11.953 ( -0.793 1.143 -5.431) 5.606 12.327 ( -3.132 -9.271 -2.307) 10.054 13.077 ( -0.404 4.868 -0.850) 4.958 13.341 ( -2.418 -1.810 3.219) 4.414 13.618 ( -0.978 -1.102 -3.154) 3.482 13.684 ( -2.518 -5.234 -4.254) 7.200 14.076 ( 2.845 7.031 0.838) 7.631 14.317 ( 1.299 0.151 -1.792) 2.219 14.405 ( 2.318 3.719 4.103) 6.003 14.579 ( 2.659 -2.135 2.519) 4.240 ======================= Grid point 223 (115/260) ======================= q-point: ( 0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.774 ( -16.597 25.678 22.607) 38.025 5.408 ( 9.182 24.261 12.991) 29.011 5.786 ( -4.817 19.210 16.015) 25.470 5.962 ( -15.078 18.611 1.776) 24.018 6.215 ( 8.033 2.661 -12.227) 14.870 6.552 ( -6.982 -15.757 -8.284) 19.122 7.033 ( 8.846 -18.439 10.427) 22.956 7.227 ( 10.039 -7.202 7.543) 14.475 7.238 ( 3.782 4.886 2.504) 6.667 7.662 ( 16.050 7.019 0.546) 17.526 7.767 ( 0.210 6.300 5.077) 8.094 8.003 ( 6.136 -6.778 1.439) 9.256 8.294 ( -1.457 -4.513 -6.207) 7.811 8.552 ( 2.173 3.880 -5.665) 7.202 8.803 ( -5.939 -11.891 8.684) 15.877 9.073 ( -3.380 2.677 3.064) 5.289 9.403 ( -16.042 6.987 -3.180) 17.784 9.817 ( 4.489 -2.613 0.228) 5.199 9.870 ( -6.304 4.167 -13.233) 15.239 10.233 ( 6.447 -7.036 4.608) 10.597 10.715 ( -2.292 5.395 -2.801) 6.497 10.910 ( -2.962 -2.121 -0.871) 3.746 11.026 ( -0.795 1.953 -5.895) 6.260 11.314 ( -0.077 -4.005 -8.334) 9.247 11.524 ( -0.840 2.569 -5.982) 6.564 11.845 ( -0.794 0.199 1.060) 1.339 11.927 ( 2.676 -3.590 -4.019) 6.017 12.210 ( -5.822 -8.056 -4.285) 10.823 13.079 ( 1.210 3.310 -0.461) 3.555 13.314 ( -2.977 -1.348 2.365) 4.034 13.542 ( -1.739 -2.213 -5.996) 6.624 13.668 ( 1.914 -4.455 -1.249) 5.007 14.139 ( 2.883 6.045 1.394) 6.841 14.325 ( 1.288 0.538 -1.819) 2.293 14.484 ( 1.265 3.299 6.211) 7.145 14.644 ( 1.247 -1.845 3.920) 4.508 ======================= Grid point 224 (116/260) ======================= q-point: (-0.50 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.541 ( -24.333 27.008 16.057) 39.741 5.394 ( -30.829 17.884 -2.574) 35.734 5.657 ( 4.650 22.768 15.750) 28.072 5.995 ( -0.189 6.446 5.274) 8.331 6.197 ( -3.350 5.480 -1.188) 6.532 6.400 ( -1.573 -18.184 -6.457) 19.360 7.137 ( -0.686 6.127 -1.701) 6.395 7.293 ( 1.791 -4.795 9.985) 11.220 7.488 ( 0.034 -7.532 10.011) 12.528 7.733 ( 2.772 -0.640 2.575) 3.837 7.949 ( 10.708 3.242 -1.491) 11.287 8.123 ( 5.545 -15.413 -0.949) 16.407 8.226 ( -4.040 1.255 0.160) 4.233 8.594 ( -2.192 5.108 0.052) 5.558 8.900 ( 13.264 4.456 4.521) 14.705 9.002 ( -8.152 5.657 7.859) 12.658 9.094 ( -9.022 0.352 -6.859) 11.339 9.630 ( -6.259 -0.606 -12.498) 13.991 9.924 ( 4.708 0.734 0.182) 4.769 10.381 ( 6.684 -6.462 -0.666) 9.321 10.664 ( -1.760 2.323 -1.128) 3.124 10.837 ( -2.255 -1.049 -3.496) 4.290 10.969 ( 0.158 1.508 -5.089) 5.310 11.211 ( -2.031 -4.528 -11.283) 12.326 11.463 ( 0.395 4.202 -7.101) 8.261 11.828 ( 0.233 0.900 -3.206) 3.338 11.926 ( -1.589 -5.414 -2.448) 6.151 12.101 ( -0.983 -6.662 -2.214) 7.088 13.111 ( 2.333 1.920 -0.028) 3.022 13.275 ( -2.963 -1.056 1.537) 3.501 13.479 ( 0.242 -0.019 -5.291) 5.297 13.711 ( 4.046 -5.157 -1.827) 6.805 14.199 ( 2.213 5.206 1.700) 5.907 14.333 ( 1.073 0.726 -1.406) 1.912 14.546 ( -0.761 2.338 7.197) 7.605 14.685 ( -0.660 -1.407 4.456) 4.719 ======================= Grid point 225 (117/260) ======================= q-point: (-0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.206 ( -25.706 28.475 14.720) 41.089 4.780 ( -32.832 20.887 -2.958) 39.025 5.789 ( -11.864 -17.962 -9.077) 23.362 5.826 ( -2.201 21.770 16.262) 27.262 6.194 ( -8.494 -10.049 4.552) 13.923 6.395 ( 4.469 13.660 6.939) 15.960 7.078 ( -8.191 21.084 3.840) 22.942 7.244 ( -14.913 10.132 8.461) 19.916 7.521 ( -0.376 -16.875 7.563) 18.496 7.842 ( -3.008 -1.399 -0.975) 3.458 8.007 ( 4.091 -1.809 -0.932) 4.569 8.116 ( 2.491 -3.811 -2.847) 5.370 8.370 ( 12.240 -7.839 2.636) 14.772 8.504 ( -2.792 3.900 -2.315) 5.325 8.882 ( -2.124 -2.284 -9.274) 9.785 8.932 ( -6.700 7.845 6.507) 12.197 9.279 ( 11.223 -5.690 9.050) 15.500 9.454 ( -1.598 -4.113 -9.079) 10.094 9.988 ( 3.377 2.331 -1.847) 4.500 10.442 ( 3.279 -6.615 -7.703) 10.670 10.582 ( -4.017 2.266 -5.185) 6.939 10.823 ( 2.732 -0.028 -0.531) 2.784 10.970 ( 3.591 0.347 -2.438) 4.354 11.070 ( -2.027 -2.960 -11.342) 11.895 11.425 ( 1.527 3.934 -6.348) 7.623 11.772 ( -1.117 -1.224 -8.295) 8.459 11.881 ( -0.984 -1.777 1.397) 2.465 12.126 ( 3.169 -5.531 0.029) 6.374 13.151 ( 1.601 0.446 -0.015) 1.662 13.237 ( -2.170 -1.066 1.403) 2.795 13.467 ( 2.802 3.361 -4.259) 6.106 13.781 ( 5.688 -4.908 -2.864) 8.040 14.245 ( 1.057 5.059 1.855) 5.491 14.341 ( 1.001 0.660 -1.049) 1.593 14.573 ( -2.840 0.651 6.872) 7.464 14.695 ( -2.294 -1.303 4.604) 5.306 ======================= Grid point 226 (118/260) ======================= q-point: (-0.30 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.847 ( -27.832 27.643 13.865) 41.605 4.201 ( -27.969 29.800 3.202) 40.994 5.512 ( -11.912 -24.492 -1.839) 27.297 5.841 ( -11.096 20.893 13.914) 27.445 6.046 ( -8.830 -8.436 3.490) 12.701 6.534 ( 0.717 21.794 7.801) 23.159 6.910 ( -14.857 26.993 10.782) 32.644 7.001 ( -18.585 11.136 10.138) 23.920 7.490 ( -10.208 -6.537 -0.343) 12.127 7.689 ( -5.329 -5.665 2.268) 8.101 8.114 ( 9.067 -0.255 -4.681) 10.208 8.243 ( 10.341 -6.713 -1.908) 12.476 8.487 ( 3.317 1.834 -4.378) 5.791 8.587 ( 7.773 -9.544 3.361) 12.760 8.784 ( 0.818 -3.612 -10.256) 10.904 8.891 ( -2.891 2.228 4.367) 5.691 9.317 ( -3.321 -15.969 0.339) 16.314 9.541 ( 5.851 -6.327 3.654) 9.360 10.016 ( 0.483 3.738 -1.668) 4.122 10.352 ( -2.950 -5.232 -10.418) 12.026 10.527 ( 2.600 2.605 -3.196) 4.875 10.870 ( 5.247 -3.042 -7.904) 9.963 10.999 ( 2.273 0.873 -3.491) 4.256 11.046 ( 5.120 -0.346 -0.799) 5.193 11.402 ( 0.540 4.375 -4.422) 6.244 11.692 ( 0.525 -1.440 -8.127) 8.271 11.895 ( 0.423 1.894 1.878) 2.700 12.190 ( 3.289 -4.875 0.387) 5.893 13.150 ( -1.289 -0.008 -0.323) 1.329 13.236 ( 0.206 -1.695 2.183) 2.772 13.504 ( 4.539 6.537 -3.353) 8.636 13.866 ( 6.418 -3.935 -3.557) 8.327 14.263 ( -1.044 6.153 1.957) 6.541 14.352 ( 0.999 0.601 -0.889) 1.466 14.558 ( -3.886 -1.359 4.496) 6.096 14.682 ( -3.198 -2.442 4.421) 5.978 ======================= Grid point 227 (119/260) ======================= q-point: (-0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.420 ( -27.736 30.682 12.245) 43.135 3.884 ( -16.361 37.785 16.114) 44.216 5.347 ( -7.848 -28.302 6.017) 29.980 5.693 ( -16.141 21.560 15.235) 30.943 5.918 ( -8.904 6.837 1.066) 11.276 6.498 ( -9.744 15.375 7.900) 19.843 6.679 ( -22.119 26.954 14.886) 37.913 6.876 ( -1.866 12.056 2.917) 12.544 7.263 ( -12.820 3.360 5.380) 14.303 7.662 ( 0.422 -11.395 -3.273) 11.863 8.246 ( 8.615 -3.402 -4.279) 10.203 8.404 ( 8.987 -6.330 -2.178) 11.206 8.521 ( 3.107 -1.638 -3.495) 4.955 8.663 ( -4.094 -8.408 4.952) 10.582 8.737 ( 2.481 -4.206 -6.476) 8.111 8.945 ( 9.428 -1.949 -5.185) 10.935 9.274 ( -3.053 -18.293 2.526) 18.717 9.640 ( 2.157 -11.951 2.687) 12.438 9.972 ( -3.626 3.964 1.552) 5.592 10.250 ( 0.503 -4.116 -5.075) 6.553 10.613 ( 8.044 2.877 0.016) 8.543 10.913 ( 6.785 -3.543 -7.926) 11.019 11.031 ( 2.057 2.182 -1.553) 3.377 11.137 ( 6.037 -1.632 -2.067) 6.586 11.361 ( -1.966 5.936 -2.088) 6.592 11.660 ( 2.546 -1.044 -6.908) 7.436 11.922 ( 0.961 4.216 1.523) 4.584 12.244 ( 2.154 -4.267 0.355) 4.793 13.122 ( -1.394 0.902 0.240) 1.678 13.263 ( 0.360 -2.248 2.608) 3.462 13.565 ( 4.603 8.127 -2.566) 9.686 13.951 ( 5.834 -3.219 -3.252) 7.414 14.233 ( -4.184 7.669 2.266) 9.026 14.357 ( 0.192 1.051 -1.095) 1.530 14.513 ( -3.164 -2.631 0.850) 4.202 14.650 ( -3.558 -4.452 2.315) 6.151 ======================= Grid point 228 (120/260) ======================= q-point: (-0.10 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.162 ( -12.185 37.651 18.335) 43.615 3.831 ( -8.125 39.075 23.395) 46.262 5.318 ( -3.839 -29.477 10.873) 31.652 5.563 ( -12.893 31.973 18.933) 39.332 5.732 ( -9.212 13.481 -2.048) 16.455 6.412 ( -6.982 7.152 9.961) 14.111 6.433 ( -15.876 25.152 11.541) 31.904 6.844 ( -2.681 8.689 -1.971) 9.305 7.158 ( -7.338 9.262 12.035) 16.866 7.627 ( 0.817 -11.786 -7.786) 14.149 8.351 ( 6.595 -5.998 -2.920) 9.380 8.465 ( -8.211 -9.350 0.278) 12.447 8.530 ( 6.069 -12.227 -3.036) 13.984 8.630 ( 1.806 -1.519 -4.017) 4.659 8.757 ( 3.951 -1.227 -2.684) 4.932 9.096 ( 10.770 -4.889 -5.550) 13.065 9.233 ( -4.438 -18.290 3.980) 19.238 9.631 ( -3.559 -12.690 -2.468) 13.408 9.989 ( 1.827 4.456 7.836) 9.198 10.327 ( 8.157 -3.735 4.232) 9.920 10.801 ( 11.118 0.640 -0.498) 11.148 10.947 ( 1.762 -2.466 -3.412) 4.564 11.034 ( 0.972 3.060 -3.234) 4.557 11.228 ( 4.246 -3.149 -0.995) 5.379 11.324 ( 1.593 6.564 -1.580) 6.937 11.651 ( 1.058 -1.447 -4.122) 4.495 11.958 ( 2.374 5.240 0.205) 5.757 12.272 ( 0.593 -3.913 0.357) 3.974 13.108 ( -0.646 2.196 0.989) 2.494 13.290 ( 0.069 -1.962 2.791) 3.412 13.624 ( 3.646 7.888 -1.585) 8.833 14.019 ( 3.880 -3.488 -2.340) 5.718 14.155 ( -6.201 8.228 2.395) 10.578 14.327 ( -2.650 1.640 -1.079) 3.298 14.470 ( -0.494 -2.677 -2.612) 3.773 14.586 ( -3.753 -4.641 -1.623) 6.185 ======================= Grid point 229 (121/260) ======================= q-point: ( 0.00 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.037 ( 4.103 34.980 20.726) 40.865 4.636 ( -1.531 3.092 16.213) 16.576 4.847 ( 4.415 -0.114 20.815) 21.279 5.419 ( 1.356 -27.969 14.836) 31.689 6.121 ( -0.787 25.659 -5.175) 26.187 6.578 ( -5.484 -13.958 0.603) 15.009 6.787 ( -4.476 17.718 4.822) 18.900 7.085 ( -5.313 25.894 8.074) 27.639 7.214 ( -4.902 5.432 11.749) 13.841 7.620 ( 3.231 17.937 -10.564) 21.066 7.955 ( -1.729 -26.358 2.579) 26.540 8.117 ( 1.883 -24.132 -5.992) 24.936 8.367 ( -9.725 5.889 1.119) 11.424 8.550 ( -8.115 -7.358 -1.441) 11.048 8.867 ( 6.246 0.969 3.189) 7.080 8.939 ( 3.272 -7.626 3.834) 9.141 9.164 ( 2.235 1.912 -1.716) 3.406 9.284 ( -2.863 -9.256 -3.366) 10.257 10.301 ( 8.325 8.020 9.197) 14.772 10.451 ( 8.923 -6.412 7.853) 13.506 10.869 ( 0.654 2.546 -7.069) 7.542 10.924 ( 0.980 -2.338 -4.475) 5.143 11.152 ( 5.607 3.564 -0.168) 6.646 11.228 ( 3.848 -3.563 1.166) 5.372 11.474 ( 2.975 4.455 -2.252) 5.811 11.567 ( -0.485 -3.977 -1.802) 4.393 12.096 ( 1.195 4.397 -0.252) 4.564 12.188 ( -0.022 -4.596 0.078) 4.597 13.190 ( 0.753 3.935 1.667) 4.339 13.264 ( 0.459 -3.201 2.491) 4.081 13.790 ( -0.044 6.217 -2.141) 6.575 13.918 ( -0.751 -6.344 -3.078) 7.092 14.218 ( -4.502 6.552 0.958) 8.007 14.301 ( -3.787 -0.444 1.164) 3.986 14.407 ( 1.184 -0.575 -4.361) 4.555 14.441 ( -0.177 -2.824 -3.723) 4.676 ======================= Grid point 230 (122/260) ======================= q-point: ( 0.10 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.386 ( 13.601 28.029 21.411) 37.803 4.805 ( 4.459 5.210 17.525) 18.819 5.172 ( 10.929 0.630 22.279) 24.823 5.619 ( 5.766 -23.570 16.359) 29.265 6.138 ( 7.225 21.466 -4.578) 23.107 6.490 ( -7.043 -0.275 4.156) 8.182 6.762 ( 1.949 3.717 -4.584) 6.215 7.046 ( -7.286 -6.475 5.482) 11.184 7.286 ( 2.533 36.376 13.580) 38.911 7.604 ( 4.407 19.611 -9.424) 22.199 7.892 ( -9.579 -3.050 2.081) 10.266 8.102 ( 3.496 -23.761 -10.785) 26.328 8.267 ( -0.932 -16.045 5.918) 17.127 8.345 ( -12.476 -11.235 -1.268) 16.837 8.957 ( 0.788 0.941 -3.996) 4.181 9.017 ( 2.911 -4.527 -1.902) 5.708 9.229 ( 1.742 -3.088 6.688) 7.569 9.232 ( 0.952 -3.773 6.984) 7.995 10.477 ( 3.824 6.521 0.298) 7.566 10.585 ( 0.327 -4.187 -2.218) 4.749 10.826 ( 1.305 4.677 -2.415) 5.423 10.885 ( -0.494 -0.610 -0.460) 0.910 11.218 ( 1.713 4.847 -0.944) 5.227 11.333 ( 3.833 -6.646 2.639) 8.113 11.529 ( 4.388 0.599 -1.756) 4.764 11.558 ( 0.977 -1.865 0.662) 2.207 12.103 ( -0.175 3.324 -0.658) 3.393 12.186 ( 0.032 -4.827 -0.095) 4.828 13.214 ( 0.117 4.468 1.646) 4.763 13.289 ( -0.124 -2.923 2.629) 3.933 13.740 ( -2.812 3.877 -2.849) 5.572 13.835 ( -4.258 -5.461 -4.865) 8.463 14.172 ( -0.858 6.737 -0.186) 6.793 14.271 ( -0.580 -2.122 0.627) 2.288 14.390 ( 0.884 1.101 -2.691) 3.039 14.431 ( 1.668 -2.280 -1.989) 3.455 ======================= Grid point 231 (123/260) ======================= q-point: ( 0.20 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.838 ( 14.640 21.772 21.057) 33.642 5.085 ( 9.870 8.227 17.431) 21.655 5.595 ( 14.994 -0.357 19.766) 24.812 5.878 ( 8.209 -15.867 12.431) 21.764 6.303 ( 12.350 11.290 0.397) 16.737 6.375 ( -9.702 14.390 6.138) 18.409 6.775 ( 4.927 -9.662 -9.978) 14.738 6.908 ( -9.400 -14.545 0.075) 17.318 7.493 ( 4.640 33.434 8.576) 34.827 7.581 ( -6.965 19.905 4.313) 21.525 7.729 ( 2.300 14.506 -6.542) 16.079 8.071 ( -5.783 -15.247 -2.115) 16.443 8.115 ( -0.887 -15.204 -9.859) 18.143 8.394 ( 4.126 -25.491 10.821) 27.998 8.864 ( -5.019 1.967 -5.448) 7.664 8.970 ( -2.205 -6.892 -5.387) 9.021 9.370 ( 6.075 -0.079 10.035) 11.730 9.414 ( 5.998 -4.766 12.509) 14.669 10.412 ( -4.299 2.980 -10.874) 12.067 10.441 ( -8.054 0.175 -9.959) 12.810 10.868 ( 1.121 4.477 2.694) 5.344 10.917 ( 0.683 -0.788 3.539) 3.689 11.217 ( -0.122 6.460 -2.588) 6.960 11.348 ( -0.793 -5.569 -3.613) 6.685 11.587 ( 2.781 0.655 -0.900) 2.996 11.631 ( 3.941 -3.549 3.494) 6.351 12.075 ( -1.781 3.935 -1.834) 4.693 12.183 ( -0.479 -6.856 -0.618) 6.901 13.215 ( -1.066 5.284 0.584) 5.422 13.300 ( -1.030 -3.033 2.359) 3.978 13.659 ( -2.749 0.910 -3.404) 4.469 13.705 ( -4.413 -3.926 -5.840) 8.307 14.176 ( 1.444 6.438 -0.662) 6.632 14.276 ( 1.073 -3.173 -0.845) 3.454 14.411 ( 2.004 2.918 1.320) 3.778 14.466 ( 2.486 -2.518 1.057) 3.693 ======================= Grid point 232 (124/260) ======================= q-point: ( 0.30 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.206 ( 5.068 22.240 20.741) 30.830 5.441 ( 13.061 6.199 15.101) 20.906 5.962 ( 5.733 -1.604 10.134) 11.754 6.071 ( 7.025 -4.868 0.635) 8.570 6.294 ( -4.338 17.112 11.379) 21.003 6.584 ( 13.088 0.273 5.046) 14.030 6.683 ( -6.403 -14.175 -8.044) 17.511 6.767 ( -3.888 -9.921 -1.230) 10.726 7.372 ( -5.827 12.742 0.727) 14.030 7.640 ( -1.533 1.631 0.353) 2.266 7.825 ( 7.302 6.561 -3.862) 10.549 7.997 ( 1.352 21.860 10.477) 24.279 8.136 ( 8.217 -13.441 -9.573) 18.434 8.522 ( -2.560 -18.472 12.712) 22.569 8.727 ( -3.662 5.332 -5.150) 8.268 8.925 ( 3.367 -11.283 -4.160) 12.488 9.559 ( 4.573 1.705 9.205) 10.419 9.625 ( 5.289 -5.163 10.312) 12.688 10.178 ( -10.326 2.588 -10.014) 14.615 10.202 ( -7.166 0.493 -11.186) 13.294 10.875 ( -2.077 3.483 0.453) 4.081 10.924 ( -2.495 -1.711 1.680) 3.461 11.170 ( -0.635 6.068 -6.362) 8.814 11.288 ( -0.397 -4.971 -7.144) 8.713 11.619 ( 1.627 3.870 -0.951) 4.305 11.720 ( 2.693 -5.325 2.978) 6.669 12.009 ( -2.619 4.590 -4.001) 6.628 12.141 ( -2.862 -8.311 -2.659) 9.183 13.190 ( -1.380 5.795 -0.498) 5.978 13.290 ( -1.776 -3.655 1.526) 4.340 13.585 ( -2.090 -1.050 -5.192) 5.695 13.603 ( -1.507 -2.583 -3.202) 4.381 14.208 ( 2.423 5.639 -0.541) 6.161 14.293 ( 1.771 -2.648 -1.418) 3.487 14.476 ( 2.085 3.157 4.404) 5.806 14.532 ( 2.311 -2.491 3.662) 4.995 ======================= Grid point 233 (125/260) ======================= q-point: ( 0.40 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.315 ( -10.285 26.749 14.197) 31.982 5.751 ( 6.035 -4.435 11.455) 13.686 5.982 ( -3.830 4.635 5.879) 8.409 6.144 ( -4.529 0.788 -2.855) 5.411 6.221 ( -6.018 7.480 -7.836) 12.393 6.426 ( -9.938 -6.825 -6.156) 13.536 6.791 ( 8.279 1.245 14.094) 16.393 6.983 ( 12.729 -12.854 13.246) 22.421 7.362 ( 2.725 8.960 0.120) 9.366 7.621 ( 3.766 -13.915 -1.112) 14.458 7.946 ( 8.823 9.023 -4.852) 13.521 8.025 ( -6.519 6.843 3.822) 10.195 8.253 ( 4.075 3.026 0.978) 5.169 8.507 ( -6.952 -15.919 9.272) 19.690 8.749 ( 11.066 14.231 -1.438) 18.085 9.015 ( 5.739 -9.118 1.333) 10.856 9.567 ( -10.980 8.176 -1.526) 13.774 9.719 ( -2.010 -6.671 -0.099) 6.968 9.961 ( -3.429 5.305 -4.836) 7.956 10.086 ( 2.395 -6.846 1.100) 7.335 10.809 ( -3.452 3.528 -2.541) 5.552 10.867 ( -3.519 -2.397 -0.952) 4.363 11.097 ( -0.731 5.074 -7.904) 9.421 11.210 ( -0.828 -5.624 -9.158) 10.779 11.630 ( 1.136 7.102 -2.919) 7.762 11.781 ( 1.949 -6.799 1.124) 7.162 11.921 ( -2.197 3.679 -5.333) 6.842 12.040 ( -4.152 -7.743 -4.533) 9.887 13.168 ( -0.339 5.102 -0.698) 5.161 13.265 ( -1.836 -3.866 0.462) 4.304 13.521 ( -0.153 0.910 -4.509) 4.602 13.578 ( 1.017 -4.138 -2.423) 4.902 14.250 ( 2.499 4.568 -0.366) 5.219 14.315 ( 1.791 -1.739 -1.381) 2.853 14.549 ( 0.728 2.947 6.235) 6.935 14.602 ( 0.938 -2.320 5.332) 5.890 ======================= Grid point 234 (126/260) ======================= q-point: (-0.50 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.119 ( -18.903 29.195 7.712) 35.625 5.685 ( -16.791 -22.828 1.424) 28.374 5.732 ( -21.752 12.504 -9.990) 27.005 6.016 ( -10.434 -13.315 -11.006) 20.181 6.117 ( 4.232 21.073 12.400) 24.814 6.437 ( 5.584 -4.273 9.926) 12.164 7.073 ( 8.476 3.461 12.559) 15.541 7.282 ( 7.016 -11.314 10.819) 17.155 7.464 ( 8.226 12.593 0.053) 15.042 7.743 ( 8.599 -10.966 -1.864) 14.059 7.885 ( -9.643 3.829 3.565) 10.971 7.998 ( -2.325 -2.478 -0.763) 3.483 8.293 ( 2.972 7.021 1.303) 7.734 8.502 ( 0.510 -11.440 3.050) 11.851 8.995 ( 7.944 7.349 5.562) 12.168 9.091 ( -0.806 -0.357 3.658) 3.763 9.267 ( -12.623 13.180 -6.362) 19.327 9.525 ( -10.771 -10.226 -7.346) 16.570 10.001 ( 5.333 7.620 -0.256) 9.305 10.199 ( 6.163 -10.536 0.468) 12.215 10.734 ( -1.881 3.810 -3.250) 5.349 10.801 ( -1.650 -2.657 -2.295) 3.879 11.017 ( -0.788 3.449 -6.942) 7.791 11.105 ( -1.894 -5.094 -9.254) 10.732 11.599 ( 0.360 8.377 -7.525) 11.266 11.778 ( -1.039 -8.567 -6.488) 10.797 11.872 ( 0.551 3.361 -0.780) 3.494 11.968 ( 0.379 -5.943 -1.465) 6.133 13.165 ( 0.505 3.304 -0.685) 3.411 13.233 ( -1.612 -3.049 -0.292) 3.461 13.508 ( 2.594 3.169 -3.664) 5.495 13.600 ( 3.638 -5.438 -2.371) 6.959 14.290 ( 2.201 3.457 -0.370) 4.115 14.334 ( 1.530 -0.877 -1.325) 2.206 14.598 ( -1.646 2.650 7.207) 7.853 14.648 ( -1.248 -2.195 6.147) 6.646 ======================= Grid point 235 (127/260) ======================= q-point: (-0.40 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.798 ( -22.014 28.942 5.661) 36.801 5.223 ( -23.878 22.437 -3.800) 32.985 5.349 ( -19.113 -23.875 -3.912) 30.833 5.721 ( -13.539 -25.282 -2.987) 28.834 6.295 ( 2.535 22.063 11.724) 25.113 6.636 ( 5.926 -5.522 9.353) 12.373 7.278 ( 4.495 4.446 5.786) 8.570 7.363 ( -7.600 1.179 9.450) 12.184 7.585 ( -0.408 18.201 4.411) 18.733 7.767 ( -2.276 -0.351 1.620) 2.816 7.878 ( 0.857 -10.918 -1.413) 11.043 7.945 ( 3.789 -11.992 2.400) 12.803 8.407 ( 7.042 7.664 1.186) 10.475 8.543 ( 1.480 -3.100 0.749) 3.516 8.864 ( -11.539 6.106 -4.690) 13.872 9.064 ( -7.194 -5.963 1.863) 9.528 9.177 ( -5.186 5.037 2.507) 7.652 9.346 ( -1.672 -7.422 -0.456) 7.622 10.086 ( 5.759 7.798 -4.305) 10.607 10.273 ( 4.001 -9.510 -6.007) 11.939 10.666 ( -1.842 5.295 -5.343) 7.744 10.774 ( 0.739 -4.630 -3.594) 5.908 10.983 ( 2.154 1.028 -2.857) 3.723 11.013 ( -0.135 -2.076 -5.644) 6.015 11.542 ( 1.612 6.938 -8.959) 11.445 11.685 ( -0.409 -6.573 -9.172) 11.292 11.908 ( 2.371 3.804 1.368) 4.687 12.008 ( 3.223 -5.718 0.815) 6.615 13.168 ( 0.329 1.361 -0.783) 1.605 13.204 ( -1.127 -1.991 -0.263) 2.303 13.553 ( 5.296 5.131 -3.196) 8.036 13.668 ( 5.968 -5.942 -2.682) 8.839 14.325 ( 2.071 2.571 -0.589) 3.354 14.350 ( 1.511 -0.106 -1.337) 2.021 14.605 ( -4.364 2.340 7.300) 8.821 14.656 ( -3.623 -2.438 6.281) 7.650 ======================= Grid point 236 (128/260) ======================= q-point: (-0.30 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.415 ( -24.219 28.204 5.613) 37.597 4.842 ( -17.158 32.133 3.664) 36.611 4.983 ( -18.279 -26.855 0.738) 32.494 5.491 ( -11.322 -30.314 2.679) 32.470 6.387 ( -1.551 23.595 7.670) 24.859 6.784 ( 2.852 -9.896 5.594) 11.720 7.187 ( -15.618 11.912 8.475) 21.393 7.339 ( -5.521 -2.064 5.612) 8.139 7.525 ( -10.362 25.151 7.917) 28.331 7.694 ( -4.418 6.228 1.235) 7.735 7.957 ( 6.650 -13.129 -2.097) 14.866 8.063 ( 4.081 -13.944 2.698) 14.777 8.527 ( 4.321 4.761 -1.218) 6.544 8.577 ( 4.208 5.211 -0.775) 6.743 8.687 ( -2.919 -1.777 -6.195) 7.075 8.935 ( -5.626 -17.782 0.922) 18.673 9.080 ( -5.659 11.461 3.042) 13.139 9.346 ( -1.992 -12.556 3.810) 13.271 10.115 ( 0.874 5.825 -4.712) 7.542 10.237 ( -1.140 -5.972 -7.557) 9.700 10.622 ( 3.236 6.393 -4.978) 8.725 10.762 ( 4.004 -6.797 -7.068) 10.592 11.020 ( 3.122 0.945 -0.884) 3.380 11.035 ( 3.964 -0.641 -0.631) 4.065 11.513 ( 2.418 5.993 -7.475) 9.881 11.626 ( 1.887 -4.807 -8.233) 9.719 11.968 ( 2.542 4.931 1.697) 5.801 12.079 ( 3.330 -5.764 1.144) 6.754 13.160 ( -0.315 1.163 -0.696) 1.391 13.196 ( 0.017 -2.105 0.532) 2.171 13.637 ( 6.292 6.449 -3.005) 9.498 13.763 ( 6.781 -5.917 -3.012) 9.491 14.355 ( 1.848 2.418 -1.286) 3.304 14.369 ( 1.900 0.608 -1.446) 2.464 14.561 ( -6.568 1.949 6.427) 9.394 14.622 ( -5.489 -3.362 5.662) 8.572 ======================= Grid point 237 (129/260) ======================= q-point: (-0.20 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.067 ( -19.605 32.697 10.553) 39.558 4.650 ( -10.551 36.962 9.863) 39.684 4.728 ( -13.062 -31.953 8.369) 35.520 5.356 ( -7.796 -31.561 7.073) 33.270 6.361 ( -5.580 24.955 1.731) 25.630 6.808 ( -3.099 -15.588 -0.301) 15.896 6.978 ( -15.336 18.031 11.630) 26.374 7.243 ( -9.139 -6.049 9.885) 14.759 7.361 ( -14.203 35.363 7.818) 38.902 7.661 ( 1.355 11.981 -3.891) 12.669 8.022 ( 0.945 -18.974 -0.776) 19.014 8.112 ( 0.714 -20.426 0.017) 20.438 8.550 ( 0.573 6.518 -1.994) 6.840 8.635 ( 2.107 2.098 -2.413) 3.829 8.675 ( 4.091 -0.793 -0.480) 4.194 8.891 ( -2.607 -17.589 3.775) 18.178 9.053 ( 2.457 11.440 -1.362) 11.780 9.345 ( -0.436 -15.892 1.814) 16.001 10.065 ( -1.994 4.966 -0.238) 5.356 10.164 ( -0.404 -4.575 -2.502) 5.230 10.702 ( 8.096 5.570 -2.610) 10.168 10.819 ( 7.134 -5.512 -5.270) 10.443 11.068 ( 2.762 1.555 -1.513) 3.512 11.100 ( 3.995 -1.726 -1.712) 4.676 11.493 ( 1.123 6.471 -5.367) 8.482 11.606 ( 2.214 -4.306 -6.458) 8.071 12.024 ( 2.193 5.664 1.329) 6.217 12.141 ( 2.403 -5.659 0.861) 6.208 13.154 ( 0.058 2.269 0.067) 2.271 13.209 ( 0.527 -2.919 1.280) 3.231 13.721 ( 5.302 7.187 -2.703) 9.331 13.855 ( 5.714 -5.936 -2.878) 8.727 14.359 ( -0.608 3.989 -1.135) 4.192 14.395 ( 2.433 1.217 -2.397) 3.626 14.479 ( -7.161 0.850 4.353) 8.423 14.557 ( -5.544 -4.839 3.452) 8.128 ======================= Grid point 238 (130/260) ======================= q-point: (-0.10 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.918 ( -8.718 36.795 16.946) 41.437 4.591 ( -6.885 13.491 13.270) 20.137 4.679 ( -3.536 -10.634 16.438) 19.895 5.329 ( -3.441 -30.589 11.196) 32.755 6.233 ( -6.551 25.737 -3.178) 26.747 6.695 ( -6.761 -17.392 -1.411) 18.713 6.845 ( -9.673 22.093 10.978) 26.499 7.167 ( -9.520 23.046 5.856) 25.613 7.219 ( -7.618 7.669 13.286) 17.128 7.649 ( 2.604 14.677 -8.330) 17.076 7.984 ( -3.721 -27.229 1.692) 27.534 8.125 ( 2.552 -21.611 -4.794) 22.283 8.508 ( -5.800 8.403 1.489) 10.318 8.643 ( -0.389 -1.052 -2.085) 2.368 8.748 ( 4.121 0.665 1.744) 4.524 8.881 ( -2.012 -13.935 5.664) 15.176 9.120 ( 6.184 6.771 -5.184) 10.534 9.342 ( -0.245 -14.032 -2.780) 14.307 10.105 ( 3.943 6.381 7.018) 10.272 10.231 ( 6.438 -5.711 6.000) 10.491 10.839 ( 8.071 2.710 -2.881) 8.988 10.895 ( 4.399 -2.659 -3.447) 6.189 11.094 ( 2.295 2.899 -2.504) 4.465 11.158 ( 4.475 -3.462 -2.233) 6.083 11.468 ( 0.577 7.022 -3.413) 7.829 11.590 ( 0.778 -4.661 -4.072) 6.238 12.068 ( 1.754 5.515 0.444) 5.804 12.178 ( 1.015 -5.206 0.418) 5.320 13.165 ( 0.622 3.287 0.974) 3.484 13.234 ( 0.664 -3.309 2.001) 3.924 13.779 ( 3.123 7.244 -2.237) 8.200 13.916 ( 3.196 -6.203 -2.511) 7.416 14.304 ( -5.124 6.099 1.163) 8.050 14.381 ( -5.689 1.767 1.756) 6.211 14.413 ( 1.862 -1.318 -3.861) 4.485 14.490 ( -2.653 -4.924 -1.210) 5.722 ======================= Grid point 279 (131/260) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.305 ( 21.458 0.000 34.490) 40.620 2.781 ( -12.004 0.000 41.716) 43.409 4.365 ( -8.951 0.000 -15.770) 18.134 4.808 ( -12.862 0.000 64.621) 65.889 5.176 ( 2.149 0.000 -4.755) 5.219 6.500 ( -9.626 0.000 14.019) 17.005 6.673 ( -23.507 0.000 23.579) 33.295 6.986 ( 6.956 0.000 16.623) 18.020 7.292 ( -1.660 0.000 12.104) 12.217 8.211 ( 8.945 0.000 -13.872) 16.506 8.219 ( 0.984 0.000 -10.432) 10.479 8.459 ( 5.779 0.000 -10.586) 12.061 8.561 ( -2.088 0.000 4.548) 5.004 8.862 ( -0.881 0.000 -6.427) 6.487 9.015 ( 0.830 0.000 -20.601) 20.618 9.244 ( 3.992 0.000 -10.644) 11.368 9.758 ( -0.149 0.000 4.294) 4.297 9.897 ( 13.640 0.000 0.607) 13.653 10.171 ( -8.872 0.000 7.039) 11.326 10.469 ( 0.362 0.000 -4.798) 4.812 10.597 ( -6.379 0.000 -9.264) 11.248 10.990 ( -0.241 0.000 -1.959) 1.973 11.060 ( 4.996 0.000 2.972) 5.813 11.366 ( 6.642 0.000 -3.575) 7.543 11.602 ( 5.988 0.000 -0.979) 6.067 11.616 ( -6.807 0.000 2.246) 7.167 12.233 ( 25.849 0.000 -0.004) 25.849 12.273 ( -3.120 0.000 1.116) 3.314 13.051 ( -4.537 0.000 2.769) 5.315 13.175 ( 3.968 0.000 0.080) 3.969 13.597 ( 2.661 0.000 6.451) 6.978 13.817 ( -4.206 0.000 4.222) 5.959 14.075 ( 5.579 0.000 -2.356) 6.056 14.205 ( -2.656 0.000 -5.851) 6.426 14.421 ( 1.702 0.000 -3.118) 3.552 14.434 ( -13.614 0.000 -1.983) 13.757 ======================= Grid point 280 (132/260) ======================= q-point: ( 0.10 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.048 ( 3.175 0.000 39.035) 39.164 3.230 ( 44.983 0.000 28.660) 53.337 4.277 ( 15.331 0.000 -18.991) 24.407 5.066 ( 2.640 0.000 16.197) 16.411 5.335 ( -0.538 0.000 41.025) 41.029 6.394 ( -14.758 0.000 13.785) 20.195 6.425 ( -23.186 0.000 20.259) 30.790 7.239 ( 5.715 0.000 14.865) 15.926 7.437 ( 5.181 0.000 15.841) 16.666 8.136 ( 0.139 0.000 -11.319) 11.320 8.198 ( 3.142 0.000 -15.684) 15.996 8.315 ( -7.171 0.000 -15.137) 16.750 8.568 ( -2.351 0.000 5.152) 5.663 8.875 ( 2.390 0.000 -18.613) 18.766 8.906 ( 8.462 0.000 -4.542) 9.604 9.192 ( 0.582 0.000 -12.388) 12.401 9.759 ( -8.247 0.000 9.310) 12.437 10.010 ( -6.449 0.000 -2.682) 6.984 10.146 ( 10.595 0.000 3.060) 11.028 10.361 ( -9.997 0.000 -9.239) 13.613 10.463 ( -0.172 0.000 -1.398) 1.409 10.969 ( 0.273 0.000 -2.237) 2.254 11.181 ( 4.678 0.000 3.794) 6.023 11.346 ( -4.720 0.000 -3.742) 6.024 11.595 ( 3.291 0.000 -0.871) 3.405 11.703 ( 5.713 0.000 -0.397) 5.727 12.171 ( -7.581 0.000 -1.783) 7.788 12.527 ( 9.294 0.000 -5.696) 10.901 13.019 ( -1.018 0.000 1.498) 1.811 13.275 ( 6.226 0.000 0.854) 6.284 13.682 ( 0.381 0.000 6.130) 6.142 13.803 ( -2.020 0.000 3.946) 4.433 14.048 ( -3.707 0.000 -6.335) 7.340 14.168 ( 2.562 0.000 -3.780) 4.567 14.228 ( -7.363 0.000 2.117) 7.662 14.479 ( 5.548 0.000 0.055) 5.548 ======================= Grid point 281 (133/260) ======================= q-point: ( 0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.507 ( 12.307 0.000 34.276) 36.419 4.251 ( 35.249 0.000 30.164) 46.394 4.569 ( 31.783 0.000 -18.401) 36.725 5.250 ( 10.986 0.000 0.483) 10.997 5.727 ( 1.417 0.000 40.675) 40.700 6.193 ( -18.886 0.000 11.909) 22.327 6.225 ( -13.106 0.000 22.528) 26.063 7.450 ( 6.170 0.000 9.849) 11.622 7.728 ( 9.521 0.000 19.098) 21.340 8.029 ( -2.018 0.000 -10.836) 11.023 8.054 ( -6.239 0.000 -12.873) 14.306 8.064 ( -3.481 0.000 -15.545) 15.930 8.549 ( -0.218 0.000 -3.015) 3.023 8.804 ( 2.391 0.000 -9.214) 9.519 8.915 ( -9.221 0.000 -0.106) 9.222 9.154 ( 11.547 0.000 -16.255) 19.939 9.559 ( -15.665 0.000 -0.084) 15.665 9.975 ( -0.136 0.000 3.719) 3.722 10.002 ( -14.499 0.000 -12.190) 18.942 10.404 ( -4.204 0.000 -3.109) 5.228 10.404 ( 8.028 0.000 6.892) 10.581 10.963 ( 1.321 0.000 -3.150) 3.416 11.210 ( -5.746 0.000 -3.918) 6.955 11.268 ( 1.478 0.000 1.358) 2.007 11.644 ( 3.950 0.000 -5.074) 6.430 11.804 ( 5.157 0.000 0.630) 5.195 11.986 ( -8.672 0.000 -4.783) 9.903 12.539 ( -0.831 0.000 -6.195) 6.250 13.023 ( 0.359 0.000 0.314) 0.477 13.405 ( 6.850 0.000 0.821) 6.899 13.664 ( -7.418 0.000 3.451) 8.182 13.825 ( 1.408 0.000 5.818) 5.986 13.914 ( -4.655 0.000 -6.153) 7.715 14.184 ( 2.647 0.000 -3.474) 4.367 14.220 ( 2.377 0.000 3.977) 4.633 14.596 ( 5.648 0.000 2.046) 6.007 ======================= Grid point 282 (134/260) ======================= q-point: ( 0.30 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.039 ( 16.075 0.000 29.462) 33.562 4.856 ( -4.213 0.000 39.230) 39.456 5.022 ( 27.290 0.000 -11.418) 29.583 5.437 ( 0.246 0.000 15.023) 15.025 5.913 ( 12.552 0.000 -6.627) 14.194 5.929 ( -15.943 0.000 4.790) 16.647 6.605 ( 22.544 0.000 35.310) 41.893 7.581 ( 2.446 0.000 -0.829) 2.583 7.791 ( -11.125 0.000 -16.462) 19.869 7.896 ( -4.563 0.000 -7.056) 8.403 7.934 ( 3.347 0.000 0.196) 3.352 8.100 ( 10.520 0.000 18.914) 21.643 8.540 ( 5.006 0.000 -8.455) 9.826 8.669 ( -14.560 0.000 -1.332) 14.621 8.782 ( -0.803 0.000 -1.647) 1.832 9.240 ( -4.767 0.000 -2.569) 5.415 9.241 ( -2.431 0.000 -15.013) 15.209 9.610 ( -15.779 0.000 -12.781) 20.306 9.982 ( -3.736 0.000 2.409) 4.445 10.302 ( -1.509 0.000 -3.137) 3.481 10.582 ( 5.251 0.000 5.644) 7.709 10.951 ( 0.421 0.000 -4.253) 4.274 11.076 ( -4.360 0.000 -6.320) 7.678 11.226 ( -4.738 0.000 -4.879) 6.801 11.649 ( 2.354 0.000 -7.181) 7.557 11.819 ( -4.479 0.000 -4.564) 6.394 11.899 ( 4.161 0.000 1.452) 4.407 12.435 ( -4.472 0.000 -5.387) 7.002 13.039 ( 1.186 0.000 0.371) 1.243 13.518 ( 4.576 0.000 -0.670) 4.625 13.534 ( -8.102 0.000 2.000) 8.345 13.789 ( -3.210 0.000 -5.360) 6.248 13.925 ( 3.038 0.000 6.981) 7.613 14.212 ( 2.842 0.000 -1.520) 3.223 14.327 ( 4.644 0.000 4.584) 6.525 14.702 ( 3.599 0.000 2.457) 4.357 ======================= Grid point 283 (135/260) ======================= q-point: (-0.60 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.568 ( 16.244 0.000 25.468) 30.208 4.784 ( -32.277 0.000 34.381) 47.158 5.152 ( -17.487 0.000 12.962) 21.767 5.546 ( -5.646 0.000 23.449) 24.120 5.840 ( 14.966 0.000 -18.828) 24.051 6.219 ( 23.476 0.000 -5.987) 24.227 7.288 ( 8.820 0.000 10.683) 13.854 7.409 ( -9.328 0.000 -4.652) 10.423 7.586 ( 1.845 0.000 -2.461) 3.076 7.823 ( 7.900 0.000 -1.232) 7.996 8.074 ( 6.997 0.000 4.602) 8.374 8.399 ( 0.173 0.000 14.704) 14.705 8.413 ( -9.656 0.000 -0.618) 9.676 8.588 ( 6.635 0.000 -8.495) 10.779 8.711 ( -5.168 0.000 -1.835) 5.484 8.910 ( -14.276 0.000 0.147) 14.277 9.267 ( 6.305 0.000 -12.646) 14.130 9.275 ( -7.673 0.000 -11.646) 13.946 9.889 ( -3.231 0.000 -4.118) 5.234 10.337 ( 5.119 0.000 1.055) 5.227 10.677 ( 2.050 0.000 -0.233) 2.064 10.899 ( -2.132 0.000 -5.216) 5.635 10.940 ( -2.773 0.000 -8.853) 9.277 11.037 ( -7.376 0.000 -11.123) 13.346 11.618 ( 0.504 0.000 -6.147) 6.167 11.739 ( -1.781 0.000 -2.700) 3.234 11.976 ( 2.790 0.000 1.563) 3.198 12.307 ( -4.804 0.000 -4.043) 6.279 13.076 ( 2.198 0.000 1.136) 2.474 13.419 ( -6.153 0.000 2.002) 6.470 13.524 ( -2.399 0.000 -2.929) 3.786 13.737 ( 2.271 0.000 -4.834) 5.341 14.037 ( 2.398 0.000 7.067) 7.463 14.262 ( 2.813 0.000 0.666) 2.891 14.455 ( 4.752 0.000 5.176) 7.027 14.761 ( 0.744 0.000 1.847) 1.991 ======================= Grid point 284 (136/260) ======================= q-point: (-0.50 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.399 ( -37.114 0.000 29.031) 47.119 4.758 ( -37.007 0.000 20.774) 42.439 5.044 ( 13.614 0.000 22.056) 25.919 5.570 ( -15.466 0.000 24.794) 29.223 5.997 ( 17.785 0.000 -21.593) 27.974 6.533 ( 3.426 0.000 -0.609) 3.480 6.922 ( -8.758 0.000 -8.047) 11.894 7.410 ( -9.497 0.000 6.535) 11.529 7.586 ( -4.451 0.000 2.839) 5.279 8.171 ( -20.927 0.000 -0.210) 20.928 8.204 ( -0.017 0.000 2.168) 2.168 8.310 ( 27.861 0.000 5.132) 28.330 8.336 ( -0.001 0.000 1.266) 1.266 8.465 ( -8.718 0.000 -3.448) 9.375 8.763 ( 13.819 0.000 -8.479) 16.212 8.885 ( 4.473 0.000 4.195) 6.132 9.150 ( 1.962 0.000 -8.333) 8.561 9.334 ( 10.095 0.000 -3.775) 10.777 9.842 ( 1.311 0.000 -3.074) 3.342 10.468 ( 8.020 0.000 -0.066) 8.021 10.611 ( -2.998 0.000 -13.289) 13.623 10.784 ( -3.855 0.000 -5.574) 6.777 10.812 ( -5.194 0.000 -13.106) 14.098 10.886 ( 2.430 0.000 -5.002) 5.561 11.566 ( -1.867 0.000 -3.065) 3.589 11.684 ( -2.460 0.000 -1.928) 3.126 12.029 ( 1.916 0.000 1.362) 2.351 12.201 ( -3.830 0.000 -2.421) 4.532 13.136 ( 2.730 0.000 2.274) 3.554 13.343 ( -4.504 0.000 2.803) 5.305 13.424 ( -4.742 0.000 -3.262) 5.755 13.752 ( 3.614 0.000 -5.991) 6.996 14.120 ( 0.070 0.000 6.733) 6.733 14.319 ( 2.333 0.000 1.394) 2.717 14.589 ( 5.109 0.000 5.500) 7.507 14.760 ( -1.856 0.000 0.684) 1.978 ======================= Grid point 285 (137/260) ======================= q-point: (-0.40 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.939 ( -38.364 0.000 25.530) 46.082 4.212 ( -42.377 0.000 23.877) 48.641 5.336 ( -34.929 0.000 27.341) 44.357 5.416 ( 7.920 0.000 18.457) 20.085 6.127 ( 13.273 0.000 -13.177) 18.703 6.172 ( -24.939 0.000 -1.213) 24.969 7.087 ( 3.858 0.000 15.832) 16.295 7.340 ( 7.116 0.000 -6.757) 9.813 7.397 ( -21.182 0.000 1.988) 21.275 7.697 ( -24.013 0.000 5.490) 24.632 8.230 ( 2.599 0.000 -6.518) 7.017 8.253 ( -5.450 0.000 -6.347) 8.366 8.465 ( 9.811 0.000 2.028) 10.018 8.743 ( 10.450 0.000 2.480) 10.740 9.002 ( 18.094 0.000 -8.443) 19.967 9.021 ( 8.232 0.000 0.713) 8.263 9.192 ( 10.533 0.000 -7.383) 12.862 9.536 ( 11.297 0.000 0.705) 11.319 9.868 ( 1.631 0.000 1.836) 2.456 10.424 ( -2.299 0.000 -14.900) 15.077 10.571 ( 5.516 0.000 -13.258) 14.359 10.686 ( -0.399 0.000 -6.706) 6.717 10.696 ( 2.813 0.000 -0.515) 2.859 10.912 ( 4.399 0.000 -4.953) 6.624 11.501 ( -3.944 0.000 0.343) 3.959 11.612 ( -3.726 0.000 -1.860) 4.165 12.076 ( 2.141 0.000 1.349) 2.531 12.119 ( -3.743 0.000 -1.206) 3.933 13.208 ( 2.223 0.000 3.354) 4.024 13.299 ( -3.270 0.000 3.973) 5.146 13.312 ( -4.426 0.000 -2.999) 5.346 13.765 ( 3.731 0.000 -6.433) 7.437 14.144 ( -3.327 0.000 6.002) 6.862 14.362 ( 1.508 0.000 0.137) 1.514 14.711 ( -3.446 0.000 -0.493) 3.481 14.731 ( 5.501 0.000 4.706) 7.240 ======================= Grid point 286 (138/260) ======================= q-point: (-0.30 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.391 ( -44.004 0.000 20.280) 48.453 3.638 ( -43.515 0.000 28.261) 51.887 4.841 ( -45.966 0.000 42.628) 62.690 5.601 ( -4.245 0.000 13.018) 13.692 5.777 ( -16.281 0.000 -4.448) 16.877 6.280 ( 10.629 0.000 -2.452) 10.908 6.895 ( -28.121 0.000 0.837) 28.133 7.112 ( -16.829 0.000 29.556) 34.011 7.452 ( -12.646 0.000 8.505) 15.240 7.604 ( 25.599 0.000 -15.965) 30.169 8.162 ( -0.425 0.000 -2.036) 2.080 8.219 ( 4.252 0.000 -9.147) 10.087 8.666 ( 8.335 0.000 4.716) 9.577 8.798 ( -1.708 0.000 -2.825) 3.301 9.185 ( 9.339 0.000 -1.726) 9.497 9.251 ( 18.493 0.000 -11.367) 21.707 9.323 ( 8.036 0.000 -9.704) 12.600 9.704 ( 7.737 0.000 -4.853) 9.133 9.921 ( 0.719 0.000 6.504) 6.543 10.352 ( 6.458 0.000 -6.457) 9.132 10.541 ( 4.331 0.000 -8.701) 9.719 10.689 ( 5.498 0.000 -3.715) 6.635 10.814 ( 6.635 0.000 0.372) 6.645 10.956 ( 5.658 0.000 -6.183) 8.381 11.431 ( -5.285 0.000 3.276) 6.218 11.525 ( -3.489 0.000 -2.210) 4.130 12.035 ( -4.695 0.000 -0.734) 4.752 12.136 ( 3.017 0.000 1.721) 3.473 13.217 ( -3.345 0.000 -2.568) 4.217 13.236 ( -2.998 0.000 3.853) 4.882 13.318 ( 1.308 0.000 5.292) 5.451 13.790 ( 4.786 0.000 -5.562) 7.337 14.100 ( -6.415 0.000 5.012) 8.141 14.374 ( 0.691 0.000 -2.232) 2.337 14.633 ( -4.012 0.000 -1.491) 4.280 14.849 ( 3.908 0.000 1.358) 4.137 ======================= Grid point 287 (139/260) ======================= q-point: (-0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.669 ( -51.044 0.000 20.558) 55.028 3.131 ( -39.480 0.000 34.135) 52.191 4.521 ( -34.915 0.000 60.271) 69.654 5.382 ( -26.238 0.000 1.240) 26.267 5.480 ( -10.491 0.000 -8.272) 13.360 6.454 ( 5.764 0.000 5.044) 7.659 6.590 ( -7.220 0.000 9.147) 11.653 7.025 ( -19.283 0.000 28.444) 34.364 7.329 ( -9.483 0.000 9.900) 13.709 7.902 ( 20.168 0.000 -14.219) 24.677 8.197 ( 3.981 0.000 0.513) 4.014 8.252 ( 8.073 0.000 -9.214) 12.251 8.700 ( -4.209 0.000 -5.136) 6.640 8.836 ( 5.109 0.000 5.922) 7.821 9.294 ( 2.101 0.000 -15.056) 15.202 9.296 ( 5.847 0.000 -7.183) 9.263 9.472 ( 15.664 0.000 -12.322) 19.930 9.726 ( 2.733 0.000 -8.676) 9.096 10.026 ( 3.024 0.000 9.375) 9.851 10.574 ( 2.046 0.000 -0.695) 2.161 10.611 ( 21.581 0.000 3.837) 21.920 10.770 ( 4.483 0.000 -2.921) 5.351 10.907 ( 4.147 0.000 -1.805) 4.523 11.038 ( 8.814 0.000 -3.133) 9.355 11.382 ( -3.093 0.000 6.466) 7.167 11.472 ( 0.414 0.000 -2.194) 2.233 11.932 ( -6.040 0.000 -0.695) 6.080 12.211 ( 3.115 0.000 2.303) 3.873 13.152 ( -1.579 0.000 -1.877) 2.453 13.193 ( -5.031 0.000 4.080) 6.477 13.400 ( 2.091 0.000 6.021) 6.374 13.854 ( 6.550 0.000 -3.795) 7.570 14.003 ( -8.036 0.000 4.145) 9.042 14.351 ( -0.075 0.000 -4.502) 4.503 14.544 ( -3.796 0.000 -2.551) 4.573 14.863 ( -2.009 0.000 -4.059) 4.529 ======================= Grid point 288 (140/260) ======================= q-point: (-0.10 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.082 ( -29.369 0.000 31.774) 43.269 2.810 ( -28.451 0.000 39.767) 48.897 4.553 ( -22.082 0.000 68.592) 72.059 4.819 ( -26.935 0.000 -9.246) 28.478 5.265 ( -4.210 0.000 -10.119) 10.960 6.518 ( -4.698 0.000 12.352) 13.215 6.729 ( 6.754 0.000 13.436) 15.038 6.879 ( -21.795 0.000 26.256) 34.124 7.272 ( -6.249 0.000 10.972) 12.627 8.104 ( 14.434 0.000 -12.672) 19.208 8.255 ( 2.708 0.000 -4.288) 5.071 8.357 ( 11.177 0.000 -8.871) 14.270 8.594 ( -2.972 0.000 -2.522) 3.898 8.926 ( -0.690 0.000 2.978) 3.057 9.172 ( 0.610 0.000 -18.980) 18.990 9.274 ( 3.336 0.000 -14.106) 14.495 9.660 ( 14.128 0.000 -5.665) 15.222 9.724 ( 2.476 0.000 -2.473) 3.500 10.154 ( 0.712 0.000 10.840) 10.863 10.551 ( -3.469 0.000 -2.541) 4.300 10.739 ( -1.505 0.000 -6.836) 6.999 10.964 ( 4.032 0.000 -0.253) 4.040 10.964 ( 8.495 0.000 -3.163) 9.065 11.229 ( 9.696 0.000 -0.052) 9.696 11.509 ( 4.857 0.000 -1.484) 5.079 11.582 ( 17.173 0.000 11.914) 20.901 11.827 ( -0.596 0.000 -0.118) 0.607 12.273 ( 1.080 0.000 2.397) 2.629 13.124 ( -5.856 0.000 3.588) 6.868 13.133 ( 1.012 0.000 -0.935) 1.378 13.493 ( 2.469 0.000 6.506) 6.959 13.892 ( -7.350 0.000 3.869) 8.306 13.962 ( 7.645 0.000 -2.059) 7.917 14.295 ( -1.360 0.000 -5.837) 5.994 14.460 ( -2.224 0.000 -3.609) 4.240 14.701 ( -10.459 0.000 -5.858) 11.988 ======================= Grid point 289 (141/260) ======================= q-point: ( 0.00 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.527 ( 20.605 20.917 31.395) 42.985 3.137 ( -9.459 31.177 36.346) 48.811 4.481 ( -8.548 11.151 -14.601) 20.263 4.986 ( -13.055 17.743 60.893) 64.755 5.335 ( 1.775 15.233 -5.678) 16.354 6.495 ( -12.642 0.750 14.227) 19.047 6.742 ( -4.395 -3.573 17.011) 17.929 6.914 ( -8.817 2.136 21.604) 23.431 7.204 ( -1.256 -8.187 11.704) 14.338 8.037 ( 1.730 -14.693 -10.957) 18.410 8.244 ( 7.913 2.670 -13.433) 15.817 8.511 ( 1.625 2.548 -7.935) 8.491 8.588 ( -1.525 0.611 2.343) 2.862 8.780 ( 2.186 -7.125 -12.637) 14.671 8.930 ( 3.122 -4.765 -7.014) 9.037 9.339 ( 0.986 5.607 -16.232) 17.202 9.627 ( 6.676 -10.684 2.094) 12.771 9.855 ( 3.756 -4.623 5.838) 8.340 10.179 ( -4.061 0.300 4.068) 5.756 10.484 ( 1.040 1.598 -3.176) 3.704 10.626 ( -6.951 2.458 -8.495) 11.248 10.950 ( 1.684 -3.314 0.925) 3.831 11.062 ( 2.601 0.302 0.447) 2.656 11.349 ( 7.718 -1.301 -4.531) 9.044 11.614 ( 3.834 0.893 0.059) 3.938 11.628 ( -3.290 0.369 2.310) 4.037 12.093 ( 14.544 -7.602 4.151) 16.927 12.346 ( 4.821 1.774 -1.647) 5.394 13.060 ( -4.673 0.988 2.865) 5.570 13.215 ( 3.873 3.670 -0.607) 5.370 13.607 ( 2.719 0.835 5.875) 6.527 13.856 ( -4.759 3.771 4.020) 7.282 14.079 ( 4.397 0.088 -2.304) 4.965 14.189 ( -2.432 -1.252 -5.429) 6.079 14.417 ( -0.550 -0.227 -3.119) 3.176 14.444 ( -9.149 0.542 -2.921) 9.619 ======================= Grid point 290 (142/260) ======================= q-point: ( 0.10 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.315 ( 18.350 19.259 30.581) 40.532 3.456 ( 26.773 25.587 30.894) 48.228 4.390 ( 14.178 11.002 -18.561) 25.818 5.225 ( 0.895 15.359 17.692) 23.446 5.474 ( 0.535 13.826 36.555) 39.086 6.343 ( -16.010 0.526 13.679) 21.065 6.631 ( -19.071 13.686 17.974) 29.565 7.089 ( 5.282 -13.646 16.985) 22.419 7.329 ( 3.284 -9.120 13.817) 16.877 7.966 ( 1.628 -14.737 -13.144) 19.814 8.222 ( 1.388 2.657 -12.779) 13.126 8.288 ( -9.306 -4.930 -13.847) 17.397 8.629 ( 0.212 4.040 3.654) 5.452 8.781 ( 5.756 -4.936 -13.191) 15.215 8.961 ( 5.183 1.679 -2.989) 6.214 9.197 ( -0.723 -0.119 -16.235) 16.251 9.731 ( -1.327 -3.925 8.775) 9.704 9.917 ( -3.659 -5.521 0.429) 6.638 10.145 ( 3.637 -1.332 -1.023) 4.006 10.385 ( -9.993 2.127 -9.665) 14.064 10.498 ( -0.001 3.328 0.764) 3.414 10.965 ( 0.442 -0.416 -0.391) 0.722 11.138 ( 3.175 -3.162 2.274) 5.025 11.368 ( -1.028 1.222 -5.395) 5.627 11.589 ( 1.309 -0.193 0.226) 1.342 11.723 ( 5.575 1.307 -0.127) 5.727 12.133 ( -6.234 -3.377 -1.005) 7.160 12.505 ( 9.383 -2.692 -4.922) 10.932 13.013 ( -2.384 0.203 2.048) 3.150 13.305 ( 5.729 2.570 0.405) 6.292 13.687 ( 0.177 0.283 5.434) 5.444 13.823 ( -2.901 2.210 3.896) 5.337 14.028 ( -4.083 -2.195 -6.242) 7.776 14.170 ( 2.084 0.993 -0.688) 2.409 14.261 ( -5.123 2.456 -1.464) 5.867 14.475 ( 5.305 -0.352 -0.241) 5.322 ======================= Grid point 291 (143/260) ======================= q-point: ( 0.20 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.771 ( 11.511 23.559 30.594) 40.293 4.374 ( 32.573 11.970 29.524) 45.563 4.657 ( 30.318 8.655 -18.451) 36.531 5.373 ( 6.515 11.667 3.253) 13.753 5.845 ( 3.634 11.829 31.068) 33.442 6.215 ( -8.658 5.162 20.419) 22.772 6.395 ( -20.936 13.280 16.180) 29.605 7.340 ( 8.189 -11.407 12.169) 18.582 7.536 ( 5.384 -14.126 14.435) 20.902 7.871 ( 0.078 -13.151 -13.675) 18.972 8.007 ( -7.710 -5.615 -10.255) 14.005 8.114 ( -3.270 3.000 -10.479) 11.380 8.623 ( 1.682 2.432 -8.503) 9.002 8.777 ( 0.630 -0.567 -2.026) 2.196 8.926 ( -7.958 0.584 -0.982) 8.039 9.154 ( 10.316 -0.227 -13.493) 16.987 9.619 ( -12.966 5.842 -2.446) 14.430 9.893 ( 0.945 -7.439 3.668) 8.348 10.013 ( -14.170 0.938 -11.682) 18.389 10.302 ( 2.319 -4.813 1.508) 5.552 10.502 ( 0.793 4.867 2.042) 5.337 10.969 ( 0.906 0.524 -1.826) 2.105 11.156 ( -2.605 -3.676 -1.783) 4.845 11.307 ( -0.408 2.034 -3.015) 3.659 11.619 ( 2.478 -1.936 -4.000) 5.088 11.821 ( 5.069 1.174 0.593) 5.237 11.966 ( -7.996 -1.654 -4.509) 9.328 12.535 ( -0.177 -1.054 -6.082) 6.175 13.006 ( -0.002 -0.994 1.020) 1.424 13.417 ( 5.476 0.867 0.839) 5.607 13.663 ( -6.638 -0.159 2.968) 7.273 13.839 ( 1.054 1.117 3.712) 4.017 13.897 ( -4.142 -1.421 -4.468) 6.257 14.208 ( 2.079 2.170 -3.571) 4.667 14.242 ( 2.712 2.119 4.107) 5.358 14.586 ( 5.520 -0.921 1.760) 5.867 ======================= Grid point 292 (144/260) ======================= q-point: ( 0.30 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.257 ( 14.653 19.866 27.173) 36.711 4.929 ( -6.446 7.207 36.953) 38.198 5.089 ( 28.091 6.531 -13.501) 31.844 5.509 ( 1.175 7.144 14.686) 16.373 6.025 ( 3.299 10.528 -2.837) 11.392 6.046 ( -8.856 10.747 -1.115) 13.971 6.685 ( 21.094 8.104 35.272) 41.890 7.514 ( 2.665 -6.423 0.659) 6.985 7.660 ( -4.801 -12.545 -6.738) 15.028 7.805 ( 5.997 -12.224 1.980) 13.759 7.873 ( -1.461 -3.268 -3.783) 5.208 8.014 ( 0.087 -2.581 4.643) 5.313 8.581 ( 2.683 -1.313 -10.662) 11.073 8.655 ( -9.638 -2.172 -3.810) 10.589 8.861 ( -1.979 8.836 5.863) 10.787 9.215 ( 0.701 -2.488 -4.860) 5.504 9.323 ( -9.089 7.644 -12.295) 17.093 9.623 ( -15.344 1.443 -13.530) 20.508 9.930 ( -2.014 -4.881 4.032) 6.643 10.282 ( -0.479 -1.489 -3.988) 4.284 10.596 ( 4.243 1.402 5.156) 6.823 10.958 ( -0.098 0.514 -3.223) 3.266 11.049 ( -4.403 -2.425 -6.162) 7.952 11.246 ( -3.638 1.472 -6.221) 7.355 11.601 ( 0.579 -4.020 -6.190) 7.403 11.816 ( -3.296 -0.195 -4.793) 5.820 11.916 ( 4.172 1.096 1.394) 4.533 12.434 ( -4.635 -0.553 -5.581) 7.276 13.025 ( 1.277 -1.022 0.700) 1.779 13.485 ( -1.320 -1.856 1.760) 2.878 13.563 ( -2.963 1.256 -0.938) 3.352 13.769 ( -2.598 -1.937 -4.808) 5.799 13.944 ( 3.146 1.901 5.997) 7.034 14.226 ( 2.386 1.303 -1.433) 3.073 14.353 ( 4.537 2.457 4.831) 7.069 14.690 ( 3.642 -1.091 2.406) 4.500 ======================= Grid point 293 (145/260) ======================= q-point: (-0.60 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.725 ( 2.906 11.672 27.994) 30.469 4.825 ( -19.795 8.199 27.114) 34.557 5.302 ( -12.244 12.681 8.581) 19.606 5.604 ( -3.487 4.961 14.589) 15.799 5.870 ( 6.950 4.424 -5.197) 9.741 6.306 ( 22.718 7.078 -11.439) 26.402 7.255 ( -2.088 -3.372 4.746) 6.185 7.427 ( -2.577 2.093 2.778) 4.329 7.555 ( 5.371 -2.738 0.253) 6.034 7.848 ( 10.905 2.396 -0.475) 11.175 8.023 ( 8.656 -5.019 5.509) 11.422 8.168 ( 3.773 -14.670 9.953) 18.125 8.430 ( -8.714 1.107 -1.041) 8.846 8.584 ( 3.966 -7.334 -8.364) 11.810 8.825 ( -10.658 11.116 3.566) 15.807 8.929 ( -16.335 1.813 0.100) 16.436 9.284 ( 2.983 3.148 -17.946) 18.463 9.296 ( -1.926 0.502 -6.765) 7.052 9.882 ( -2.423 -0.815 -2.122) 3.323 10.304 ( 5.395 -2.408 -2.024) 6.245 10.689 ( 2.242 1.070 0.927) 2.651 10.888 ( -5.614 -1.585 -6.233) 8.537 10.918 ( -0.995 -1.111 -7.357) 7.507 11.077 ( -5.616 3.016 -11.277) 12.954 11.555 ( -0.345 -5.285 -4.820) 7.161 11.752 ( -0.763 0.893 -3.637) 3.822 11.992 ( 2.711 1.015 1.450) 3.238 12.299 ( -5.025 -1.084 -4.282) 6.691 13.065 ( 2.246 -0.900 1.179) 2.692 13.414 ( -5.752 -0.511 2.522) 6.301 13.512 ( -2.668 -1.218 -3.813) 4.811 13.733 ( 2.415 -0.617 -4.334) 5.000 14.051 ( 2.684 1.419 6.102) 6.816 14.267 ( 2.387 0.563 0.469) 2.497 14.478 ( 4.328 2.236 5.512) 7.356 14.752 ( 0.929 -0.796 2.045) 2.383 ======================= Grid point 294 (146/260) ======================= q-point: (-0.50 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.418 ( -35.860 3.333 28.846) 46.143 4.880 ( -36.989 10.161 14.914) 41.157 5.192 ( 11.985 13.818 20.699) 27.623 5.677 ( -8.575 9.667 19.834) 23.672 5.987 ( 12.270 0.041 -15.562) 19.817 6.603 ( 10.257 5.204 -3.723) 12.089 6.909 ( -14.177 -1.494 -6.206) 15.548 7.396 ( -10.870 -0.054 9.906) 14.707 7.612 ( -1.727 2.339 1.628) 3.333 8.109 ( -7.495 -5.491 -0.611) 9.311 8.145 ( -1.058 -5.017 2.684) 5.787 8.330 ( 3.832 -0.312 0.731) 3.914 8.377 ( 13.571 3.596 2.904) 14.336 8.520 ( -7.771 4.627 3.100) 9.561 8.662 ( 10.084 -8.164 -7.595) 15.034 8.822 ( 0.266 -3.543 2.940) 4.611 9.160 ( 3.533 1.742 -12.151) 12.773 9.399 ( 9.900 3.475 -1.831) 10.651 9.852 ( 1.357 1.028 -2.370) 2.919 10.403 ( 6.938 -4.705 -4.530) 9.529 10.644 ( -2.459 1.742 -11.109) 11.511 10.726 ( -4.818 -1.855 -6.774) 8.517 10.868 ( 0.395 0.076 -5.940) 5.953 10.907 ( -1.379 3.872 -8.668) 9.593 11.507 ( -1.970 -4.910 -1.807) 5.590 11.704 ( -1.665 1.226 -3.313) 3.905 12.034 ( 0.477 -0.054 1.292) 1.378 12.199 ( -2.382 -0.454 -2.480) 3.468 13.125 ( 2.751 -0.920 2.107) 3.585 13.344 ( -4.394 0.076 2.900) 5.265 13.414 ( -3.916 -0.904 -3.630) 5.416 13.750 ( 3.596 -0.337 -5.606) 6.669 14.134 ( 0.671 1.375 5.875) 6.071 14.315 ( 1.985 -0.392 0.964) 2.241 14.602 ( 4.044 1.260 5.741) 7.135 14.759 ( -1.487 -0.069 1.133) 1.871 ======================= Grid point 295 (147/260) ======================= q-point: (-0.40 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.993 ( -36.310 5.879 27.045) 45.655 4.280 ( -42.510 6.663 17.482) 46.445 5.470 ( -11.968 10.904 21.595) 26.990 5.600 ( -9.529 18.551 21.277) 29.793 6.070 ( 10.295 -5.298 -11.457) 16.288 6.304 ( -23.438 12.272 -0.948) 26.473 7.007 ( 8.143 -9.209 2.592) 12.563 7.271 ( -11.707 -1.267 12.058) 16.854 7.501 ( -11.358 7.251 -0.938) 13.508 7.779 ( -16.777 6.462 2.486) 18.149 8.169 ( 1.928 -6.042 -5.384) 8.320 8.253 ( -5.912 -0.189 -5.001) 7.745 8.425 ( 8.061 -2.990 1.663) 8.757 8.777 ( 8.042 1.058 0.236) 8.115 8.820 ( 12.510 -10.751 -7.654) 18.184 8.995 ( 11.882 -5.855 6.315) 14.675 9.198 ( 10.817 2.049 -9.874) 14.788 9.596 ( 11.693 3.080 -0.293) 12.096 9.879 ( 1.604 1.297 1.347) 2.463 10.385 ( 0.542 -3.007 -15.225) 15.528 10.560 ( -0.715 -5.788 -3.536) 6.820 10.613 ( 3.826 3.130 -12.417) 13.365 10.804 ( 1.368 4.439 -4.072) 6.177 10.917 ( 4.470 0.708 -3.894) 5.970 11.454 ( -3.365 -3.669 0.994) 5.077 11.633 ( -3.063 1.276 -3.056) 4.511 12.025 ( -2.444 -2.988 1.127) 4.021 12.177 ( 1.254 2.851 -1.048) 3.286 13.195 ( 2.212 -1.001 3.053) 3.901 13.292 ( -3.456 -0.311 0.200) 3.476 13.329 ( -2.945 1.066 0.368) 3.153 13.769 ( 3.985 0.161 -6.193) 7.366 14.166 ( -2.509 1.984 5.324) 6.211 14.350 ( 1.384 -1.151 -0.251) 1.818 14.693 ( -1.143 -1.080 2.006) 2.549 14.749 ( 1.989 1.162 2.915) 3.715 ======================= Grid point 296 (148/260) ======================= q-point: (-0.30 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.469 ( -44.121 7.864 17.017) 47.938 3.713 ( -38.300 8.293 30.753) 49.814 5.123 ( -40.273 24.964 36.660) 59.909 5.667 ( -8.557 7.948 9.528) 15.073 5.959 ( -11.494 15.451 -2.145) 19.377 6.197 ( 7.858 -7.430 -0.222) 10.817 6.867 ( -23.653 -1.693 5.779) 24.408 7.193 ( -9.321 -3.464 12.454) 15.937 7.302 ( -11.637 1.285 11.881) 16.680 7.755 ( 12.908 8.829 -7.510) 17.348 8.132 ( 0.191 -5.798 -5.514) 8.004 8.193 ( 3.628 0.103 -5.437) 6.537 8.588 ( 5.924 -5.197 3.875) 8.782 8.818 ( 1.805 -2.146 -5.116) 5.835 9.005 ( 12.310 -10.395 -5.712) 17.095 9.169 ( 4.359 -8.956 -1.762) 10.116 9.364 ( 14.220 3.106 -8.257) 16.734 9.771 ( 8.346 3.324 -5.384) 10.474 9.920 ( 0.012 0.463 5.367) 5.387 10.317 ( 5.546 -3.038 -8.688) 10.746 10.523 ( 2.490 -2.457 -4.254) 5.508 10.660 ( 8.255 -0.401 -5.347) 9.844 10.858 ( 5.195 2.892 -1.309) 6.088 10.975 ( 5.692 1.567 -4.733) 7.567 11.403 ( -4.020 -2.055 3.058) 5.453 11.548 ( -3.097 1.538 -2.843) 4.476 11.976 ( -3.776 -3.316 1.036) 5.131 12.211 ( 2.759 4.072 -0.236) 4.924 13.209 ( -3.087 -1.099 -0.279) 3.289 13.247 ( -0.989 1.784 0.962) 2.255 13.331 ( 0.618 0.879 4.917) 5.033 13.801 ( 5.176 0.868 -5.535) 7.627 14.132 ( -5.633 2.957 4.537) 7.814 14.358 ( 0.722 -1.457 -2.457) 2.946 14.633 ( -4.057 -0.028 -0.821) 4.139 14.831 ( 2.503 -1.668 1.568) 3.392 ======================= Grid point 297 (149/260) ======================= q-point: (-0.20 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.757 ( -46.888 10.869 20.259) 52.221 3.353 ( -32.053 18.549 34.495) 50.610 4.792 ( -34.153 25.481 51.573) 66.899 5.414 ( -21.019 6.352 -1.165) 21.989 5.707 ( -14.787 18.589 -5.849) 24.463 6.352 ( 6.424 -10.549 6.951) 14.173 6.600 ( -9.856 2.225 9.764) 14.051 7.119 ( -14.590 4.359 21.317) 26.197 7.212 ( -9.427 -6.576 12.082) 16.676 7.958 ( 14.786 3.958 -10.004) 18.286 8.121 ( 4.300 -7.437 -7.151) 11.177 8.264 ( 7.906 1.774 -3.274) 8.739 8.657 ( -0.425 -2.882 -0.788) 3.018 8.834 ( 4.398 -2.799 -1.868) 5.538 9.100 ( -1.231 -9.860 -5.554) 11.383 9.213 ( 11.592 -11.919 -9.869) 19.335 9.521 ( 9.535 4.119 -10.076) 14.471 9.782 ( 1.871 2.169 -9.644) 10.061 10.008 ( 2.599 -1.391 9.372) 9.824 10.446 ( 7.527 -8.183 1.152) 11.178 10.625 ( 12.989 -0.818 -0.100) 13.015 10.786 ( 6.454 1.902 -1.708) 6.942 10.928 ( 4.040 0.837 -1.412) 4.360 11.055 ( 7.656 1.438 -3.866) 8.696 11.367 ( -3.177 -1.061 5.935) 6.815 11.501 ( 1.406 2.218 -2.548) 3.659 11.904 ( -4.835 -1.531 0.717) 5.122 12.266 ( 2.873 3.425 0.583) 4.509 13.153 ( -2.194 -0.251 -0.587) 2.285 13.222 ( -2.962 3.234 2.001) 4.821 13.407 ( 2.376 0.567 5.608) 6.117 13.870 ( 6.767 1.375 -3.974) 7.967 14.044 ( -7.456 3.854 3.820) 9.222 14.335 ( -0.015 -1.472 -4.619) 4.848 14.546 ( -4.010 0.121 -2.088) 4.522 14.828 ( -2.712 -3.142 -3.120) 5.193 ======================= Grid point 298 (150/260) ======================= q-point: (-0.10 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.275 ( -23.004 19.570 29.787) 42.420 3.135 ( -23.137 27.496 35.950) 50.830 4.748 ( -22.605 18.324 55.233) 62.429 4.935 ( -24.152 12.266 -2.246) 27.181 5.440 ( -5.874 16.573 -9.597) 20.032 6.545 ( 1.482 -1.916 11.917) 12.161 6.573 ( -3.123 -8.419 14.724) 17.247 7.009 ( -17.835 9.556 23.864) 31.287 7.172 ( -5.265 -8.657 10.692) 14.730 8.068 ( 4.187 -9.611 -6.886) 12.542 8.174 ( 10.989 0.178 -13.435) 17.358 8.404 ( 9.539 3.135 -2.799) 10.424 8.618 ( -0.398 1.392 -3.471) 3.761 8.902 ( 0.780 -3.352 1.793) 3.881 8.955 ( -2.330 -13.202 -15.305) 20.346 9.365 ( 10.251 -2.970 -8.380) 13.569 9.533 ( 4.748 -1.368 -11.678) 12.680 9.772 ( 2.664 -1.664 -0.871) 3.259 10.135 ( 1.390 -1.287 9.998) 10.176 10.506 ( 0.291 -3.391 -1.444) 3.697 10.777 ( -2.328 3.206 -5.818) 7.039 10.871 ( 8.127 -4.880 -2.060) 9.701 11.019 ( 4.530 1.406 -0.771) 4.806 11.210 ( 9.902 -1.374 -1.480) 10.106 11.474 ( 8.367 -3.531 6.756) 11.319 11.585 ( 8.793 0.665 3.410) 9.455 11.832 ( -0.923 1.045 1.016) 1.725 12.314 ( 1.546 2.378 0.711) 2.924 13.115 ( -3.179 -0.181 2.104) 3.816 13.188 ( -0.690 4.584 -0.215) 4.641 13.504 ( 2.867 0.851 5.968) 6.676 13.934 ( -6.427 3.948 3.270) 8.221 13.980 ( 6.643 1.565 -1.948) 7.098 14.279 ( -1.381 -1.503 -5.926) 6.267 14.461 ( -2.460 0.046 -3.244) 4.072 14.676 ( -9.475 -2.302 -5.147) 11.026 ======================= Grid point 299 (151/260) ======================= q-point: ( 0.00 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.082 ( 16.439 31.986 25.829) 44.277 3.856 ( -4.420 36.202 31.648) 48.288 4.801 ( -7.227 19.801 -13.923) 25.262 5.521 ( -11.525 33.865 48.722) 60.444 5.757 ( 0.386 25.081 -6.142) 25.825 6.361 ( -0.245 -19.778 16.393) 25.690 6.629 ( -7.090 3.872 12.189) 14.623 6.929 ( -1.944 -12.241 11.178) 16.690 7.191 ( -13.268 12.669 20.210) 27.295 7.691 ( -0.259 -18.016 -11.071) 21.147 8.301 ( 5.209 1.918 -10.122) 11.544 8.424 ( -9.725 -9.383 -10.991) 17.419 8.580 ( 3.409 -3.973 -0.621) 5.272 8.651 ( 6.895 -4.983 -9.033) 12.408 8.865 ( 6.244 -1.066 -0.159) 6.337 9.368 ( -2.831 -7.560 -10.669) 13.379 9.416 ( 7.538 -5.052 -2.141) 9.323 9.730 ( 1.630 -7.407 9.547) 12.193 10.178 ( -0.145 0.430 0.230) 0.509 10.537 ( 2.737 3.671 -0.005) 4.579 10.669 ( -5.823 0.719 -8.576) 10.391 10.889 ( 1.886 -1.775 2.627) 3.689 11.073 ( 1.344 0.710 -0.937) 1.785 11.321 ( 9.003 -1.450 -6.129) 10.987 11.591 ( 5.521 -4.114 5.627) 8.892 11.630 ( -0.558 0.297 1.023) 1.203 11.991 ( 8.303 -1.677 3.370) 9.116 12.334 ( 1.948 -2.550 -1.950) 3.754 13.093 ( -3.109 2.227 2.682) 4.671 13.304 ( 1.998 4.282 -0.860) 4.803 13.623 ( 3.183 0.740 3.687) 4.927 13.960 ( -5.654 5.994 2.910) 8.739 14.051 ( 0.821 -3.236 -4.407) 5.528 14.187 ( -0.056 1.806 -2.433) 3.031 14.411 ( -0.585 -0.542 -2.648) 2.766 14.444 ( -5.663 -0.599 -3.800) 6.846 ======================= Grid point 300 (152/260) ======================= q-point: ( 0.10 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.743 ( 27.980 23.781 23.904) 43.816 4.140 ( 8.864 36.102 29.751) 47.614 4.707 ( 11.646 19.677 -17.475) 28.778 5.668 ( -0.612 27.092 8.296) 28.340 5.890 ( 1.193 26.796 35.271) 44.311 6.385 ( -8.528 -0.147 9.755) 12.958 6.694 ( 1.658 -12.792 15.947) 20.511 6.974 ( -9.588 3.629 16.829) 19.706 7.147 ( -5.144 -0.492 15.989) 16.803 7.601 ( 2.283 -20.476 -14.094) 24.963 8.106 ( -12.109 -11.719 -10.404) 19.804 8.286 ( 0.526 3.134 -10.304) 10.783 8.578 ( 3.015 -10.297 -10.445) 14.974 8.742 ( 4.389 0.245 1.736) 4.726 8.976 ( 3.980 -0.190 -0.909) 4.087 9.167 ( -2.140 -2.929 -14.363) 14.813 9.577 ( 4.667 -9.149 6.729) 12.279 9.847 ( 0.645 -4.333 8.919) 9.937 10.113 ( -1.107 0.083 -9.216) 9.282 10.434 ( -9.209 2.330 -10.708) 14.314 10.591 ( 0.185 5.804 3.461) 6.761 10.950 ( 1.526 -1.048 3.085) 3.597 11.089 ( 1.251 -1.140 -0.763) 1.857 11.372 ( 2.643 -0.967 -8.252) 8.719 11.592 ( -1.107 0.312 1.578) 1.953 11.733 ( 5.179 -0.675 1.502) 5.434 12.061 ( -3.447 -2.997 -0.151) 4.570 12.411 ( 7.518 -6.229 -3.168) 10.264 13.050 ( -3.330 3.425 1.903) 5.142 13.357 ( 3.685 2.019 0.271) 4.210 13.685 ( -0.264 -0.582 3.275) 3.337 13.890 ( -3.786 2.882 0.702) 4.810 13.965 ( -3.901 -2.449 -4.124) 6.183 14.218 ( 2.764 3.467 1.502) 4.681 14.305 ( -3.255 1.597 -3.223) 4.851 14.463 ( 4.777 -0.910 -0.797) 4.927 ======================= Grid point 301 (153/260) ======================= q-point: ( 0.20 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.316 ( 13.724 27.008 24.281) 38.825 4.717 ( 21.775 20.945 28.503) 41.536 4.916 ( 26.299 16.643 -17.308) 35.612 5.697 ( -2.779 19.485 5.443) 20.421 6.180 ( 6.922 18.246 -0.029) 19.515 6.425 ( 0.853 16.712 36.493) 40.146 6.704 ( -20.122 13.627 12.804) 27.469 7.019 ( 6.774 -15.507 16.906) 23.920 7.267 ( 2.453 -12.163 11.571) 16.966 7.542 ( 3.642 -18.211 -13.173) 22.769 7.834 ( -8.802 -10.543 -5.421) 14.766 8.174 ( -3.944 2.492 -8.570) 9.757 8.531 ( 2.138 -9.858 -11.800) 15.524 8.754 ( -5.202 -3.679 -2.680) 6.913 8.971 ( 0.721 2.832 2.282) 3.708 9.134 ( 4.567 -2.109 -6.614) 8.310 9.706 ( 1.946 -7.069 9.278) 11.825 9.782 ( -6.229 6.379 -10.268) 13.599 10.020 ( -8.726 -1.121 -8.179) 12.013 10.222 ( -1.422 -2.462 -1.505) 3.217 10.614 ( -0.067 6.483 1.602) 6.679 10.980 ( 0.102 0.427 0.399) 0.594 11.083 ( -1.267 -3.029 -2.493) 4.123 11.321 ( 0.401 -0.922 -7.456) 7.524 11.586 ( -0.651 -1.073 -1.913) 2.288 11.831 ( 4.525 -0.539 0.935) 4.652 11.938 ( -6.198 -0.696 -3.744) 7.274 12.466 ( 1.363 -6.042 -4.983) 7.949 13.017 ( -1.492 2.508 1.314) 3.200 13.424 ( 2.447 -0.378 1.318) 2.805 13.653 ( -4.565 -0.974 0.915) 4.757 13.800 ( -3.831 -4.727 -5.060) 7.914 13.931 ( 0.996 4.779 2.997) 5.728 14.256 ( 0.448 2.201 -2.815) 3.601 14.305 ( 3.912 3.970 4.093) 6.916 14.562 ( 5.260 -1.422 1.380) 5.620 ======================= Grid point 302 (154/260) ======================= q-point: ( 0.30 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.743 ( 11.070 25.415 23.988) 36.659 5.142 ( -5.258 13.465 27.039) 30.660 5.283 ( 24.468 12.516 -13.784) 30.746 5.723 ( 1.483 13.590 13.469) 19.191 6.279 ( 12.012 11.966 -16.382) 23.577 6.318 ( -23.183 14.747 4.373) 27.822 6.940 ( 15.755 16.332 32.126) 39.332 7.320 ( 9.354 -14.575 7.994) 19.075 7.362 ( 0.171 -11.881 6.901) 13.741 7.533 ( 6.473 -12.577 -4.158) 14.744 7.758 ( 2.052 -6.643 3.836) 7.941 8.019 ( -5.946 1.475 -4.309) 7.490 8.461 ( 0.219 -9.201 -9.826) 13.463 8.586 ( -7.666 -4.542 -4.381) 9.929 9.042 ( 0.929 6.703 5.951) 9.011 9.136 ( -1.272 -5.487 -1.818) 5.919 9.518 ( -11.332 10.390 -10.985) 18.896 9.670 ( -12.017 2.797 -14.891) 19.339 9.821 ( 1.094 -4.116 4.769) 6.395 10.253 ( 2.052 -1.821 -1.709) 3.232 10.639 ( 1.507 3.021 2.946) 4.481 10.964 ( -1.143 -0.271 -2.420) 2.690 10.995 ( -3.839 -2.199 -5.971) 7.431 11.259 ( -0.846 -0.873 -8.679) 8.764 11.520 ( -2.838 -3.021 -4.826) 6.362 11.817 ( -1.727 0.398 -5.279) 5.569 11.922 ( 3.434 -0.736 2.184) 4.136 12.386 ( -4.345 -4.704 -5.746) 8.603 13.020 ( 0.584 1.016 1.059) 1.580 13.445 ( -2.325 -2.121 2.483) 4.009 13.567 ( -3.275 -1.192 -3.512) 4.948 13.711 ( -1.125 -3.660 -3.422) 5.135 14.005 ( 3.161 4.121 3.881) 6.484 14.260 ( 1.502 1.813 -1.147) 2.619 14.421 ( 4.225 4.025 5.264) 7.859 14.664 ( 3.800 -1.378 2.567) 4.789 ======================= Grid point 303 (155/260) ======================= q-point: (-0.60 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.914 ( -26.435 10.847 27.597) 39.725 5.207 ( 9.092 23.706 17.524) 30.850 5.578 ( 7.844 12.485 -6.941) 16.297 5.721 ( -13.660 7.237 1.680) 15.550 6.063 ( -3.596 14.111 16.186) 21.773 6.413 ( 15.887 0.885 -18.023) 24.042 7.180 ( -8.092 -2.774 1.946) 8.773 7.442 ( 4.002 -2.873 2.745) 5.639 7.525 ( 5.516 0.174 10.336) 11.717 7.795 ( 15.068 -10.041 8.406) 19.963 7.932 ( -2.310 -7.351 7.371) 10.663 7.991 ( 19.184 6.692 4.409) 20.790 8.382 ( -1.267 -10.664 -6.148) 12.374 8.438 ( -4.548 -1.556 -2.128) 5.257 8.957 ( -16.338 2.323 -2.355) 16.669 9.050 ( -8.291 8.378 3.440) 12.278 9.276 ( -5.560 -1.980 -2.206) 6.301 9.405 ( 0.675 8.176 -18.145) 19.914 9.859 ( 0.731 -0.934 0.717) 1.386 10.275 ( 4.980 -0.240 -6.187) 7.946 10.708 ( 1.770 0.183 4.281) 4.636 10.834 ( -5.403 -2.560 -10.042) 11.687 10.918 ( -1.683 0.577 -3.935) 4.319 11.128 ( -3.252 1.427 -12.324) 12.825 11.439 ( -1.453 -5.162 -4.043) 6.716 11.768 ( -0.003 0.575 -4.458) 4.495 11.992 ( 2.101 -1.384 1.675) 3.023 12.246 ( -5.145 -4.529 -4.722) 8.324 13.053 ( 1.993 0.122 1.184) 2.322 13.397 ( -4.677 -1.265 2.993) 5.695 13.475 ( -2.693 -2.379 -5.213) 6.332 13.702 ( 2.512 -2.614 -3.416) 4.981 14.096 ( 3.010 3.055 3.871) 5.777 14.284 ( 1.481 1.005 -0.075) 1.791 14.539 ( 3.299 3.578 6.146) 7.839 14.735 ( 1.421 -0.716 2.778) 3.201 ======================= Grid point 304 (156/260) ======================= q-point: (-0.50 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.569 ( -32.053 11.668 24.755) 42.147 5.109 ( -35.688 11.739 5.732) 38.004 5.550 ( 7.815 19.956 17.349) 27.574 5.827 ( 11.974 1.359 -10.612) 16.057 6.117 ( -5.848 15.317 12.029) 20.335 6.589 ( 13.499 -9.381 -6.571) 17.704 6.942 ( -16.110 6.983 -0.246) 17.561 7.450 ( -10.373 5.011 13.120) 17.460 7.659 ( 5.759 1.258 -0.214) 5.899 7.947 ( -1.608 -10.378 2.394) 10.771 8.025 ( 3.529 -6.194 1.867) 7.370 8.262 ( -4.576 -5.226 1.520) 7.110 8.425 ( 8.644 -11.130 0.928) 14.123 8.476 ( 3.432 6.400 2.789) 7.780 8.669 ( 0.646 6.949 -2.590) 7.445 8.879 ( -7.456 9.004 0.597) 11.706 9.195 ( 2.325 0.721 -9.070) 9.391 9.418 ( 6.707 -1.279 -0.906) 6.888 9.884 ( 2.616 1.954 -1.674) 3.670 10.325 ( 6.379 -2.535 -8.551) 10.965 10.635 ( -6.637 -2.041 -9.630) 11.873 10.737 ( -0.005 2.045 -3.654) 4.187 10.869 ( 1.479 0.586 -4.646) 4.910 10.975 ( -2.080 2.179 -9.956) 10.402 11.398 ( -0.868 -5.202 -1.400) 5.457 11.719 ( -1.064 0.178 -5.241) 5.351 12.007 ( -2.142 -2.818 1.248) 3.754 12.165 ( 0.320 -3.197 -2.116) 3.847 13.110 ( 2.850 -0.302 1.629) 3.297 13.339 ( -4.037 -0.843 2.260) 4.703 13.392 ( -1.894 -1.084 -3.874) 4.447 13.727 ( 3.724 -2.306 -4.702) 6.426 14.173 ( 1.813 2.443 3.685) 4.778 14.308 ( 1.183 -0.118 -0.065) 1.191 14.638 ( 1.541 2.191 6.283) 6.830 14.762 ( -0.669 0.412 2.408) 2.533 ======================= Grid point 305 (157/260) ======================= q-point: (-0.40 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.193 ( -31.743 13.734 24.264) 42.250 4.479 ( -39.052 12.881 9.870) 42.289 5.731 ( -1.557 12.084 10.430) 16.038 5.926 ( 2.757 -6.116 -2.285) 7.087 6.089 ( -7.539 26.768 16.409) 32.290 6.567 ( -17.211 1.816 1.980) 17.420 6.787 ( 4.659 -0.820 -4.937) 6.838 7.331 ( -18.243 6.580 19.070) 27.199 7.658 ( -6.157 6.759 0.490) 9.156 7.885 ( -3.517 1.030 -1.775) 4.072 8.012 ( -3.611 -6.379 0.469) 7.345 8.199 ( -1.001 -6.399 -1.960) 6.767 8.400 ( 0.518 1.957 -0.136) 2.029 8.589 ( 11.003 -11.794 -8.430) 18.199 8.716 ( 2.407 -3.983 -1.571) 4.912 8.998 ( 4.994 5.228 8.885) 11.455 9.238 ( 10.891 1.910 -9.195) 14.381 9.583 ( 9.406 -4.591 3.018) 10.893 9.924 ( 2.765 2.634 -0.465) 3.847 10.325 ( 2.790 -2.806 -13.745) 14.303 10.476 ( -2.752 -2.308 -4.156) 5.493 10.670 ( 2.192 2.132 -12.924) 13.281 10.875 ( 2.192 2.817 -2.735) 4.497 10.939 ( 3.738 1.154 -2.726) 4.768 11.377 ( -1.148 -3.620 0.534) 3.835 11.645 ( -2.014 -0.367 -5.326) 5.706 11.964 ( -3.112 -2.984 1.647) 4.615 12.194 ( 3.124 -1.465 -0.948) 3.578 13.174 ( 1.830 -1.121 1.793) 2.796 13.291 ( -1.405 0.060 -0.138) 1.413 13.347 ( -1.284 0.952 -0.110) 1.602 13.760 ( 4.730 -1.382 -5.539) 7.414 14.217 ( -0.474 2.860 3.411) 4.476 14.324 ( 1.027 -1.077 -1.099) 1.850 14.680 ( -2.256 0.020 3.822) 4.439 14.771 ( -0.120 0.963 3.076) 3.226 ======================= Grid point 306 (158/260) ======================= q-point: (-0.30 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.714 ( -39.422 16.116 13.362) 44.636 3.990 ( -29.390 18.732 28.720) 45.160 5.665 ( -19.648 22.873 18.489) 35.371 5.878 ( -3.941 -5.110 1.687) 6.670 6.051 ( -15.421 15.581 15.278) 26.720 6.368 ( -2.886 17.785 0.062) 18.018 6.757 ( -6.827 -8.757 -0.230) 11.106 7.078 ( -19.075 2.470 9.383) 21.401 7.501 ( -15.858 9.738 15.444) 24.183 7.899 ( 3.796 -1.151 -3.283) 5.149 7.961 ( 3.304 -2.976 -4.210) 6.123 8.214 ( 5.426 0.838 -4.303) 6.975 8.485 ( 5.877 -4.893 1.131) 7.730 8.663 ( 6.834 -9.456 -10.259) 15.536 8.807 ( 8.955 -10.370 -4.709) 14.488 9.052 ( -4.921 -2.291 6.422) 8.409 9.395 ( 11.868 -0.446 -5.584) 13.124 9.747 ( 5.665 -4.992 0.244) 7.554 9.964 ( 0.586 2.950 0.981) 3.164 10.248 ( 2.317 -3.440 -9.305) 10.188 10.470 ( 4.394 -1.795 -2.503) 5.366 10.673 ( 8.462 0.750 -7.104) 11.073 10.915 ( 3.434 2.819 -1.909) 4.836 11.006 ( 5.428 1.230 -2.848) 6.252 11.363 ( -1.523 -1.709 1.934) 2.997 11.567 ( -1.517 0.017 -4.707) 4.946 11.929 ( -2.474 -1.176 1.898) 3.333 12.246 ( 3.232 -0.805 -0.802) 3.426 13.175 ( -2.028 -1.939 0.271) 2.818 13.318 ( 3.291 4.605 -1.255) 5.797 13.336 ( -0.873 -0.293 3.982) 4.087 13.812 ( 6.116 -0.219 -5.404) 8.164 14.209 ( -3.410 4.311 3.093) 6.307 14.325 ( 0.770 -1.430 -2.803) 3.239 14.631 ( -4.545 -0.105 0.946) 4.644 14.793 ( -0.839 -1.809 2.116) 2.907 ======================= Grid point 307 (159/260) ======================= q-point: (-0.20 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.129 ( -35.506 24.804 17.941) 46.880 3.795 ( -21.633 24.403 33.640) 46.852 5.420 ( -24.319 30.090 24.845) 45.979 5.671 ( -21.384 19.056 6.995) 29.484 6.020 ( -0.609 -11.046 9.522) 14.597 6.213 ( -13.620 21.695 -3.386) 25.838 6.646 ( -4.508 -1.687 7.881) 9.234 6.927 ( -6.661 -7.700 7.579) 12.693 7.366 ( -15.529 9.508 20.380) 27.329 7.859 ( -1.403 -12.839 -4.731) 13.754 8.096 ( 11.897 5.069 -6.978) 14.694 8.315 ( 8.497 2.752 -2.862) 9.379 8.588 ( 4.776 -5.315 -1.280) 7.260 8.681 ( 4.698 -9.312 -10.264) 14.633 8.942 ( -0.084 -10.800 -1.117) 10.858 8.975 ( 4.246 -5.703 -1.949) 7.373 9.546 ( 7.124 -3.797 -1.329) 8.182 9.751 ( -1.130 -3.974 -10.299) 11.097 10.003 ( 1.895 0.968 7.036) 7.351 10.305 ( 6.726 -5.325 1.469) 8.703 10.592 ( 11.289 -1.888 -2.659) 11.750 10.831 ( 9.837 1.421 0.010) 9.939 10.934 ( 0.879 0.609 -3.098) 3.278 11.081 ( 6.097 0.822 -3.924) 7.297 11.349 ( -2.880 -0.493 4.789) 5.610 11.538 ( 3.038 1.025 -3.991) 5.120 11.899 ( -2.429 1.287 1.661) 3.212 12.294 ( 2.523 -0.882 -0.493) 2.717 13.139 ( -1.962 -0.897 0.599) 2.238 13.317 ( -0.928 4.765 0.190) 4.858 13.418 ( 3.968 1.031 3.420) 5.339 13.894 ( 7.233 0.414 -4.428) 8.491 14.147 ( -5.868 5.940 2.905) 8.841 14.303 ( 0.115 -1.243 -4.590) 4.757 14.544 ( -4.691 -0.350 -0.935) 4.796 14.753 ( -4.319 -3.881 -1.218) 5.933 ======================= Grid point 308 (160/260) ======================= q-point: (-0.10 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.833 ( -13.573 33.381 24.470) 43.558 3.752 ( -13.867 31.149 33.562) 47.843 5.144 ( -19.381 18.882 -2.329) 27.159 5.423 ( -20.226 34.472 37.870) 55.059 5.888 ( -8.004 25.778 -7.501) 28.015 6.201 ( 1.601 -20.128 15.473) 25.438 6.653 ( -5.033 3.576 10.686) 12.341 6.902 ( -4.252 -11.214 9.199) 15.114 7.268 ( -14.013 10.493 20.438) 26.910 7.784 ( -1.312 -15.293 -7.345) 17.016 8.234 ( 9.933 3.909 -8.515) 13.655 8.460 ( 8.572 1.398 -0.853) 8.727 8.615 ( 0.588 -3.729 -6.968) 7.925 8.661 ( 3.608 -12.191 -14.153) 19.025 8.823 ( -5.420 -5.272 3.875) 8.496 9.182 ( 13.517 -9.695 -1.496) 16.701 9.588 ( -3.077 -0.892 -15.805) 16.127 9.640 ( 1.599 -7.914 5.447) 9.739 10.116 ( 2.474 -0.617 7.433) 7.858 10.450 ( 5.732 -1.594 2.626) 6.504 10.766 ( 6.493 -4.720 -5.583) 9.778 10.859 ( -0.752 3.891 -3.715) 5.432 11.021 ( 5.606 -1.041 1.402) 5.871 11.186 ( 9.515 -0.962 -4.422) 10.536 11.396 ( 3.952 -3.247 9.425) 10.723 11.599 ( 4.659 0.345 -1.055) 4.790 11.880 ( 0.183 3.630 1.328) 3.870 12.325 ( 1.129 -1.476 -0.513) 1.928 13.116 ( -1.827 0.320 1.979) 2.712 13.299 ( -0.541 5.324 -0.524) 5.377 13.523 ( 4.161 1.246 3.639) 5.666 13.992 ( 6.201 0.035 -3.139) 6.950 14.056 ( -6.210 6.539 2.904) 9.474 14.249 ( -1.314 -0.725 -5.477) 5.679 14.457 ( -2.923 -0.602 -2.436) 3.852 14.617 ( -7.778 -3.233 -3.544) 9.139 ======================= Grid point 309 (161/260) ======================= q-point: ( 0.00 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.764 ( 10.597 34.289 22.177) 42.188 4.543 ( -1.548 31.401 29.526) 43.131 5.227 ( -4.870 18.625 -11.271) 22.307 5.871 ( 2.761 -18.104 17.999) 25.678 6.155 ( -1.735 4.756 26.465) 26.945 6.318 ( -3.803 30.341 -4.221) 30.868 6.703 ( -2.985 10.985 12.116) 16.625 6.815 ( -8.759 3.470 12.061) 15.305 7.233 ( 1.936 -9.543 -11.323) 14.934 7.529 ( -11.068 3.604 14.523) 18.612 8.189 ( -9.147 -8.231 -10.626) 16.258 8.324 ( -0.975 -16.502 -7.724) 18.246 8.397 ( 3.972 1.951 -3.335) 5.541 8.580 ( 2.492 -4.064 -0.224) 4.772 8.876 ( 7.594 1.183 -1.260) 7.788 9.167 ( -1.693 -9.705 -0.688) 9.876 9.324 ( 2.885 -5.287 0.594) 6.052 9.532 ( -0.578 -12.296 9.500) 15.550 10.234 ( 3.918 5.267 -3.845) 7.607 10.617 ( 4.372 -0.284 3.502) 5.609 10.644 ( -1.094 1.522 -9.091) 9.282 10.887 ( 0.170 0.461 0.713) 0.866 11.090 ( 2.820 0.994 -1.570) 3.377 11.282 ( 9.199 -2.853 -6.811) 11.796 11.502 ( 5.294 -2.950 8.878) 10.749 11.621 ( 0.156 -1.372 1.147) 1.795 12.011 ( 2.997 2.796 0.319) 4.111 12.262 ( 0.374 -4.225 -1.971) 4.677 13.150 ( -0.674 3.414 2.430) 4.245 13.356 ( -0.050 0.293 1.339) 1.372 13.650 ( 3.049 2.255 -1.076) 3.942 13.942 ( -0.858 -5.800 -6.563) 8.801 14.106 ( -5.757 6.902 2.302) 9.277 14.250 ( 1.039 3.751 -0.833) 3.980 14.389 ( -0.512 -1.743 -1.849) 2.592 14.421 ( -3.598 -1.556 -3.160) 5.035 ======================= Grid point 310 (162/260) ======================= q-point: ( 0.10 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.258 ( 21.533 26.318 21.059) 39.997 4.808 ( 4.235 28.628 27.683) 40.048 5.158 ( 9.165 23.660 -13.655) 28.814 6.109 ( 7.064 -19.065 15.683) 25.677 6.234 ( -2.524 24.944 -1.479) 25.115 6.409 ( 2.572 8.762 27.339) 28.824 6.649 ( -3.962 2.332 1.380) 4.800 6.916 ( 0.872 13.794 21.269) 25.365 7.179 ( 3.914 -17.631 -16.005) 24.131 7.428 ( -14.483 14.522 17.987) 27.280 7.879 ( -14.455 -7.891 -7.544) 18.114 8.254 ( 1.457 -15.087 -10.637) 18.517 8.372 ( -1.695 -0.600 -5.772) 6.046 8.680 ( 5.177 -7.266 2.280) 9.208 8.929 ( -1.202 -4.671 -3.801) 6.140 9.084 ( 0.851 -5.155 -6.138) 8.060 9.435 ( 3.433 -4.226 8.855) 10.395 9.671 ( 3.244 -11.660 14.769) 19.095 10.182 ( -0.368 5.704 -15.212) 16.251 10.459 ( -6.861 -0.301 -11.901) 13.740 10.728 ( 1.983 7.349 4.688) 8.940 10.931 ( 2.066 -0.580 3.210) 3.861 11.098 ( 0.323 1.929 -2.442) 3.129 11.332 ( 3.304 -2.857 -9.318) 10.291 11.592 ( -1.005 -0.429 2.829) 3.033 11.689 ( 4.748 -3.365 4.410) 7.301 12.034 ( -1.583 0.456 -1.224) 2.052 12.277 ( 3.700 -6.476 -2.591) 7.896 13.140 ( -2.335 5.153 1.650) 5.893 13.376 ( 0.962 -0.284 1.381) 1.707 13.667 ( -0.583 -0.946 -0.735) 1.332 13.824 ( -4.693 -5.790 -6.988) 10.217 14.045 ( -2.470 6.701 1.925) 7.396 14.294 ( 2.095 3.090 2.602) 4.551 14.322 ( -1.145 0.417 -3.029) 3.265 14.440 ( 4.286 -1.278 -0.689) 4.525 ======================= Grid point 311 (163/260) ======================= q-point: ( 0.20 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.812 ( 17.898 22.152 20.413) 35.039 5.151 ( 10.471 19.709 19.876) 29.885 5.323 ( 18.292 23.036 -8.673) 30.667 6.115 ( -10.423 19.855 4.463) 22.865 6.363 ( 7.486 -6.247 4.416) 10.703 6.624 ( 11.186 -3.184 -3.291) 12.087 6.759 ( 2.336 -3.444 20.377) 20.797 7.059 ( -6.808 -6.245 -2.124) 9.479 7.130 ( 2.553 15.391 18.604) 24.280 7.343 ( -4.934 12.058 6.798) 14.695 7.636 ( -5.543 -6.025 1.455) 8.315 8.170 ( -3.298 -6.154 -8.136) 10.721 8.285 ( -0.737 -11.454 -6.464) 13.172 8.671 ( -6.183 -2.879 -2.984) 7.445 8.943 ( 7.119 -6.756 -1.381) 9.911 9.056 ( -2.627 -6.073 0.580) 6.642 9.588 ( 4.434 -2.966 8.947) 10.417 9.831 ( -0.278 -5.914 9.792) 11.443 10.014 ( -1.565 4.302 -17.090) 17.692 10.214 ( -7.998 0.668 -9.501) 12.437 10.767 ( -0.484 8.187 0.767) 8.237 10.979 ( 0.467 -0.618 1.210) 1.437 11.059 ( -1.829 1.035 -4.131) 4.635 11.274 ( 0.430 -3.382 -9.983) 10.550 11.578 ( -2.090 0.313 -0.137) 2.117 11.793 ( 3.643 -3.217 1.797) 5.182 11.949 ( -4.196 1.926 -3.310) 5.681 12.308 ( 1.257 -8.748 -3.752) 9.601 13.102 ( -2.473 5.471 0.693) 6.043 13.403 ( -0.053 -1.709 2.220) 2.802 13.616 ( -3.157 -2.746 -3.238) 5.290 13.691 ( -3.619 -5.381 -4.579) 7.939 14.051 ( 1.163 6.493 1.870) 6.856 14.285 ( 0.086 0.345 -1.375) 1.420 14.390 ( 4.199 4.112 3.690) 6.940 14.533 ( 4.998 -1.395 1.712) 5.464 ======================= Grid point 312 (164/260) ======================= q-point: ( 0.30 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.215 ( 4.936 20.679 22.354) 30.850 5.453 ( 6.552 16.266 10.887) 20.641 5.583 ( 14.619 16.344 -8.052) 23.360 6.023 ( -1.948 14.204 9.159) 17.013 6.409 ( 0.897 -0.311 -12.268) 12.305 6.540 ( -17.548 3.568 -4.822) 18.545 6.949 ( 11.586 -14.490 8.620) 20.457 7.171 ( 7.163 -7.358 13.127) 16.666 7.264 ( 0.331 3.756 9.610) 10.323 7.418 ( 7.998 3.500 4.319) 9.740 7.779 ( 11.839 15.576 16.106) 25.341 8.015 ( -7.337 -2.786 -2.348) 8.192 8.236 ( 0.362 -12.471 -6.565) 14.099 8.515 ( -5.775 -0.715 -4.822) 7.557 8.976 ( -2.807 -9.554 -2.295) 10.218 9.093 ( 2.878 -3.070 7.638) 8.720 9.668 ( -11.339 1.646 0.931) 11.496 9.716 ( -0.961 4.107 -12.809) 13.486 9.842 ( -3.567 5.324 -5.420) 8.393 10.175 ( 4.129 -6.018 3.063) 7.915 10.730 ( -2.256 5.862 -1.851) 6.549 10.949 ( -3.894 -0.426 -4.220) 5.758 10.978 ( -0.937 0.123 -4.297) 4.399 11.202 ( 0.578 -4.329 -9.976) 10.890 11.506 ( -3.677 1.764 -4.027) 5.731 11.824 ( 0.551 -0.896 -6.628) 6.711 11.894 ( -0.097 -0.877 3.624) 3.730 12.245 ( -3.738 -8.734 -5.250) 10.854 13.074 ( -0.892 4.276 0.571) 4.406 13.400 ( -2.613 -2.553 2.757) 4.577 13.513 ( -2.974 -3.444 -5.947) 7.488 13.629 ( -0.283 -4.324 -2.530) 5.017 14.105 ( 2.665 5.435 1.981) 6.369 14.288 ( 1.023 0.659 -0.774) 1.442 14.505 ( 3.898 3.958 5.395) 7.744 14.638 ( 3.961 -1.136 3.342) 5.305 ======================= Grid point 313 (165/260) ======================= q-point: (-0.60 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.193 ( -22.994 16.287 19.019) 33.996 5.675 ( 6.761 20.399 12.378) 24.800 5.764 ( 15.177 7.262 -18.223) 24.803 5.917 ( -21.724 10.828 0.571) 24.280 6.284 ( 1.357 -10.730 -5.017) 11.923 6.379 ( -1.005 12.811 9.234) 15.825 7.131 ( 1.384 -4.652 1.204) 5.001 7.350 ( 5.265 -4.593 9.042) 11.427 7.424 ( 7.055 -7.131 8.123) 12.908 7.667 ( 14.971 -4.068 1.822) 15.620 7.894 ( -6.659 2.361 4.483) 8.368 8.132 ( -0.754 -6.818 4.738) 8.337 8.226 ( 8.494 8.511 8.063) 14.477 8.443 ( 6.436 4.922 -4.839) 9.438 8.909 ( -3.089 -7.543 1.043) 8.218 9.167 ( -1.595 1.451 5.613) 6.013 9.302 ( -19.088 6.415 -5.716) 20.933 9.565 ( -2.812 5.916 -14.293) 15.723 9.864 ( 2.245 1.963 2.325) 3.781 10.258 ( 4.101 -3.137 -3.465) 6.218 10.692 ( -1.537 -0.181 0.842) 1.762 10.819 ( -2.894 0.450 -8.307) 8.808 10.929 ( -1.318 0.490 -3.444) 3.719 11.110 ( -1.238 -3.280 -11.180) 11.717 11.399 ( -2.423 2.046 -6.346) 7.095 11.772 ( 0.066 -0.515 -6.466) 6.487 11.934 ( 0.479 -3.945 2.496) 4.693 12.116 ( -4.396 -7.679 -4.286) 9.832 13.081 ( 1.007 2.729 0.742) 3.002 13.358 ( -3.942 -3.017 1.976) 5.343 13.426 ( -1.152 -1.538 -5.191) 5.535 13.625 ( 2.161 -4.831 -3.086) 6.126 14.172 ( 2.713 4.157 1.779) 5.273 14.302 ( 0.963 0.579 -0.549) 1.251 14.613 ( 2.315 3.512 6.441) 7.693 14.724 ( 1.853 -0.486 4.015) 4.448 ======================= Grid point 314 (166/260) ======================= q-point: (-0.50 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.876 ( -26.387 17.951 16.734) 36.035 5.345 ( -30.214 11.486 -1.153) 32.344 5.762 ( 0.964 -4.529 -15.306) 15.991 5.983 ( 5.245 20.082 15.706) 26.028 6.255 ( 3.080 -15.924 -7.890) 18.037 6.520 ( -1.734 15.219 18.799) 24.249 7.112 ( -0.789 7.640 -1.713) 7.870 7.490 ( -0.880 -4.219 10.591) 11.434 7.609 ( 9.048 -6.629 0.098) 11.217 7.798 ( -5.537 -0.745 5.322) 7.716 7.938 ( 8.965 -2.114 -0.518) 9.226 8.091 ( -0.945 -10.351 -0.284) 10.398 8.307 ( -1.874 0.067 7.260) 7.498 8.608 ( -1.579 4.872 1.240) 5.270 8.855 ( -7.467 11.610 -6.454) 15.239 9.067 ( 5.604 5.837 4.520) 9.269 9.176 ( 0.043 -0.589 3.356) 3.408 9.409 ( -4.252 1.416 -5.423) 7.035 9.919 ( 2.933 1.439 -0.982) 3.411 10.279 ( 4.165 -3.330 -8.582) 10.104 10.602 ( -5.110 -0.249 -6.527) 8.293 10.767 ( 0.438 0.197 -4.232) 4.259 10.889 ( 1.331 1.182 -3.679) 4.087 10.987 ( -1.702 -0.839 -8.474) 8.684 11.334 ( 0.537 -0.027 -4.876) 4.906 11.700 ( -1.173 -2.713 -8.561) 9.057 11.929 ( -2.288 -4.022 1.793) 4.963 12.073 ( 1.932 -5.483 -0.878) 5.879 13.119 ( 2.069 1.158 0.856) 2.520 13.300 ( -3.069 -2.985 0.448) 4.304 13.386 ( 0.547 0.925 -3.258) 3.430 13.652 ( 3.954 -4.983 -3.984) 7.506 14.231 ( 2.204 3.028 1.419) 4.005 14.312 ( 0.744 0.360 -0.850) 1.186 14.687 ( -0.503 2.572 6.627) 7.126 14.771 ( -0.335 0.252 4.000) 4.022 ======================= Grid point 315 (167/260) ======================= q-point: (-0.40 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.528 ( -27.105 18.509 15.351) 36.235 4.800 ( -30.095 18.813 7.135) 36.202 5.622 ( -4.345 -14.362 -6.978) 16.548 6.137 ( -3.463 17.634 14.674) 23.201 6.223 ( -3.013 -21.739 -1.137) 21.977 6.616 ( -0.912 21.504 12.247) 24.764 7.074 ( -2.016 15.727 -3.940) 16.338 7.492 ( -10.185 4.815 11.594) 16.166 7.646 ( -7.624 -4.197 8.047) 11.853 7.812 ( 1.804 -4.511 -1.764) 5.168 7.986 ( 0.395 -1.585 -0.964) 1.897 8.093 ( 1.542 -3.328 0.881) 3.772 8.391 ( 6.689 -2.894 -0.226) 7.291 8.469 ( -6.189 4.274 -1.656) 7.701 8.698 ( -2.632 0.194 -6.402) 6.925 9.109 ( -6.032 4.650 8.932) 11.738 9.281 ( 3.598 0.687 -7.095) 7.984 9.458 ( 9.070 -4.993 8.652) 13.493 9.961 ( 3.208 1.081 -1.274) 3.617 10.260 ( 1.721 -4.082 -10.141) 11.066 10.471 ( -2.205 1.865 -5.235) 5.978 10.688 ( 0.680 -0.666 -12.500) 12.536 10.925 ( 3.126 2.055 -0.874) 3.841 10.956 ( 3.018 0.420 -1.908) 3.595 11.326 ( 1.852 -0.756 -2.940) 3.556 11.605 ( -0.816 -3.865 -8.320) 9.210 11.918 ( -0.640 -0.986 2.110) 2.416 12.126 ( 3.666 -4.704 -0.255) 5.969 13.153 ( 0.577 -0.695 0.175) 0.920 13.270 ( -0.738 -2.376 1.612) 2.965 13.391 ( 2.808 3.544 -2.924) 5.385 13.703 ( 5.665 -4.275 -4.820) 8.579 14.273 ( 1.233 2.498 1.042) 2.975 14.316 ( 0.808 0.247 -1.570) 1.783 14.697 ( -3.985 1.558 5.262) 6.782 14.783 ( -1.953 0.068 3.965) 4.421 ======================= Grid point 316 (168/260) ======================= q-point: (-0.30 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.103 ( -30.524 21.664 11.919) 39.282 4.450 ( -21.227 26.019 21.040) 39.627 5.523 ( -4.256 -20.886 3.098) 21.539 6.098 ( -10.900 19.833 8.811) 24.285 6.134 ( -8.758 -21.593 6.737) 24.256 6.692 ( -1.218 24.093 7.532) 25.272 6.963 ( -6.613 20.000 -1.766) 21.139 7.267 ( -21.423 14.039 7.561) 26.706 7.541 ( -10.639 -5.034 7.373) 13.888 7.743 ( -7.984 -5.046 5.105) 10.736 8.049 ( 7.217 0.735 -1.328) 7.375 8.201 ( 8.782 -0.670 -1.448) 8.926 8.424 ( 1.713 -0.778 -2.238) 2.924 8.494 ( 9.450 -5.763 -11.535) 15.987 8.658 ( 2.427 -4.027 -1.448) 4.920 9.042 ( -9.671 2.045 9.077) 13.421 9.300 ( 2.398 -9.914 -0.644) 10.220 9.628 ( 3.257 -6.331 3.463) 7.917 10.010 ( 1.673 1.799 0.223) 2.466 10.185 ( 0.036 -2.757 -6.635) 7.185 10.466 ( 5.392 1.593 -3.978) 6.887 10.670 ( 7.468 -1.229 -6.999) 10.309 10.968 ( 2.583 2.165 -1.766) 3.805 11.019 ( 4.602 0.033 -2.007) 5.020 11.344 ( 1.709 0.197 -1.028) 2.004 11.541 ( 0.921 -2.625 -6.883) 7.424 11.934 ( 0.339 1.822 1.964) 2.700 12.190 ( 3.501 -4.211 -0.472) 5.496 13.144 ( -0.934 -0.773 -0.250) 1.238 13.294 ( 0.360 -3.144 3.464) 4.692 13.437 ( 4.956 6.197 -3.287) 8.589 13.777 ( 7.041 -3.342 -5.182) 9.360 14.288 ( -0.535 2.943 0.572) 3.045 14.315 ( 0.965 0.658 -2.514) 2.772 14.636 ( -6.209 0.874 3.187) 7.034 14.759 ( -4.015 -1.636 2.936) 5.236 ======================= Grid point 317 (169/260) ======================= q-point: (-0.20 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.705 ( -24.179 30.721 16.669) 42.500 4.335 ( -14.158 28.648 27.233) 41.986 5.515 ( -3.438 -24.395 10.102) 26.626 5.908 ( -13.526 19.142 0.720) 23.449 6.042 ( -10.964 -9.615 15.922) 21.591 6.668 ( -6.833 19.184 6.922) 21.509 6.772 ( -13.630 28.241 -3.830) 31.592 7.009 ( -11.721 11.143 11.146) 19.641 7.405 ( -8.008 -5.592 2.637) 10.117 7.655 ( -7.006 -5.434 6.813) 11.182 8.182 ( 7.463 -0.559 -0.669) 7.514 8.326 ( 7.035 -2.975 -5.292) 9.292 8.435 ( 2.167 -5.689 -5.914) 8.487 8.555 ( 7.875 -3.664 -9.619) 12.960 8.763 ( 5.294 -5.003 3.827) 8.228 8.928 ( -5.993 1.632 3.415) 7.088 9.341 ( -0.452 -14.795 4.926) 15.600 9.642 ( -1.369 -8.585 -4.141) 9.630 10.038 ( 1.328 2.692 3.981) 4.986 10.228 ( 6.823 -2.641 2.500) 7.732 10.575 ( 9.815 0.854 -4.834) 10.974 10.813 ( 9.359 -2.798 -0.085) 9.768 10.975 ( 0.882 2.709 -3.898) 4.828 11.079 ( 4.779 -1.059 -3.651) 6.107 11.357 ( -0.851 1.531 1.946) 2.619 11.537 ( 4.233 -1.169 -5.048) 6.691 11.954 ( 0.163 3.896 1.492) 4.175 12.241 ( 2.485 -3.953 -0.665) 4.716 13.130 ( -0.540 0.400 0.581) 0.888 13.327 ( -0.126 -2.903 3.631) 4.651 13.509 ( 5.598 6.817 -3.045) 9.332 13.868 ( 7.308 -3.141 -5.003) 9.397 14.261 ( -2.802 4.413 0.399) 5.243 14.305 ( 0.436 1.764 -3.398) 3.854 14.534 ( -6.535 -0.339 0.914) 6.607 14.681 ( -6.173 -3.191 0.646) 6.979 ======================= Grid point 318 (170/260) ======================= q-point: (-0.10 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.556 ( -8.336 36.696 21.100) 43.143 4.377 ( -7.668 30.651 29.755) 43.401 5.461 ( -10.473 -1.283 -1.966) 10.733 5.741 ( -4.473 -2.356 11.159) 12.250 6.030 ( -7.598 0.726 23.086) 24.315 6.482 ( -9.293 28.618 -6.823) 30.853 6.651 ( -5.458 15.491 13.680) 21.376 6.917 ( -10.160 5.274 10.135) 15.289 7.304 ( -2.405 -5.302 -4.551) 7.390 7.594 ( -7.748 -2.942 10.144) 13.099 8.303 ( 6.440 -3.738 -0.848) 7.494 8.339 ( 2.398 -11.206 -12.241) 16.768 8.410 ( 0.467 -7.127 -6.763) 9.837 8.595 ( -0.345 0.988 -1.919) 2.186 8.772 ( -0.130 1.320 3.203) 3.467 9.039 ( 10.766 -3.938 1.233) 11.530 9.348 ( -4.086 -15.148 5.892) 16.759 9.549 ( -2.541 -8.585 -5.132) 10.320 10.137 ( 4.532 3.478 4.901) 7.526 10.431 ( 9.394 -1.342 6.172) 11.320 10.692 ( 6.274 -1.617 -7.585) 9.976 10.901 ( 0.611 -1.293 -3.375) 3.665 11.007 ( 5.518 1.088 0.907) 5.697 11.157 ( 8.496 -2.190 -5.228) 10.213 11.374 ( 0.419 1.487 6.130) 6.322 11.589 ( 3.665 -1.469 -1.676) 4.289 11.970 ( 0.914 4.919 0.587) 5.037 12.266 ( 0.917 -3.965 -0.959) 4.181 13.135 ( -0.016 1.801 1.740) 2.504 13.347 ( -0.560 -1.122 2.620) 2.905 13.586 ( 5.054 5.229 -2.111) 7.573 13.946 ( 5.179 -4.317 -5.024) 8.409 14.195 ( -5.195 6.507 1.509) 8.461 14.272 ( -0.612 2.938 -3.595) 4.683 14.432 ( -3.655 -1.707 -1.426) 4.279 14.553 ( -7.030 -3.175 -1.629) 7.884 ======================= Grid point 319 (171/260) ======================= q-point: ( 0.00 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.444 ( 4.965 32.232 19.846) 38.176 4.983 ( -1.576 -8.905 17.063) 19.312 5.295 ( 4.329 12.107 23.515) 26.801 5.743 ( 0.619 -15.299 15.164) 21.549 6.034 ( 1.022 12.872 -0.951) 12.948 6.475 ( 0.176 -20.947 -8.801) 22.722 6.912 ( -12.010 20.622 4.307) 24.249 7.179 ( -5.183 0.076 -4.767) 7.042 7.400 ( 0.016 32.723 6.720) 33.406 7.555 ( -1.925 5.234 9.447) 10.970 7.894 ( 2.079 -19.517 -11.961) 22.984 8.013 ( 0.134 -18.643 1.156) 18.680 8.460 ( -7.748 5.313 5.690) 10.984 8.540 ( -8.852 -0.828 1.517) 9.019 8.888 ( 2.447 0.870 -1.529) 3.014 8.982 ( -3.010 -7.976 0.511) 8.541 9.245 ( 5.752 -1.550 7.535) 9.605 9.301 ( 1.129 -7.922 7.762) 11.148 10.370 ( 4.778 7.398 -5.379) 10.319 10.514 ( 3.251 -6.549 -4.709) 8.697 10.755 ( 4.037 6.072 -0.028) 7.292 10.859 ( 2.626 -3.616 -0.144) 4.471 11.126 ( 4.926 2.855 -2.497) 6.217 11.203 ( 7.364 -4.401 -4.111) 9.513 11.504 ( 2.092 2.651 5.340) 6.318 11.572 ( 0.644 -3.284 2.323) 4.074 12.083 ( 0.841 4.108 -1.148) 4.347 12.172 ( 0.114 -4.513 -1.793) 4.858 13.231 ( 0.657 4.462 2.528) 5.170 13.317 ( 0.339 -3.586 2.810) 4.568 13.718 ( 1.010 4.346 -5.133) 6.801 13.821 ( -0.568 -5.747 -6.585) 8.759 14.238 ( -5.086 5.824 1.091) 7.809 14.319 ( -1.751 1.602 0.302) 2.393 14.341 ( -0.037 -1.937 -1.835) 2.668 14.381 ( -0.863 -2.349 -2.094) 3.263 ======================= Grid point 320 (172/260) ======================= q-point: ( 0.10 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.784 ( 13.836 24.736 18.684) 33.947 5.150 ( 5.250 -3.605 15.052) 16.344 5.586 ( 7.628 18.878 16.287) 26.073 5.875 ( 5.004 -1.612 8.608) 10.086 6.188 ( 8.538 -8.417 12.692) 17.459 6.449 ( 4.385 -20.658 -8.181) 22.647 6.733 ( -10.168 19.872 0.967) 22.343 7.007 ( -5.700 -5.758 -10.276) 13.086 7.481 ( 0.584 20.763 4.860) 21.333 7.651 ( 3.131 19.696 14.369) 24.581 7.827 ( 0.963 -12.855 -13.550) 18.702 7.955 ( -8.760 -2.303 3.586) 9.742 8.356 ( -12.322 -2.900 2.723) 12.948 8.444 ( 1.010 -13.946 9.310) 16.798 8.853 ( -2.554 -0.244 -5.160) 5.763 8.945 ( -0.366 -7.781 -3.542) 8.557 9.401 ( 4.276 0.717 11.187) 11.998 9.469 ( 4.892 -6.572 13.867) 16.106 10.308 ( -0.953 6.153 -15.124) 16.356 10.415 ( -3.592 -3.994 -13.282) 14.327 10.861 ( 3.425 4.964 3.842) 7.150 10.920 ( 2.255 -1.147 2.375) 3.471 11.163 ( 1.930 4.366 -4.324) 6.441 11.258 ( 3.063 -4.430 -7.477) 9.214 11.585 ( 0.476 0.287 4.551) 4.585 11.619 ( 2.451 -2.983 4.997) 6.314 12.073 ( -0.750 3.255 -2.320) 4.067 12.159 ( 0.680 -5.075 -2.619) 5.751 13.249 ( -1.018 5.355 1.995) 5.804 13.341 ( -0.285 -3.259 2.499) 4.117 13.662 ( -2.110 0.951 -4.991) 5.502 13.716 ( -4.012 -4.336 -6.744) 8.965 14.178 ( -1.964 5.965 0.778) 6.328 14.275 ( -1.814 -3.409 -0.129) 3.864 14.371 ( 3.459 2.699 0.627) 4.432 14.413 ( 3.802 -1.505 0.129) 4.091 ======================= Grid point 321 (173/260) ======================= q-point: ( 0.20 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.221 ( 15.974 17.534 17.364) 29.396 5.417 ( 10.496 2.457 12.759) 16.703 5.797 ( 8.370 21.752 0.027) 23.307 6.095 ( 5.440 -9.881 12.714) 16.997 6.475 ( 9.589 -9.436 11.193) 17.500 6.487 ( 3.135 -4.865 0.409) 5.802 6.559 ( -5.904 7.434 -6.418) 11.459 6.836 ( -3.608 -10.924 -4.336) 12.295 7.513 ( 2.114 13.070 -0.900) 13.270 7.627 ( -12.623 11.522 -2.378) 17.256 7.854 ( 2.551 12.039 11.258) 16.679 7.896 ( 3.304 -13.796 -5.351) 15.162 8.191 ( -7.834 8.810 11.646) 16.571 8.612 ( 6.097 -13.933 8.097) 17.229 8.752 ( -2.067 -2.179 -5.143) 5.955 8.878 ( -4.936 -9.688 -0.844) 10.906 9.583 ( 4.784 2.113 10.640) 11.856 9.672 ( 4.200 -6.837 12.988) 15.267 10.127 ( -3.181 5.334 -16.834) 17.944 10.205 ( -6.190 -2.076 -13.476) 14.974 10.907 ( -0.558 4.806 0.760) 4.898 10.962 ( 0.374 -1.202 0.906) 1.551 11.115 ( -1.828 3.971 -6.973) 8.230 11.198 ( -0.649 -3.977 -9.960) 10.744 11.610 ( -0.397 3.228 1.645) 3.645 11.703 ( 2.337 -5.279 2.524) 6.301 12.016 ( -2.620 4.673 -3.365) 6.326 12.139 ( -0.712 -7.422 -3.431) 8.207 13.226 ( -2.489 6.455 0.644) 6.948 13.344 ( -1.618 -4.548 2.050) 5.245 13.569 ( -2.943 -0.671 -5.759) 6.502 13.601 ( -2.736 -3.334 -4.143) 5.981 14.176 ( 0.865 5.484 0.665) 5.592 14.261 ( 0.427 -2.747 -0.353) 2.802 14.461 ( 4.313 2.792 3.285) 6.098 14.504 ( 4.628 -1.561 2.600) 5.533 ======================= Grid point 322 (174/260) ======================= q-point: ( 0.30 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.580 ( 4.830 14.849 15.004) 21.655 5.716 ( 11.187 5.207 9.695) 15.693 5.907 ( 7.071 15.041 -8.263) 18.561 6.142 ( -5.463 -5.296 3.478) 8.366 6.371 ( -8.591 -0.375 -8.273) 11.933 6.468 ( -2.299 -6.921 -6.440) 9.729 6.755 ( 11.656 0.829 13.312) 17.713 6.955 ( 8.092 -13.176 14.784) 21.393 7.436 ( -7.487 12.008 3.846) 14.664 7.541 ( 3.274 5.689 -5.494) 8.560 7.854 ( -2.030 -6.005 3.049) 7.034 7.952 ( 5.176 -12.183 -4.058) 13.845 8.361 ( 5.436 28.840 20.992) 36.083 8.588 ( -2.564 7.484 -6.078) 9.976 8.764 ( -6.547 -10.922 0.650) 12.751 8.882 ( 8.522 -18.154 8.825) 21.911 9.696 ( -1.987 2.363 1.432) 3.403 9.749 ( -4.117 -1.651 -2.167) 4.936 9.958 ( -2.104 5.213 -7.374) 9.273 10.053 ( 1.098 -4.961 -1.805) 5.392 10.850 ( -4.266 5.144 -3.280) 7.444 10.926 ( -4.368 -2.388 -2.205) 5.444 11.016 ( -0.679 3.619 -7.899) 8.715 11.106 ( 0.052 -4.855 -9.764) 10.905 11.591 ( -1.157 6.439 -3.109) 7.243 11.737 ( 1.320 -6.777 -2.878) 7.480 11.936 ( -3.277 4.497 -1.524) 5.770 12.065 ( -3.687 -8.105 -4.037) 9.777 13.184 ( -2.021 6.283 0.030) 6.600 13.314 ( -2.774 -6.002 0.856) 6.667 13.483 ( -1.426 1.127 -4.601) 4.947 13.541 ( -0.685 -4.066 -3.180) 5.208 14.210 ( 1.956 4.502 0.650) 4.951 14.277 ( 1.283 -1.938 -0.251) 2.338 14.573 ( 3.778 2.689 5.096) 6.890 14.614 ( 3.892 -1.445 4.375) 6.031 ======================= Grid point 323 (175/260) ======================= q-point: (-0.60 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.551 ( -16.013 18.309 8.718) 25.839 5.846 ( -4.861 -3.219 -9.067) 10.780 5.925 ( 1.272 3.323 -10.060) 10.670 6.013 ( -9.682 -9.792 -4.320) 14.432 6.205 ( -0.139 17.478 9.413) 19.852 6.492 ( 3.521 -6.386 10.592) 12.860 7.049 ( 8.331 2.768 10.023) 13.324 7.220 ( 8.755 -10.454 9.109) 16.398 7.410 ( -0.015 7.085 4.307) 8.291 7.578 ( 6.185 -6.915 -2.954) 9.737 7.914 ( 4.831 1.543 1.953) 5.435 7.994 ( 1.367 -5.229 -2.550) 5.976 8.411 ( -8.186 9.791 8.533) 15.352 8.608 ( -3.079 -4.133 1.188) 5.289 8.822 ( 13.654 10.967 9.775) 20.056 9.093 ( 5.887 -9.325 7.400) 13.280 9.462 ( -14.714 7.746 -7.981) 18.445 9.587 ( -6.360 -3.681 -10.613) 12.908 9.960 ( 1.176 7.276 2.417) 7.757 10.128 ( 3.263 -8.485 1.214) 9.172 10.738 ( -3.329 3.833 -4.619) 6.864 10.807 ( -3.385 -2.254 -5.546) 6.877 10.955 ( -0.514 2.528 -5.363) 5.951 11.027 ( -0.679 -4.208 -8.250) 9.286 11.513 ( -1.730 8.471 -8.626) 12.213 11.696 ( -0.438 -7.853 -9.150) 12.066 11.892 ( -1.689 1.249 1.801) 2.767 11.970 ( -2.646 -5.982 -1.827) 6.792 13.160 ( -0.615 4.860 0.045) 4.899 13.267 ( -2.445 -5.370 -0.158) 5.903 13.439 ( 0.274 2.614 -3.511) 4.386 13.520 ( 1.373 -5.049 -3.274) 6.172 14.251 ( 1.976 3.341 0.368) 3.899 14.298 ( 1.238 -1.184 -0.423) 1.764 14.674 ( 1.881 2.396 6.136) 6.851 14.709 ( 1.903 -1.110 5.270) 5.712 ======================= Grid point 324 (176/260) ======================= q-point: (-0.50 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.263 ( -20.525 19.189 5.476) 28.626 5.557 ( -15.672 1.820 -6.987) 17.255 5.625 ( -17.076 -1.475 -6.189) 18.222 5.884 ( -6.453 -17.391 -2.169) 18.676 6.392 ( 3.845 18.806 14.667) 24.157 6.676 ( 3.863 -5.156 13.062) 14.565 7.224 ( 5.972 6.770 1.953) 9.237 7.423 ( 7.784 -10.672 1.955) 13.353 7.485 ( 5.002 7.301 2.081) 9.092 7.700 ( 8.438 -11.362 -2.453) 14.364 7.942 ( -5.717 3.137 2.464) 6.971 7.994 ( 0.944 -1.533 0.969) 2.044 8.391 ( -1.363 8.174 8.444) 11.831 8.580 ( -1.694 -7.778 4.405) 9.098 9.069 ( -13.641 6.951 -4.062) 15.840 9.150 ( 2.058 0.931 3.379) 4.065 9.222 ( 4.135 8.503 4.125) 10.316 9.408 ( -6.272 -4.685 -0.522) 7.846 9.983 ( 1.384 6.343 -1.662) 6.701 10.154 ( 1.874 -8.657 -4.671) 10.014 10.644 ( -2.615 3.897 -6.361) 7.905 10.729 ( -1.209 -3.720 -5.791) 6.988 10.918 ( 1.142 1.738 -2.855) 3.532 10.956 ( -0.223 -1.885 -4.648) 5.021 11.412 ( 0.009 7.177 -9.904) 12.231 11.583 ( -1.422 -8.409 -11.240) 14.109 11.896 ( 0.506 1.259 1.839) 2.286 11.964 ( 2.048 -4.840 0.351) 5.267 13.158 ( 0.110 2.763 0.090) 2.767 13.227 ( -1.653 -3.852 -0.226) 4.198 13.436 ( 2.750 3.986 -3.397) 5.915 13.539 ( 3.831 -5.735 -3.673) 7.814 14.286 ( 1.716 2.193 -0.074) 2.785 14.313 ( 1.037 -0.479 -0.824) 1.409 14.736 ( -1.088 2.048 6.336) 6.747 14.766 ( -0.720 -0.851 5.393) 5.507 ======================= Grid point 325 (177/260) ======================= q-point: (-0.40 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.914 ( -22.174 19.105 5.182) 29.724 5.229 ( -17.969 20.492 5.345) 27.774 5.296 ( -15.223 -14.755 -1.065) 21.227 5.731 ( -9.870 -24.922 3.238) 27.000 6.525 ( -1.653 18.747 11.016) 21.807 6.821 ( 1.681 -5.752 8.563) 10.451 7.304 ( 2.833 9.785 -2.371) 10.459 7.478 ( -1.937 -1.718 0.894) 2.739 7.631 ( 7.627 0.533 -1.197) 7.739 7.812 ( 5.060 -7.107 -2.587) 9.100 7.868 ( -6.494 3.851 7.184) 10.422 8.008 ( 1.910 -5.020 3.155) 6.229 8.464 ( 1.251 6.249 4.516) 7.811 8.584 ( -2.096 -1.986 3.205) 4.314 8.737 ( -13.052 12.265 -6.282) 18.980 9.045 ( -6.160 -13.043 -2.691) 14.674 9.311 ( -8.595 6.290 9.994) 14.605 9.422 ( 2.250 -2.721 7.693) 8.464 10.012 ( 4.234 5.129 -3.033) 7.310 10.148 ( 2.380 -6.862 -5.992) 9.416 10.542 ( -1.384 4.638 -6.689) 8.257 10.637 ( -0.577 -4.126 -9.206) 10.105 10.953 ( 3.111 0.732 -0.576) 3.248 10.959 ( 2.926 -0.010 -1.171) 3.152 11.365 ( 3.040 4.611 -7.834) 9.585 11.490 ( 1.300 -6.844 -9.744) 11.978 11.939 ( 2.423 2.963 1.419) 4.082 12.023 ( 3.664 -5.005 0.444) 6.219 13.158 ( -0.162 1.432 -0.110) 1.445 13.208 ( -0.527 -3.205 0.708) 3.325 13.483 ( 5.458 5.289 -3.767) 8.482 13.597 ( 6.119 -5.759 -4.288) 9.433 14.313 ( 1.463 1.281 -0.622) 2.041 14.323 ( 1.117 0.153 -1.319) 1.736 14.736 ( -4.406 2.067 5.625) 7.438 14.771 ( -3.488 -1.251 4.987) 6.213 ======================= Grid point 326 (178/260) ======================= q-point: (-0.30 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.572 ( -21.263 24.129 10.130) 33.718 5.013 ( -14.012 27.290 13.063) 33.342 5.065 ( -12.620 -22.194 7.520) 26.615 5.604 ( -8.845 -28.475 8.164) 30.914 6.508 ( -6.939 20.169 3.935) 21.689 6.861 ( -2.587 -10.814 1.710) 11.250 7.287 ( -4.354 12.260 1.684) 13.119 7.427 ( -3.325 4.206 1.763) 5.644 7.648 ( -4.165 0.459 -0.230) 4.197 7.767 ( -13.607 18.293 10.129) 24.948 7.889 ( 6.651 -11.073 -4.447) 13.661 8.122 ( 3.839 -10.906 3.177) 11.991 8.455 ( 1.266 3.567 -4.551) 5.920 8.533 ( -1.481 0.332 -8.475) 8.610 8.625 ( 2.125 9.512 5.177) 11.036 8.967 ( -2.691 -17.190 3.363) 17.721 9.216 ( -10.325 10.012 9.548) 17.263 9.453 ( -4.461 -11.214 6.442) 13.680 10.061 ( 2.454 3.321 -1.289) 4.326 10.129 ( 0.679 -3.063 -3.500) 4.700 10.531 ( 5.623 4.405 -4.613) 8.503 10.620 ( 6.255 -3.743 -5.718) 9.264 10.997 ( 2.767 0.817 -1.809) 3.405 11.011 ( 3.343 -0.633 -1.934) 3.914 11.381 ( 4.103 3.399 -4.994) 7.302 11.466 ( 3.585 -4.431 -7.356) 9.306 11.998 ( 2.623 4.193 1.144) 5.077 12.094 ( 3.500 -4.991 0.170) 6.098 13.155 ( -0.043 1.988 0.192) 1.998 13.218 ( 0.353 -3.890 1.704) 4.261 13.563 ( 6.763 6.164 -4.247) 10.088 13.684 ( 7.341 -5.550 -4.840) 10.398 14.325 ( 0.976 1.187 -1.770) 2.344 14.335 ( 1.391 0.415 -1.595) 2.157 14.671 ( -7.165 2.368 4.361) 8.715 14.720 ( -6.116 -2.274 3.902) 7.603 ======================= Grid point 327 (179/260) ======================= q-point: (-0.20 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.339 ( -15.619 31.307 16.186) 38.550 4.923 ( -10.075 9.529 16.436) 21.504 4.978 ( -7.501 -8.226 16.924) 20.257 5.556 ( -5.720 -28.887 12.738) 32.085 6.353 ( -9.880 21.752 -2.729) 24.046 6.757 ( -6.482 -15.238 -4.776) 17.235 7.198 ( -9.581 15.076 9.540) 20.251 7.388 ( -5.850 8.933 4.114) 11.443 7.541 ( -2.972 16.383 -7.977) 18.463 7.577 ( -13.802 11.314 12.540) 21.813 7.956 ( 5.168 -15.959 -6.021) 17.823 8.100 ( -5.718 -19.830 -1.108) 20.667 8.487 ( 4.026 7.017 -2.646) 8.511 8.554 ( 7.645 0.649 -4.665) 8.979 8.742 ( 5.018 4.434 6.043) 9.020 8.979 ( -0.940 -13.636 5.767) 14.835 9.106 ( -8.247 9.349 6.540) 14.078 9.392 ( -5.800 -14.864 2.221) 16.109 10.107 ( 3.143 3.734 3.348) 5.919 10.176 ( 5.479 -2.899 3.133) 6.945 10.633 ( 8.706 4.540 -4.969) 11.005 10.734 ( 8.314 -4.773 -2.684) 9.955 11.019 ( 2.197 1.584 -3.116) 4.129 11.049 ( 3.417 -1.566 -3.083) 4.861 11.414 ( 2.400 3.755 -1.927) 4.855 11.490 ( 4.294 -3.328 -4.518) 7.066 12.046 ( 1.726 4.935 0.655) 5.269 12.148 ( 2.395 -4.983 -0.261) 5.535 13.165 ( 0.627 3.101 1.052) 3.335 13.246 ( 0.758 -4.500 2.419) 5.165 13.648 ( 6.304 6.663 -4.594) 10.258 13.775 ( 6.887 -5.693 -5.148) 10.312 14.320 ( 0.386 2.076 -2.440) 3.227 14.342 ( 1.147 0.431 -2.423) 2.715 14.553 ( -8.803 2.463 2.811) 9.564 14.617 ( -7.848 -3.314 2.184) 8.795 ======================= Grid point 328 (180/260) ======================= q-point: (-0.10 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.288 ( -6.126 35.038 19.532) 40.579 4.914 ( -6.670 -7.674 17.923) 20.607 5.069 ( -1.137 6.998 22.451) 23.544 5.611 ( -1.972 -26.315 16.711) 31.235 6.142 ( -7.795 22.560 -5.796) 24.562 6.590 ( -4.848 -18.172 -7.783) 20.355 7.089 ( -13.137 17.259 10.862) 24.257 7.265 ( -5.836 19.941 1.464) 20.829 7.445 ( -4.852 15.774 -2.681) 16.720 7.518 ( -2.636 4.446 8.859) 10.257 7.960 ( 1.830 -20.205 -10.834) 22.999 8.006 ( -1.550 -21.591 0.330) 21.649 8.517 ( -0.221 8.588 -0.203) 8.593 8.626 ( 0.226 -0.597 0.107) 0.647 8.845 ( -1.005 5.133 7.393) 9.056 9.004 ( -1.184 -7.276 4.389) 8.579 9.093 ( 2.598 0.636 5.598) 6.204 9.304 ( -3.285 -13.752 -1.112) 14.183 10.244 ( 7.066 6.204 4.639) 10.485 10.364 ( 9.251 -5.146 6.071) 12.203 10.723 ( 5.547 4.130 -6.855) 9.737 10.824 ( 4.283 -5.152 -4.034) 7.821 11.051 ( 4.006 2.486 -1.566) 4.968 11.104 ( 5.970 -2.761 -3.228) 7.327 11.443 ( 1.441 4.668 1.600) 5.140 11.535 ( 2.797 -3.853 -0.897) 4.845 12.072 ( 1.017 5.105 -0.228) 5.211 12.174 ( 0.982 -4.900 -0.858) 5.071 13.194 ( 1.080 3.940 1.979) 4.540 13.283 ( 0.742 -4.371 2.857) 5.274 13.708 ( 4.395 6.360 -4.860) 9.131 13.836 ( 4.294 -6.102 -5.588) 9.322 14.298 ( -1.030 3.655 -1.546) 4.100 14.338 ( 0.907 1.183 -2.891) 3.253 14.411 ( -7.742 1.352 1.033) 7.927 14.482 ( -7.422 -3.890 0.150) 8.381 ======================= Grid point 369 (181/260) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.946 ( 17.813 0.000 30.188) 35.051 3.541 ( -9.890 0.000 33.009) 34.459 4.013 ( -12.273 0.000 -17.756) 21.585 4.772 ( 6.618 0.000 -22.406) 23.363 6.175 ( -7.384 0.000 59.468) 59.925 6.800 ( -9.737 0.000 15.150) 18.009 7.110 ( -23.045 0.000 17.564) 28.975 7.325 ( 6.651 0.000 17.101) 18.349 7.528 ( 1.732 0.000 9.959) 10.108 7.921 ( 5.444 0.000 -13.470) 14.529 7.990 ( 0.883 0.000 -11.524) 11.557 8.206 ( -1.278 0.000 -17.078) 17.125 8.528 ( 11.223 0.000 -21.657) 24.392 8.603 ( -2.088 0.000 -16.907) 17.035 8.732 ( -0.121 0.000 8.270) 8.271 9.091 ( 2.257 0.000 -6.045) 6.453 9.892 ( 4.551 0.000 8.727) 9.842 9.924 ( 16.604 0.000 2.324) 16.766 10.159 ( -15.629 0.000 -6.712) 17.009 10.375 ( -5.443 0.000 -12.453) 13.590 10.536 ( -1.615 0.000 10.390) 10.515 10.919 ( 2.641 0.000 -5.793) 6.366 11.131 ( 5.411 0.000 3.817) 6.621 11.284 ( 2.017 0.000 -4.274) 4.726 11.609 ( 4.959 0.000 1.316) 5.130 11.644 ( -5.912 0.000 0.503) 5.933 12.246 ( 16.630 0.000 1.039) 16.663 12.280 ( -5.527 0.000 -0.297) 5.535 13.105 ( -5.301 0.000 2.498) 5.860 13.170 ( 5.046 0.000 -0.670) 5.090 13.734 ( 2.036 0.000 7.267) 7.547 13.900 ( -3.612 0.000 4.145) 5.498 14.006 ( 1.676 0.000 -4.975) 5.250 14.081 ( 0.586 0.000 -5.933) 5.961 14.383 ( 3.930 0.000 -0.958) 4.045 14.398 ( -9.749 0.000 -1.478) 9.860 ======================= Grid point 370 (182/260) ======================= q-point: ( 0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.733 ( 8.969 0.000 14.587) 17.124 3.749 ( 41.272 0.000 23.553) 47.520 3.892 ( 8.916 0.000 -4.311) 9.903 4.792 ( 16.284 0.000 -22.233) 27.558 6.526 ( -11.412 0.000 57.148) 58.276 6.685 ( -16.063 0.000 13.925) 21.259 6.815 ( -21.362 0.000 15.995) 26.687 7.489 ( 1.081 0.000 8.228) 8.299 7.758 ( 9.755 0.000 12.888) 16.163 7.849 ( 2.373 0.000 -17.062) 17.226 7.946 ( 1.181 0.000 -8.057) 8.143 7.979 ( -3.288 0.000 -14.675) 15.039 8.435 ( -0.885 0.000 -15.878) 15.902 8.653 ( 16.556 0.000 -16.688) 23.508 8.792 ( -0.794 0.000 7.963) 8.003 9.032 ( -3.020 0.000 -6.087) 6.795 9.792 ( -16.656 0.000 -8.929) 18.898 10.038 ( 2.134 0.000 10.772) 10.982 10.074 ( -6.927 0.000 -10.454) 12.541 10.287 ( 10.370 0.000 2.641) 10.701 10.534 ( -6.889 0.000 7.008) 9.827 10.897 ( 0.891 0.000 -5.891) 5.958 11.221 ( -2.996 0.000 -7.770) 8.327 11.242 ( 3.446 0.000 2.070) 4.020 11.582 ( -1.192 0.000 -0.743) 1.404 11.718 ( 5.576 0.000 1.600) 5.801 12.108 ( -10.523 0.000 -4.478) 11.436 12.433 ( 5.663 0.000 -3.953) 6.906 13.051 ( -2.424 0.000 1.716) 2.970 13.278 ( 6.948 0.000 -0.660) 6.979 13.803 ( -2.192 0.000 5.446) 5.871 13.886 ( -1.481 0.000 4.876) 5.096 13.915 ( -3.516 0.000 -7.030) 7.860 14.088 ( 3.210 0.000 -3.864) 5.024 14.269 ( -3.448 0.000 2.301) 4.145 14.498 ( 7.207 0.000 1.607) 7.384 ======================= Grid point 371 (183/260) ======================= q-point: ( 0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.133 ( 29.904 0.000 -4.347) 30.218 4.174 ( 15.547 0.000 11.931) 19.597 4.673 ( 36.958 0.000 8.655) 37.958 5.044 ( 31.239 0.000 -10.404) 32.926 6.355 ( -30.937 0.000 20.032) 36.856 6.451 ( -21.142 0.000 12.006) 24.313 6.953 ( -0.878 0.000 40.785) 40.795 7.493 ( 0.300 0.000 -10.870) 10.874 7.726 ( -2.025 0.000 -13.750) 13.898 7.871 ( 4.037 0.000 2.099) 4.550 7.884 ( -2.142 0.000 -3.942) 4.487 8.130 ( 10.360 0.000 18.222) 20.961 8.320 ( 2.504 0.000 -14.339) 14.556 8.799 ( 14.238 0.000 -18.184) 23.095 8.837 ( -1.121 0.000 6.824) 6.915 8.888 ( -8.179 0.000 -2.846) 8.660 9.419 ( -14.007 0.000 -11.607) 18.191 9.762 ( -14.642 0.000 -11.460) 18.594 10.137 ( -2.742 0.000 11.644) 11.963 10.405 ( -10.486 0.000 2.694) 10.827 10.515 ( 8.412 0.000 4.279) 9.438 10.860 ( 1.501 0.000 -8.367) 8.501 11.077 ( -4.772 0.000 -8.049) 9.357 11.259 ( -2.615 0.000 -2.245) 3.447 11.562 ( 0.519 0.000 -3.072) 3.115 11.835 ( 5.181 0.000 2.226) 5.639 11.867 ( -8.589 0.000 -7.051) 11.113 12.424 ( -1.264 0.000 -5.353) 5.500 13.040 ( -0.342 0.000 1.314) 1.358 13.398 ( 6.723 0.000 -1.569) 6.904 13.711 ( -8.707 0.000 1.692) 8.869 13.789 ( -3.789 0.000 -6.434) 7.467 13.956 ( 2.253 0.000 7.139) 7.486 14.130 ( 4.119 0.000 -1.890) 4.532 14.309 ( 3.189 0.000 4.823) 5.782 14.641 ( 6.104 0.000 2.510) 6.600 ======================= Grid point 372 (184/260) ======================= q-point: ( 0.30 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.594 ( 15.488 0.000 18.722) 24.298 4.694 ( 36.749 0.000 -12.270) 38.743 5.140 ( 23.370 0.000 -10.682) 25.696 5.681 ( 14.957 0.000 9.702) 17.829 6.003 ( -11.179 0.000 16.088) 19.590 6.124 ( -25.356 0.000 11.902) 28.011 7.250 ( 5.596 0.000 9.750) 11.242 7.415 ( 5.071 0.000 -14.270) 15.144 7.586 ( -6.551 0.000 11.284) 13.048 7.812 ( -4.537 0.000 1.810) 4.884 8.018 ( 5.810 0.000 6.187) 8.487 8.294 ( 7.342 0.000 -13.443) 15.317 8.474 ( 9.460 0.000 17.841) 20.194 8.666 ( -13.817 0.000 1.181) 13.868 8.857 ( -3.436 0.000 6.314) 7.188 8.869 ( 8.210 0.000 -18.321) 20.076 9.125 ( -6.042 0.000 -11.609) 13.088 9.379 ( -16.257 0.000 -10.022) 19.098 10.028 ( -14.760 0.000 2.968) 15.056 10.335 ( -0.430 0.000 5.909) 5.924 10.619 ( 1.574 0.000 -3.701) 4.022 10.811 ( 1.539 0.000 -8.952) 9.084 10.929 ( -4.454 0.000 -6.699) 8.045 11.089 ( -10.041 0.000 -8.467) 13.135 11.554 ( 1.358 0.000 -2.622) 2.953 11.726 ( -1.582 0.000 -4.673) 4.934 11.939 ( 3.836 0.000 2.303) 4.474 12.329 ( -3.634 0.000 -5.185) 6.332 13.061 ( 1.253 0.000 1.815) 2.206 13.478 ( 3.589 0.000 -3.113) 4.751 13.569 ( -7.811 0.000 1.881) 8.035 13.678 ( -2.331 0.000 -5.877) 6.323 14.064 ( 2.908 0.000 6.832) 7.425 14.203 ( 4.377 0.000 0.213) 4.383 14.428 ( 4.685 0.000 5.269) 7.050 14.749 ( 3.173 0.000 2.291) 3.914 ======================= Grid point 373 (185/260) ======================= q-point: ( 0.40 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.018 ( 16.395 0.000 10.287) 19.355 5.210 ( 24.842 0.000 -0.958) 24.860 5.272 ( -22.326 0.000 15.196) 27.007 5.614 ( 13.861 0.000 -12.615) 18.742 5.736 ( -26.882 0.000 10.951) 29.027 6.336 ( 10.363 0.000 10.110) 14.477 7.148 ( -11.150 0.000 -5.004) 12.221 7.473 ( 11.985 0.000 -10.110) 15.680 7.756 ( -8.212 0.000 13.856) 16.107 7.896 ( 20.001 0.000 16.395) 25.862 8.127 ( 2.327 0.000 -0.073) 2.328 8.351 ( 10.217 0.000 -13.038) 16.564 8.418 ( -13.258 0.000 1.976) 13.404 8.644 ( -10.099 0.000 8.223) 13.023 8.758 ( -13.383 0.000 5.481) 14.462 8.823 ( 2.402 0.000 -6.354) 6.793 9.073 ( 11.139 0.000 -8.860) 14.233 9.092 ( -4.999 0.000 -6.882) 8.506 9.828 ( -5.588 0.000 0.476) 5.609 10.396 ( 1.370 0.000 4.035) 4.261 10.510 ( -3.346 0.000 -14.808) 15.181 10.748 ( -2.111 0.000 -9.532) 9.763 10.820 ( -9.348 0.000 -9.361) 13.230 10.826 ( -1.118 0.000 -3.044) 3.243 11.566 ( 0.881 0.000 -0.142) 0.892 11.687 ( -0.323 0.000 -2.599) 2.619 12.012 ( 2.281 0.000 2.016) 3.044 12.225 ( -3.160 0.000 -4.000) 5.097 13.116 ( 2.576 0.000 2.738) 3.759 13.455 ( -2.589 0.000 -3.914) 4.693 13.467 ( -5.581 0.000 2.986) 6.329 13.627 ( 2.103 0.000 -6.020) 6.376 14.167 ( 2.258 0.000 5.961) 6.375 14.282 ( 3.448 0.000 0.935) 3.573 14.558 ( 4.786 0.000 4.982) 6.909 14.790 ( -0.227 0.000 1.123) 1.146 ======================= Grid point 374 (186/260) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.851 ( -33.812 0.000 17.871) 38.244 5.169 ( -26.984 0.000 19.135) 33.080 5.439 ( 5.868 0.000 8.361) 10.214 5.665 ( 20.314 0.000 -1.659) 20.381 5.816 ( 7.851 0.000 -1.579) 8.008 6.382 ( -3.119 0.000 -14.976) 15.298 6.955 ( -10.290 0.000 13.275) 16.796 7.589 ( 3.245 0.000 -5.210) 6.138 7.744 ( -10.198 0.000 23.523) 25.638 8.098 ( -5.743 0.000 -2.630) 6.316 8.240 ( -9.480 0.000 -0.337) 9.486 8.274 ( 1.426 0.000 -5.909) 6.079 8.373 ( -10.629 0.000 1.217) 10.698 8.456 ( 17.608 0.000 -2.370) 17.767 8.679 ( 6.110 0.000 3.807) 7.199 8.876 ( 5.877 0.000 -2.006) 6.209 9.022 ( 0.749 0.000 -4.850) 4.907 9.267 ( 14.306 0.000 -8.258) 16.518 9.849 ( 3.553 0.000 5.661) 6.684 10.308 ( -3.776 0.000 -15.172) 15.635 10.407 ( -0.380 0.000 -4.645) 4.660 10.606 ( -2.319 0.000 -10.927) 11.170 10.672 ( -0.869 0.000 -0.195) 0.891 10.804 ( 1.298 0.000 -4.075) 4.277 11.573 ( -1.216 0.000 2.214) 2.526 11.652 ( -1.948 0.000 -1.494) 2.454 12.061 ( 1.533 0.000 1.819) 2.379 12.150 ( -2.224 0.000 -2.599) 3.421 13.197 ( 3.219 0.000 3.667) 4.879 13.354 ( -4.258 0.000 -3.795) 5.704 13.412 ( -3.901 0.000 4.223) 5.749 13.628 ( 3.271 0.000 -6.300) 7.098 14.236 ( -0.018 0.000 4.816) 4.816 14.334 ( 1.699 0.000 -0.159) 1.706 14.684 ( 4.852 0.000 3.951) 6.258 14.764 ( -2.775 0.000 -0.375) 2.800 ======================= Grid point 375 (187/260) ======================= q-point: (-0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.362 ( -37.157 0.000 19.156) 41.805 4.703 ( -39.220 0.000 25.085) 46.557 5.671 ( 11.553 0.000 1.379) 11.635 5.797 ( -11.920 0.000 7.476) 14.071 6.021 ( 14.397 0.000 7.694) 16.324 6.047 ( -21.768 0.000 -2.768) 21.943 7.032 ( 12.885 0.000 -4.580) 13.674 7.385 ( -21.638 0.000 -4.223) 22.047 7.767 ( -12.531 0.000 30.664) 33.126 7.811 ( -17.910 0.000 6.099) 18.920 8.105 ( -1.860 0.000 -5.089) 5.419 8.179 ( -3.348 0.000 0.560) 3.394 8.488 ( 14.430 0.000 -1.004) 14.465 8.726 ( 12.364 0.000 -4.389) 13.120 8.845 ( 7.311 0.000 -6.348) 9.682 8.980 ( 7.208 0.000 -3.114) 7.852 9.064 ( 9.110 0.000 -5.548) 10.666 9.407 ( 11.879 0.000 -16.067) 19.981 9.979 ( 2.721 0.000 9.015) 9.416 10.160 ( 1.672 0.000 -11.942) 12.058 10.399 ( 3.800 0.000 0.170) 3.804 10.538 ( 3.992 0.000 -6.394) 7.538 10.729 ( 4.092 0.000 2.297) 4.693 10.803 ( 3.235 0.000 -5.557) 6.430 11.558 ( -3.187 0.000 3.950) 5.075 11.588 ( -3.949 0.000 -0.705) 4.012 12.090 ( -2.698 0.000 -1.729) 3.204 12.107 ( 2.092 0.000 1.916) 2.837 13.248 ( -3.807 0.000 -3.426) 5.122 13.285 ( 2.306 0.000 4.265) 4.848 13.392 ( -2.473 0.000 5.328) 5.874 13.643 ( 4.145 0.000 -5.765) 7.101 14.240 ( -3.366 0.000 3.564) 4.902 14.339 ( 0.072 0.000 -2.428) 2.429 14.691 ( -4.045 0.000 -1.604) 4.352 14.793 ( 4.021 0.000 1.654) 4.348 ======================= Grid point 376 (188/260) ======================= q-point: (-0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.787 ( -44.504 0.000 20.913) 49.173 4.208 ( -38.746 0.000 28.625) 48.173 5.539 ( -12.104 0.000 -16.453) 20.425 5.702 ( -28.116 0.000 38.881) 47.981 5.785 ( -7.895 0.000 4.748) 9.212 6.298 ( 11.530 0.000 2.847) 11.876 6.922 ( -19.770 0.000 3.065) 20.006 7.261 ( 18.373 0.000 -13.619) 22.870 7.625 ( -10.758 0.000 8.366) 13.628 7.786 ( -13.485 0.000 30.278) 33.145 8.064 ( 2.267 0.000 -5.556) 6.000 8.181 ( 0.124 0.000 4.754) 4.756 8.730 ( -4.016 0.000 -3.159) 5.110 8.738 ( 12.813 0.000 -1.355) 12.884 9.020 ( 17.974 0.000 -10.708) 20.922 9.051 ( 5.036 0.000 -10.398) 11.554 9.106 ( 1.928 0.000 -12.295) 12.446 9.459 ( 10.431 0.000 -16.110) 19.192 10.110 ( 2.404 0.000 12.396) 12.627 10.243 ( 16.386 0.000 -5.846) 17.398 10.526 ( 5.254 0.000 5.914) 7.911 10.619 ( 6.747 0.000 -4.102) 7.896 10.820 ( 4.077 0.000 0.321) 4.089 10.855 ( 7.529 0.000 -1.935) 7.774 11.507 ( -4.128 0.000 0.157) 4.131 11.528 ( -4.014 0.000 5.519) 6.825 12.015 ( -4.146 0.000 -1.322) 4.352 12.175 ( 3.286 0.000 2.412) 4.076 13.163 ( -2.541 0.000 -2.840) 3.811 13.318 ( -2.866 0.000 4.351) 5.210 13.433 ( 1.602 0.000 6.171) 6.375 13.691 ( 5.955 0.000 -4.419) 7.416 14.176 ( -6.255 0.000 2.590) 6.771 14.301 ( -0.744 0.000 -4.807) 4.864 14.594 ( -4.540 0.000 -2.625) 5.244 14.840 ( 0.629 0.000 -1.800) 1.907 ======================= Grid point 377 (189/260) ======================= q-point: (-0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 260 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.132 ( -45.342 0.000 25.528) 52.034 3.797 ( -33.433 0.000 32.521) 46.641 5.185 ( -8.967 0.000 -18.869) 20.892 5.328 ( -35.976 0.000 -6.432) 36.547 5.658 ( -18.749 0.000 51.093) 54.424 6.556 ( 13.491 0.000 4.421) 14.197 6.842 ( -1.980 0.000 15.739) 15.863 7.406 ( 3.513 0.000 -2.924) 4.570 7.530 ( -8.199 0.000 9.814) 12.788 7.803 ( -4.411 0.000 15.087) 15.719 8.097 ( 6.479 0.000 -5.614) 8.573 8.205 ( -1.031 0.000 -1.135) 1.534 8.643 ( -2.991 0.000 1.439) 3.319 8.907 ( 11.455 0.000 -22.146) 24.933 8.966 ( -2.009 0.000 -3.802) 4.300 8.971 ( -1.546 0.000 -17.252) 17.321 9.280 ( 18.623 0.000 -6.622) 19.765 9.566 ( 10.350 0.000 -4.602) 11.327 10.271 ( 2.436 0.000 14.613) 14.815 10.587 ( 21.668 0.000 -4.859) 22.206 10.608 ( -2.242 0.000 2.179) 3.126 10.639 ( 2.732 0.000 -10.128) 10.490 10.889 ( 4.098 0.000 0.706) 4.159 11.068 ( 11.827 0.000 5.293) 12.958 11.468 ( -0.260 0.000 1.427) 1.451 11.542 ( 1.435 0.000 8.786) 8.902 11.914 ( -5.758 0.000 -1.207) 5.883 12.260 ( 3.169 0.000 2.826) 4.247 13.113 ( -0.574 0.000 -2.037) 2.116 13.274 ( -5.459 0.000 4.019) 6.779 13.527 ( 2.413 0.000 6.667) 7.090 13.789 ( 7.997 0.000 -2.755) 8.458 14.068 ( -7.453 0.000 2.366) 7.819 14.237 ( -0.939 0.000 -6.605) 6.671 14.486 ( -4.354 0.000 -3.499) 5.586 14.775 ( -4.852 0.000 -4.377) 6.535 ======================= Grid point 378 (190/260) ======================= q-point: (-0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.715 ( -21.848 0.000 31.414) 38.265 3.557 ( -23.307 0.000 35.126) 42.155 4.580 ( -32.449 0.000 -14.418) 35.508 4.915 ( -2.047 0.000 -20.886) 20.986 5.847 ( -11.147 0.000 57.277) 58.351 6.777 ( 0.426 0.000 12.639) 12.647 7.029 ( 7.726 0.000 16.224) 17.970 7.334 ( -15.275 0.000 13.740) 20.545 7.490 ( -5.293 0.000 10.209) 11.500 7.876 ( 6.504 0.000 -4.649) 7.995 8.111 ( -2.528 0.000 -10.529) 10.828 8.195 ( 9.058 0.000 -6.860) 11.363 8.661 ( -0.622 0.000 8.473) 8.496 8.694 ( -0.450 0.000 -30.973) 30.977 8.790 ( -1.401 0.000 -18.999) 19.051 9.052 ( 5.739 0.000 -2.646) 6.319 9.590 ( 18.665 0.000 -1.200) 18.703 9.729 ( 7.574 0.000 3.372) 8.291 10.417 ( -3.603 0.000 13.613) 14.082 10.475 ( -6.623 0.000 -3.775) 7.623 10.546 ( -1.876 0.000 -11.902) 12.049 10.856 ( 11.718 0.000 -7.339) 13.827 10.998 ( 5.467 0.000 3.372) 6.424 11.241 ( 3.851 0.000 1.204) 4.035 11.517 ( 3.545 0.000 1.740) 3.949 11.755 ( -2.510 0.000 3.268) 4.121 11.860 ( 14.814 0.000 5.413) 15.772 12.317 ( 0.139 0.000 2.191) 2.196 13.112 ( 2.118 0.000 -1.224) 2.446 13.193 ( -6.529 0.000 3.232) 7.285 13.630 ( 2.522 0.000 7.143) 7.575 13.924 ( 8.137 0.000 -1.934) 8.364 13.960 ( -6.333 0.000 3.114) 7.058 14.158 ( -1.185 0.000 -7.531) 7.624 14.391 ( -2.169 0.000 -3.464) 4.088 14.604 ( -9.294 0.000 -4.013) 10.124 ======================= Grid point 379 (191/260) ======================= q-point: ( 0.00 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.123 ( 17.194 16.835 28.508) 37.306 3.809 ( -8.317 24.464 28.173) 38.228 4.146 ( -11.742 12.759 -15.498) 23.256 4.961 ( 5.790 17.862 -21.370) 28.448 6.255 ( -6.898 7.978 54.918) 55.921 6.798 ( -12.681 -0.134 15.070) 19.695 7.078 ( -1.554 -7.026 16.161) 17.690 7.301 ( -5.680 -2.479 13.229) 14.608 7.463 ( -4.126 -1.270 14.947) 15.557 7.791 ( -0.438 -14.492 -13.391) 19.736 8.012 ( 5.293 5.700 -8.305) 11.379 8.235 ( -5.053 -1.433 -19.900) 20.581 8.469 ( 9.197 -2.201 -13.625) 16.586 8.656 ( 3.276 3.364 -15.814) 16.496 8.739 ( 2.276 -0.059 4.036) 4.633 9.080 ( 0.569 -1.490 -8.597) 8.744 9.718 ( 11.094 -10.043 6.981) 16.513 9.995 ( 5.481 -0.037 8.267) 9.919 10.102 ( -8.873 -3.292 -9.683) 13.539 10.401 ( -5.987 1.869 -10.511) 12.240 10.591 ( -2.630 4.572 8.992) 10.425 10.928 ( 3.031 0.744 -4.117) 5.166 11.097 ( 4.295 -2.795 2.933) 5.904 11.252 ( 3.157 -2.592 -4.865) 6.353 11.628 ( 4.630 1.490 1.357) 5.050 11.659 ( -5.060 0.984 0.673) 5.199 12.172 ( 9.316 -4.956 3.810) 11.219 12.304 ( 0.740 0.180 -2.629) 2.737 13.116 ( -5.171 1.208 2.748) 5.979 13.198 ( 4.846 2.703 -1.207) 5.678 13.731 ( 2.144 -0.580 6.494) 6.863 13.933 ( -4.128 3.044 3.505) 6.212 13.999 ( 0.091 -1.282 -5.589) 5.735 14.088 ( 2.415 1.382 -4.239) 5.071 14.378 ( 0.741 -0.261 -0.996) 1.268 14.396 ( -6.248 -0.270 -1.802) 6.508 ======================= Grid point 380 (192/260) ======================= q-point: ( 0.10 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.843 ( 27.626 12.120 19.117) 35.715 3.951 ( 21.551 14.549 -10.890) 28.190 4.102 ( 6.369 22.417 22.645) 32.494 4.971 ( 15.078 16.878 -21.413) 31.156 6.495 ( -17.693 -1.145 33.475) 37.880 6.730 ( -6.667 5.058 32.681) 33.735 6.976 ( -20.607 12.263 15.338) 28.465 7.386 ( 1.586 -9.597 10.461) 14.285 7.593 ( 4.457 -11.537 9.340) 15.499 7.686 ( 1.715 -14.578 -14.029) 20.304 7.975 ( -4.169 -1.669 -14.578) 15.254 8.024 ( 1.862 4.754 -4.887) 7.067 8.445 ( 1.654 0.006 -13.412) 13.514 8.702 ( 15.019 5.165 -17.631) 23.729 8.813 ( 0.517 0.296 5.844) 5.874 8.995 ( -2.657 -3.171 -5.973) 7.266 9.773 ( -13.621 -1.227 -11.166) 17.655 9.929 ( 4.399 -8.327 9.185) 13.155 10.116 ( -7.943 2.343 -6.151) 10.316 10.263 ( 5.514 -2.066 2.803) 6.521 10.586 ( -5.389 4.411 6.380) 9.445 10.920 ( 0.954 2.121 -4.664) 5.212 11.164 ( -0.560 -4.214 -1.731) 4.590 11.237 ( 2.182 -1.386 -5.184) 5.793 11.592 ( -2.051 0.881 -0.292) 2.251 11.736 ( 5.413 1.360 1.354) 5.743 12.085 ( -10.136 -2.103 -3.908) 11.065 12.417 ( 6.336 -2.011 -3.816) 7.665 13.054 ( -3.325 0.688 2.061) 3.972 13.300 ( 6.673 2.003 -0.975) 7.035 13.795 ( -2.164 -1.103 5.034) 5.590 13.876 ( -3.158 -1.506 -2.375) 4.228 13.924 ( -2.674 1.317 0.012) 2.981 14.117 ( 3.321 2.926 -3.414) 5.589 14.279 ( -2.532 0.958 2.258) 3.525 14.488 ( 6.958 -0.914 1.329) 7.143 ======================= Grid point 381 (193/260) ======================= q-point: ( 0.20 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.223 ( 33.527 8.629 -20.991) 40.487 4.363 ( 9.786 17.465 25.016) 32.041 4.830 ( 35.878 14.844 13.958) 41.260 5.181 ( 27.251 13.036 -13.647) 33.148 6.248 ( -25.200 -4.053 14.772) 29.491 6.659 ( -25.694 13.382 12.138) 31.410 7.021 ( -0.150 6.624 38.212) 38.782 7.428 ( 0.909 -6.868 -9.400) 11.677 7.623 ( 0.869 -8.581 -6.549) 10.829 7.728 ( 5.213 -14.051 5.857) 16.090 7.862 ( -1.855 -2.357 -2.823) 4.119 8.070 ( 2.186 -0.819 8.888) 9.189 8.384 ( 3.616 1.742 -10.132) 10.898 8.773 ( -1.602 -6.075 -8.415) 10.502 8.845 ( 8.972 5.106 -9.047) 13.727 8.948 ( 0.727 4.439 1.548) 4.757 9.427 ( -12.190 0.979 -13.631) 18.313 9.794 ( -15.410 2.830 -9.940) 18.554 10.063 ( -1.043 -6.911 11.001) 13.034 10.344 ( -6.040 -3.725 3.512) 7.918 10.568 ( 2.457 3.782 3.266) 5.569 10.891 ( 0.980 2.428 -7.068) 7.537 11.057 ( -4.388 -1.889 -6.972) 8.452 11.234 ( -1.238 -2.433 -3.760) 4.647 11.555 ( -1.085 -0.516 -2.591) 2.856 11.833 ( -0.675 -1.766 -2.895) 3.458 11.869 ( -2.361 1.668 -1.916) 3.468 12.421 ( -0.898 -0.839 -5.228) 5.370 13.033 ( -0.771 -0.230 1.688) 1.870 13.408 ( 5.900 0.825 -1.680) 6.189 13.703 ( -8.068 -0.998 1.001) 8.191 13.774 ( -4.125 -1.660 -5.013) 6.701 13.963 ( 2.211 0.887 6.118) 6.565 14.156 ( 3.563 2.418 -1.690) 4.626 14.331 ( 3.656 2.148 4.723) 6.347 14.628 ( 6.122 -1.228 2.403) 6.691 ======================= Grid point 382 (194/260) ======================= q-point: ( 0.30 0.11 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.710 ( 36.186 5.126 -20.689) 41.997 4.779 ( 13.839 14.602 23.225) 30.727 5.291 ( 17.701 13.203 -6.132) 22.918 5.750 ( 11.973 6.665 9.208) 16.510 5.934 ( -7.492 -2.750 9.438) 12.360 6.276 ( -24.376 10.470 12.003) 29.119 7.267 ( 2.943 0.521 1.937) 3.562 7.369 ( 6.008 -3.654 -11.279) 13.291 7.612 ( -1.727 2.758 18.713) 18.994 7.802 ( -4.484 -0.552 3.130) 5.496 7.928 ( 8.909 -9.528 6.565) 14.603 8.186 ( 3.281 -6.661 2.659) 7.887 8.437 ( 5.225 -4.156 2.385) 7.090 8.609 ( -10.016 -4.665 -0.657) 11.069 8.916 ( 9.158 4.549 -18.856) 21.451 8.989 ( -0.768 9.282 5.518) 10.826 9.135 ( -6.609 1.268 -10.804) 12.728 9.398 ( -18.195 2.168 -8.624) 20.252 10.018 ( -12.348 -1.330 4.285) 13.138 10.255 ( -0.846 -5.940 1.795) 6.263 10.638 ( 1.653 1.767 -3.034) 3.881 10.836 ( 0.539 1.250 -7.741) 7.859 10.923 ( -4.747 -0.322 -5.031) 6.924 11.088 ( -8.233 -0.258 -8.959) 12.170 11.518 ( -0.017 -3.208 -2.348) 3.975 11.721 ( -1.096 -0.467 -4.795) 4.941 11.952 ( 3.885 1.032 1.959) 4.471 12.327 ( -3.966 -0.666 -5.016) 6.429 13.052 ( 1.101 -0.624 1.973) 2.344 13.470 ( 2.428 -0.874 -3.017) 3.970 13.566 ( -7.473 -0.465 1.494) 7.635 13.671 ( -1.887 -0.738 -5.091) 5.479 14.064 ( 3.011 0.221 5.971) 6.691 14.219 ( 3.694 1.458 0.359) 3.987 14.455 ( 4.853 2.539 5.136) 7.509 14.737 ( 3.406 -0.988 2.376) 4.269 ======================= Grid point 383 (195/260) ======================= q-point: ( 0.40 0.11 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.128 ( 21.235 8.017 -5.351) 23.320 5.249 ( 21.913 6.384 7.502) 24.025 5.292 ( -26.061 2.223 17.899) 31.693 5.696 ( -4.844 6.862 -0.230) 8.403 5.795 ( -8.307 5.483 -3.523) 10.559 6.380 ( 8.778 4.221 10.081) 14.018 7.157 ( -9.334 0.692 -3.123) 9.867 7.458 ( 12.193 -1.363 -8.426) 14.883 7.763 ( -6.940 0.841 12.896) 14.669 7.954 ( 16.686 4.619 15.549) 23.271 8.103 ( 5.960 -2.088 2.507) 6.794 8.232 ( 1.519 -9.122 -3.462) 9.875 8.425 ( -4.298 -0.447 -2.601) 5.044 8.541 ( -3.946 -7.291 7.721) 11.329 8.828 ( -9.064 4.048 -5.404) 11.303 8.893 ( -3.326 3.988 -5.371) 7.471 9.004 ( -9.311 -0.040 -4.327) 10.268 9.187 ( 8.425 5.697 -5.577) 11.599 9.844 ( -5.153 1.286 0.134) 5.313 10.279 ( 1.317 -8.293 -2.114) 8.658 10.555 ( -1.991 2.518 -10.980) 11.440 10.751 ( -7.175 0.399 -9.301) 11.753 10.817 ( -0.223 -0.509 -1.657) 1.748 10.870 ( -5.298 3.645 -8.052) 10.305 11.518 ( 0.505 -4.379 0.370) 4.423 11.684 ( -0.082 -0.365 -3.445) 3.465 12.025 ( 2.422 0.876 1.710) 3.092 12.217 ( -3.514 -1.060 -3.671) 5.192 13.104 ( 2.430 -0.953 2.658) 3.725 13.432 ( -2.901 -2.104 -4.130) 5.468 13.469 ( -5.121 0.068 3.182) 6.030 13.632 ( 2.057 0.161 -5.616) 5.983 14.164 ( 2.548 -0.210 5.174) 5.771 14.285 ( 2.674 0.215 0.871) 2.821 14.584 ( 4.603 2.479 4.921) 7.180 14.786 ( 0.156 -0.269 1.422) 1.456 ======================= Grid point 384 (196/260) ======================= q-point: (-0.50 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.883 ( -32.454 3.304 17.990) 37.254 5.201 ( -30.811 3.079 17.702) 35.668 5.490 ( 11.892 2.603 -6.336) 13.724 5.683 ( 17.104 5.425 10.844) 20.966 5.924 ( 8.629 8.309 -5.177) 13.050 6.448 ( 0.925 5.671 -13.459) 14.635 6.970 ( -14.390 1.518 14.581) 20.542 7.594 ( 4.820 0.532 -5.680) 7.469 7.768 ( -9.311 2.418 23.666) 25.547 8.062 ( -5.315 -3.455 -1.453) 6.504 8.146 ( -4.524 -5.669 -2.060) 7.540 8.335 ( -2.132 2.702 -0.093) 3.443 8.407 ( -6.184 3.058 -0.989) 6.969 8.491 ( 13.483 -0.229 -6.748) 15.079 8.639 ( -0.456 -1.019 7.022) 7.110 8.899 ( 4.862 1.038 3.941) 6.344 8.930 ( 4.558 -4.318 -8.949) 10.932 9.337 ( 12.177 5.084 -7.854) 15.356 9.854 ( 3.075 0.352 3.796) 4.897 10.214 ( -1.298 -6.509 -12.523) 14.173 10.463 ( 0.347 2.854 -6.962) 7.533 10.546 ( -4.798 -2.244 -7.687) 9.335 10.759 ( -1.337 4.864 -3.288) 6.022 10.815 ( 1.785 1.287 -3.279) 3.949 11.526 ( -1.318 -4.160 2.748) 5.157 11.646 ( -1.349 -0.826 -2.764) 3.184 12.066 ( 0.064 0.018 1.816) 1.818 12.150 ( -0.752 -0.251 -2.416) 2.543 13.181 ( 3.094 -1.358 3.401) 4.794 13.332 ( -3.839 -1.808 -3.795) 5.693 13.421 ( -3.581 0.610 4.137) 5.505 13.632 ( 3.185 0.240 -6.058) 6.848 14.235 ( 0.644 -0.078 4.166) 4.216 14.323 ( 1.200 -0.990 -0.322) 1.589 14.700 ( 3.723 1.537 3.990) 5.669 14.771 ( -2.095 0.824 0.071) 2.253 ======================= Grid point 385 (197/260) ======================= q-point: (-0.40 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.410 ( -36.615 4.640 17.572) 40.878 4.729 ( -36.835 3.201 25.884) 45.133 5.696 ( 11.317 1.642 -2.463) 11.698 5.901 ( -7.424 8.684 0.315) 11.429 6.045 ( 10.817 4.125 12.741) 17.215 6.223 ( -16.456 15.568 -2.944) 22.844 6.943 ( 3.968 -7.855 0.872) 8.843 7.421 ( -18.521 3.201 -4.344) 19.292 7.809 ( -9.916 4.230 25.283) 27.486 7.860 ( -14.153 3.694 7.692) 16.526 8.062 ( -2.375 -3.926 -4.223) 6.236 8.198 ( -6.043 1.758 1.021) 6.376 8.435 ( 11.953 -4.806 -1.612) 12.984 8.696 ( 8.993 -9.697 -4.123) 13.853 8.759 ( 4.882 -0.143 -1.981) 5.271 8.980 ( 11.522 -1.948 -10.507) 15.715 9.075 ( 7.827 3.370 0.414) 8.531 9.473 ( 12.209 5.269 -14.075) 19.363 9.963 ( 2.942 -1.509 7.104) 7.836 10.099 ( 2.518 -4.556 -11.909) 12.997 10.433 ( 1.560 1.530 -2.901) 3.632 10.504 ( 4.838 -1.717 -1.904) 5.475 10.769 ( 3.128 3.157 0.036) 4.444 10.834 ( 3.773 2.600 -4.095) 6.145 11.510 ( -3.341 -3.672 3.555) 6.106 11.591 ( -2.651 -0.600 -1.229) 2.983 12.047 ( -2.856 -2.185 0.934) 3.715 12.157 ( 2.444 2.285 -0.674) 3.413 13.236 ( -3.238 -1.066 -3.507) 4.891 13.266 ( 2.457 -1.535 3.917) 4.872 13.406 ( -2.235 1.000 5.117) 5.673 13.649 ( 4.271 0.455 -5.676) 7.118 14.249 ( -2.442 0.764 2.963) 3.915 14.323 ( -0.018 -1.501 -2.379) 2.813 14.700 ( -4.002 0.868 -0.768) 4.167 14.798 ( 2.900 0.574 1.457) 3.296 ======================= Grid point 386 (198/260) ======================= q-point: (-0.30 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.827 ( -43.612 5.058 20.142) 48.304 4.324 ( -33.296 10.369 29.750) 45.839 5.616 ( -12.450 6.658 -8.125) 16.290 5.887 ( -10.857 10.949 16.344) 22.470 5.896 ( -17.475 16.069 10.824) 26.091 6.277 ( 5.822 -0.738 6.736) 8.934 6.912 ( -12.944 -3.239 1.359) 13.412 7.165 ( 5.662 -5.745 -5.865) 9.973 7.694 ( -9.281 5.919 6.774) 12.924 7.864 ( -8.608 6.339 23.750) 26.045 8.004 ( 0.244 -5.352 -4.593) 7.057 8.187 ( 0.300 0.625 5.189) 5.235 8.642 ( 9.384 -7.389 -1.345) 12.020 8.688 ( -0.831 -6.599 -6.439) 9.257 8.867 ( 10.474 -8.958 -6.830) 15.382 9.104 ( -0.888 0.678 -3.542) 3.714 9.141 ( 13.760 5.158 -16.363) 21.993 9.536 ( 9.274 5.359 -14.933) 18.378 10.083 ( 2.885 -2.527 10.435) 11.118 10.191 ( 14.875 -4.720 -4.056) 16.124 10.474 ( 3.932 -2.561 -1.328) 4.877 10.656 ( 8.518 1.760 3.868) 9.519 10.840 ( 4.219 1.516 -0.256) 4.490 10.890 ( 5.933 3.075 -2.653) 7.190 11.471 ( -3.039 -2.506 2.266) 4.545 11.537 ( -3.501 -0.148 2.395) 4.244 11.990 ( -3.874 -1.684 0.313) 4.236 12.213 ( 3.456 2.366 0.662) 4.240 13.159 ( -1.997 -0.179 -3.046) 3.646 13.313 ( -1.516 -0.410 4.096) 4.387 13.438 ( 0.990 0.333 5.730) 5.824 13.701 ( 6.175 0.780 -4.505) 7.683 14.198 ( -5.254 2.026 2.068) 5.999 14.285 ( -0.802 -1.417 -4.538) 4.821 14.606 ( -4.789 1.078 -2.100) 5.339 14.827 ( -0.242 -1.106 -1.528) 1.902 ======================= Grid point 387 (199/260) ======================= q-point: (-0.20 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.218 ( -41.249 9.686 25.466) 49.434 4.007 ( -28.966 18.242 31.289) 46.377 5.264 ( -17.392 6.757 -12.997) 22.739 5.500 ( -25.454 17.271 -10.021) 32.352 5.806 ( -18.346 14.074 43.508) 49.271 6.503 ( 12.692 -5.835 7.537) 15.873 6.843 ( -4.211 0.591 14.562) 15.170 7.253 ( 4.481 -12.264 -1.291) 13.121 7.599 ( -10.270 5.863 11.712) 16.644 7.906 ( -0.979 6.459 7.798) 10.173 7.981 ( -0.007 -7.832 -3.171) 8.450 8.244 ( 2.826 2.562 0.033) 3.815 8.621 ( -1.212 -2.801 -0.103) 3.053 8.707 ( 4.048 -12.650 -15.086) 20.100 8.961 ( -0.172 -0.189 -13.249) 13.251 9.067 ( 7.804 -1.569 -1.678) 8.135 9.210 ( 11.336 0.672 -15.534) 19.242 9.636 ( 9.932 3.572 -3.370) 11.079 10.230 ( 2.310 -4.481 11.371) 12.438 10.463 ( 7.117 -6.255 -0.301) 9.480 10.566 ( 14.977 -1.811 -4.706) 15.803 10.748 ( -0.570 4.379 -2.725) 5.189 10.919 ( 4.624 2.221 -0.036) 5.130 11.049 ( 10.020 -1.681 4.014) 10.924 11.465 ( 0.863 -0.248 2.068) 2.254 11.537 ( 1.226 -0.681 7.159) 7.295 11.910 ( -4.855 -0.019 -0.218) 4.860 12.285 ( 3.037 1.556 1.548) 3.747 13.117 ( -0.097 0.547 -2.264) 2.331 13.287 ( -4.616 1.204 3.731) 6.056 13.524 ( 2.618 -0.345 6.083) 6.631 13.801 ( 8.106 0.914 -2.995) 8.690 14.102 ( -6.770 3.245 2.004) 7.771 14.222 ( -1.028 -1.302 -6.350) 6.563 14.496 ( -4.660 0.901 -3.099) 5.669 14.754 ( -5.148 -1.859 -3.915) 6.729 ======================= Grid point 388 (200/260) ======================= q-point: (-0.10 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.876 ( -18.111 15.974 30.107) 38.595 3.816 ( -20.409 23.143 32.209) 44.604 4.674 ( -29.301 9.157 -14.103) 33.783 5.115 ( -3.938 18.806 -19.794) 27.586 5.954 ( -10.674 10.575 52.542) 54.648 6.794 ( 5.892 -0.815 12.464) 13.810 6.898 ( -2.861 -8.361 17.222) 19.357 7.297 ( -1.058 -9.792 4.980) 11.037 7.504 ( -13.222 6.606 17.579) 22.967 7.912 ( -1.249 -13.413 -9.644) 16.567 7.966 ( 4.284 7.246 -2.741) 8.852 8.304 ( 7.116 5.666 -6.863) 11.395 8.565 ( -0.590 -10.881 -23.633) 26.025 8.650 ( 0.565 -1.812 6.630) 6.896 8.801 ( -0.742 1.079 -17.866) 17.914 9.115 ( 3.900 4.245 -9.698) 11.282 9.429 ( 15.402 -10.471 1.799) 18.711 9.808 ( 8.170 2.654 3.970) 9.463 10.289 ( -3.688 -8.349 -0.365) 9.134 10.488 ( -0.773 2.227 3.648) 4.344 10.635 ( -4.409 3.580 -6.469) 8.609 10.831 ( 11.766 -1.528 -3.383) 12.337 11.004 ( 4.255 0.514 0.717) 4.345 11.202 ( 4.179 -3.299 0.574) 5.355 11.531 ( 3.976 1.136 2.028) 4.605 11.724 ( 2.554 -3.333 5.766) 7.132 11.868 ( 7.818 1.189 3.553) 8.670 12.329 ( 0.099 0.483 0.945) 1.065 13.122 ( 2.122 0.985 -1.026) 2.555 13.217 ( -5.590 2.380 2.584) 6.602 13.628 ( 2.875 -0.374 6.428) 7.052 13.933 ( 7.806 0.564 -2.094) 8.102 14.001 ( -5.882 3.867 2.705) 7.541 14.144 ( -1.237 -1.153 -7.178) 7.375 14.398 ( -2.533 0.612 -3.221) 4.143 14.587 ( -8.923 -1.516 -3.797) 9.815 ======================= Grid point 389 (201/260) ======================= q-point: ( 0.00 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.586 ( 14.334 27.638 24.780) 39.791 4.410 ( -5.847 31.034 6.742) 32.292 4.514 ( -8.609 23.808 3.109) 25.507 5.444 ( 3.747 28.165 -19.565) 34.497 6.487 ( -2.801 11.714 39.066) 40.881 6.703 ( -8.969 -11.089 17.359) 22.467 6.940 ( -2.232 -0.945 20.068) 20.214 7.116 ( 2.584 -11.558 6.217) 13.376 7.387 ( -0.052 -19.671 -9.022) 21.641 7.661 ( -16.349 11.055 14.893) 24.725 8.086 ( -2.715 -8.168 -16.751) 18.833 8.154 ( 0.665 4.620 -7.535) 8.864 8.461 ( 1.084 -1.499 -6.247) 6.515 8.669 ( 6.301 -3.189 4.640) 8.450 8.752 ( 7.276 2.580 -13.159) 15.256 9.027 ( -1.196 -3.085 -15.836) 16.178 9.541 ( 9.661 -6.615 10.025) 15.415 9.932 ( 1.227 -4.534 8.369) 9.597 10.050 ( -2.483 -2.889 -8.478) 9.295 10.429 ( -5.328 0.381 -11.236) 12.441 10.690 ( -1.635 4.801 9.052) 10.376 10.940 ( 3.356 0.213 0.944) 3.493 11.047 ( 2.148 -1.427 -0.811) 2.704 11.196 ( 4.997 -2.783 -6.256) 8.476 11.654 ( 3.063 0.806 1.577) 3.538 11.667 ( -1.651 -0.403 1.915) 2.560 12.075 ( 6.742 -3.969 4.930) 9.247 12.274 ( 0.036 -2.929 -4.046) 4.995 13.153 ( -3.583 2.318 3.267) 5.374 13.272 ( 3.164 4.261 -2.229) 5.756 13.702 ( 2.546 -2.316 4.317) 5.521 13.919 ( -1.560 -4.862 -6.400) 8.188 14.036 ( -4.762 5.337 2.973) 7.746 14.144 ( 4.003 3.826 -2.197) 5.957 14.376 ( -0.211 -0.063 -1.051) 1.074 14.387 ( -4.486 -0.549 -1.904) 4.905 ======================= Grid point 390 (202/260) ======================= q-point: ( 0.10 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.189 ( 25.922 21.029 19.268) 38.541 4.319 ( 13.255 21.943 -19.395) 32.146 4.705 ( 7.157 33.475 26.804) 43.477 5.422 ( 11.900 25.967 -20.256) 35.017 6.515 ( -19.419 2.886 14.844) 24.612 6.827 ( 4.094 -2.237 26.605) 27.011 7.103 ( -3.873 0.240 28.686) 28.948 7.235 ( -1.713 -7.163 6.821) 10.038 7.317 ( 4.263 -20.028 -11.710) 23.588 7.450 ( -14.292 5.312 8.591) 17.501 7.882 ( -5.356 -6.356 -7.792) 11.393 8.128 ( -0.018 5.140 -3.292) 6.104 8.404 ( -0.473 -5.171 -6.201) 8.088 8.745 ( 1.106 -3.439 -9.270) 9.949 8.852 ( 11.936 6.415 -7.823) 15.647 8.925 ( 2.357 -4.181 -5.347) 7.186 9.740 ( -1.634 -5.189 0.344) 5.451 9.784 ( -2.564 -1.428 -4.214) 5.135 10.120 ( -1.613 -3.484 5.965) 7.093 10.226 ( -3.489 -0.811 -6.631) 7.537 10.694 ( -4.456 5.994 5.554) 9.308 10.970 ( 0.686 2.372 -2.010) 3.184 11.073 ( -0.008 -4.249 -0.941) 4.352 11.193 ( 2.416 -2.663 -8.671) 9.387 11.612 ( -2.761 1.030 0.243) 2.957 11.754 ( 4.551 0.133 0.521) 4.582 12.038 ( -8.232 -2.104 -2.357) 8.818 12.340 ( 6.471 -5.472 -3.294) 9.092 13.094 ( -4.371 3.286 2.367) 5.959 13.345 ( 5.321 2.105 -1.383) 5.887 13.749 ( -2.212 -3.527 3.035) 5.152 13.810 ( -3.512 -4.753 -5.326) 7.956 13.984 ( -3.040 4.427 3.065) 6.183 14.197 ( 2.887 4.531 -2.575) 5.958 14.306 ( -0.348 1.661 2.306) 2.863 14.465 ( 6.369 -1.143 0.973) 6.544 ======================= Grid point 391 (203/260) ======================= q-point: ( 0.20 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.493 ( 27.256 17.758 -21.921) 39.227 4.777 ( 15.060 21.205 20.429) 33.073 5.239 ( 25.806 24.063 22.174) 41.673 5.534 ( 18.655 20.433 -18.547) 33.309 6.230 ( -21.232 2.364 8.141) 22.862 6.894 ( -22.781 5.754 3.632) 23.776 7.131 ( 3.786 -7.888 8.897) 12.478 7.274 ( 2.918 2.521 3.518) 5.220 7.406 ( 5.018 -12.112 9.307) 16.078 7.460 ( 1.680 -6.764 17.266) 18.620 7.790 ( -2.341 -3.837 1.440) 4.720 8.102 ( -3.237 2.893 5.023) 6.639 8.354 ( 0.355 -4.966 -5.231) 7.222 8.628 ( -3.585 -5.775 -8.564) 10.933 8.940 ( 7.511 0.221 -11.098) 13.403 9.038 ( 8.119 5.517 1.752) 9.971 9.463 ( -8.488 2.601 -17.815) 19.904 9.859 ( -12.491 2.763 -5.997) 14.129 9.906 ( -1.885 -6.627 7.476) 10.166 10.277 ( -2.360 -3.364 5.505) 6.870 10.655 ( -1.287 4.900 2.144) 5.501 10.934 ( -1.212 1.405 -6.881) 7.127 11.008 ( -3.217 -2.596 -3.735) 5.571 11.167 ( 0.664 -4.020 -6.517) 7.686 11.549 ( -3.975 -0.029 -2.179) 4.533 11.785 ( -1.570 -2.442 -5.717) 6.412 11.910 ( -0.373 1.904 1.009) 2.187 12.365 ( -0.106 -5.013 -4.610) 6.811 13.051 ( -2.119 2.331 2.054) 3.760 13.420 ( 3.836 0.208 -1.672) 4.190 13.655 ( -6.266 -4.005 -1.234) 7.538 13.721 ( -4.221 -3.469 -1.878) 5.777 14.005 ( 1.636 3.457 4.175) 5.662 14.218 ( 2.000 3.279 -1.079) 3.989 14.390 ( 4.831 3.491 4.212) 7.298 14.599 ( 6.205 -1.376 2.361) 6.780 ======================= Grid point 392 (204/260) ======================= q-point: ( 0.30 0.22 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.867 ( 32.080 11.190 -21.795) 40.365 5.178 ( 11.950 22.048 18.852) 31.373 5.590 ( -0.001 14.334 2.964) 14.637 5.923 ( 1.447 1.468 -3.725) 4.258 5.948 ( 8.715 12.614 8.068) 17.325 6.471 ( -21.855 7.160 5.724) 23.700 7.184 ( 4.840 -6.820 -8.252) 11.749 7.345 ( 3.148 -0.491 -2.610) 4.119 7.664 ( 11.250 -13.708 10.242) 20.479 7.714 ( 5.354 5.443 27.313) 28.360 7.782 ( 0.256 -1.045 0.803) 1.342 8.105 ( -4.046 -0.698 11.197) 11.926 8.334 ( 0.263 -5.741 -0.952) 5.826 8.503 ( -4.413 -4.120 -2.307) 6.462 8.955 ( 4.620 -1.651 -12.369) 13.307 9.177 ( -6.471 3.684 -16.160) 17.793 9.201 ( 7.287 9.470 2.279) 12.165 9.476 ( -19.783 5.125 -6.171) 21.347 9.951 ( -4.408 -4.657 6.522) 9.146 10.185 ( -4.461 -0.243 -3.823) 5.880 10.687 ( 1.321 2.921 -1.847) 3.699 10.821 ( -2.381 -2.704 -6.331) 7.285 10.926 ( -3.810 0.385 -3.176) 4.975 11.070 ( -3.971 -1.678 -9.136) 10.102 11.445 ( -3.442 -3.241 -2.605) 5.398 11.709 ( 0.056 -0.817 -5.749) 5.807 11.967 ( 2.900 0.235 1.918) 3.485 12.279 ( -4.250 -4.376 -4.465) 7.560 13.052 ( 0.145 0.961 2.136) 2.346 13.440 ( 0.212 -1.922 -3.261) 3.792 13.538 ( -6.178 -2.600 1.305) 6.829 13.642 ( -1.236 -2.328 -3.524) 4.401 14.085 ( 2.868 2.087 4.116) 5.433 14.255 ( 2.098 1.869 0.364) 2.833 14.523 ( 5.226 3.949 4.740) 8.086 14.717 ( 4.032 -0.837 2.755) 4.955 ======================= Grid point 393 (205/260) ======================= q-point: ( 0.40 0.22 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.244 ( 26.844 5.362 -19.843) 33.809 5.367 ( -26.882 5.123 16.587) 32.000 5.530 ( 9.984 17.745 11.927) 23.597 5.829 ( -26.459 5.276 9.214) 28.510 5.938 ( 15.268 7.849 -17.006) 24.165 6.502 ( 5.236 7.704 10.776) 14.243 7.166 ( -5.023 0.041 0.455) 5.044 7.422 ( 11.374 -2.029 -5.743) 12.902 7.785 ( -4.405 -0.083 12.824) 13.560 7.925 ( 7.964 -9.532 4.377) 13.170 8.005 ( 2.790 -7.111 2.787) 8.131 8.210 ( 12.881 9.348 10.203) 18.905 8.326 ( -0.865 -8.268 -0.028) 8.313 8.466 ( -3.051 0.283 9.456) 9.940 8.869 ( -9.558 0.192 -7.135) 11.929 8.960 ( 0.929 6.023 -14.920) 16.116 9.103 ( -14.423 5.629 -2.362) 15.661 9.336 ( 4.786 8.820 2.466) 10.333 9.864 ( -4.099 0.544 -0.139) 4.138 10.136 ( 2.397 -4.444 -7.214) 8.805 10.595 ( -2.626 1.274 -10.649) 11.042 10.756 ( -7.921 -0.284 -7.013) 10.583 10.814 ( 0.636 0.553 -1.212) 1.476 10.933 ( -2.986 2.093 -5.774) 6.830 11.406 ( -0.337 -6.083 0.518) 6.114 11.668 ( 0.059 -1.444 -5.684) 5.865 12.028 ( 1.989 -0.922 1.562) 2.692 12.167 ( -3.863 -4.091 -2.763) 6.268 13.089 ( 1.785 -0.187 2.393) 2.991 13.378 ( -2.684 -2.937 -4.474) 5.987 13.461 ( -4.652 -1.172 3.597) 5.996 13.618 ( 2.002 -1.858 -4.831) 5.550 14.169 ( 2.694 0.983 3.445) 4.482 14.290 ( 1.197 0.304 0.401) 1.298 14.650 ( 4.128 3.757 4.771) 7.344 14.786 ( 1.102 0.295 2.224) 2.499 ======================= Grid point 394 (206/260) ======================= q-point: (-0.50 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.985 ( -28.895 6.549 15.554) 33.462 5.290 ( -33.043 5.628 14.519) 36.528 5.501 ( 17.004 -0.597 -14.855) 22.586 5.907 ( 13.641 13.560 9.061) 21.261 6.092 ( 9.504 7.488 -5.799) 13.417 6.577 ( 2.015 7.171 -5.489) 9.253 7.024 ( -16.452 3.832 13.324) 21.515 7.592 ( 9.459 -1.536 -7.708) 12.298 7.831 ( -6.303 2.030 21.873) 22.854 7.957 ( -4.260 -6.291 0.129) 7.599 8.025 ( 1.802 -6.110 -1.524) 6.550 8.307 ( -4.008 -8.817 1.172) 9.756 8.435 ( -7.117 3.588 1.249) 8.068 8.523 ( 3.278 5.782 1.425) 6.797 8.627 ( -0.888 -1.208 -0.506) 1.583 8.910 ( 3.228 4.848 -9.860) 11.452 9.023 ( 5.286 9.235 6.654) 12.550 9.436 ( 6.822 4.170 -1.674) 8.169 9.861 ( 2.872 0.422 -0.219) 2.911 10.097 ( 2.296 -4.230 -13.246) 14.093 10.480 ( -2.201 -0.463 -5.382) 5.833 10.550 ( -4.221 1.652 -9.603) 10.619 10.827 ( 0.842 2.248 -0.874) 2.555 10.865 ( 0.178 2.906 -3.178) 4.310 11.418 ( -0.604 -6.242 3.034) 6.966 11.610 ( -0.868 -2.875 -5.685) 6.429 12.043 ( -2.665 -2.462 2.181) 4.234 12.127 ( 2.063 -2.312 -1.886) 3.628 13.153 ( 2.738 -1.097 2.684) 3.988 13.291 ( -2.490 -2.003 -4.127) 5.220 13.423 ( -3.128 -0.722 4.155) 5.251 13.623 ( 3.255 -1.525 -5.492) 6.564 14.236 ( 1.708 0.401 2.634) 3.165 14.302 ( 0.242 -0.880 -0.713) 1.158 14.743 ( 1.267 2.536 4.141) 5.018 14.798 ( -0.629 1.737 1.073) 2.137 ======================= Grid point 395 (207/260) ======================= q-point: (-0.40 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.548 ( -33.523 8.888 14.184) 37.470 4.855 ( -30.759 9.355 25.308) 40.916 5.677 ( 12.439 -4.337 -6.258) 14.584 6.090 ( -7.968 10.599 2.119) 13.428 6.224 ( 13.412 9.801 4.509) 17.212 6.562 ( 4.218 12.315 -13.621) 18.841 6.803 ( -20.390 0.298 18.382) 27.455 7.499 ( -13.864 3.570 -4.799) 15.099 7.896 ( -6.800 -1.793 5.708) 9.058 7.918 ( -3.267 4.245 16.916) 17.743 7.988 ( -3.373 -1.024 1.217) 3.729 8.213 ( -8.930 -2.068 3.077) 9.669 8.327 ( 6.890 -4.696 -8.166) 11.671 8.493 ( -0.399 -6.825 1.387) 6.976 8.706 ( 1.437 -4.022 -0.040) 4.271 9.029 ( 16.491 6.009 -9.455) 19.936 9.170 ( 1.261 6.349 5.427) 8.448 9.568 ( 9.925 3.040 -7.008) 12.525 9.929 ( 4.016 -1.473 1.069) 4.409 10.022 ( 3.766 -2.382 -13.618) 14.328 10.418 ( -0.739 -1.569 -1.525) 2.310 10.512 ( 4.975 1.215 -1.089) 5.235 10.840 ( 2.249 3.623 -1.148) 4.416 10.888 ( 3.899 2.361 -2.262) 5.089 11.421 ( -2.015 -5.013 3.335) 6.349 11.553 ( -0.972 -3.302 -3.717) 5.066 12.002 ( -3.147 -2.330 2.027) 4.409 12.171 ( 3.558 -1.240 -1.331) 3.996 13.198 ( -1.295 -2.502 -0.891) 2.955 13.254 ( 2.788 0.580 -0.104) 2.850 13.414 ( -2.020 -0.628 4.699) 5.154 13.649 ( 4.723 -0.930 -5.500) 7.309 14.267 ( -0.429 0.999 1.434) 1.800 14.290 ( -0.155 -1.344 -2.023) 2.434 14.728 ( -4.279 1.862 1.015) 4.776 14.817 ( 0.503 1.208 1.240) 1.803 ======================= Grid point 396 (208/260) ======================= q-point: (-0.30 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.021 ( -37.504 14.055 18.309) 44.037 4.589 ( -24.610 15.273 30.111) 41.780 5.772 ( -6.389 5.277 -2.968) 8.802 5.969 ( 2.511 0.200 1.349) 2.858 6.368 ( -12.632 21.757 1.694) 25.216 6.431 ( -10.445 21.022 16.236) 28.542 6.688 ( 0.320 -16.985 -1.386) 17.044 7.176 ( -14.301 5.698 2.586) 15.610 7.776 ( -9.496 -5.779 3.688) 11.712 7.880 ( -3.804 3.353 -2.077) 5.480 8.038 ( -2.565 7.505 15.773) 17.655 8.187 ( 2.627 -2.171 3.656) 4.998 8.452 ( 9.310 -10.731 -7.575) 16.100 8.495 ( 0.979 -9.103 -3.368) 9.755 8.734 ( 5.045 -4.247 -0.644) 6.626 9.138 ( -6.664 2.710 1.925) 7.448 9.262 ( 15.255 6.153 -10.173) 19.341 9.598 ( 3.911 -0.223 -13.372) 13.934 10.022 ( 3.492 -2.545 4.417) 6.179 10.106 ( 13.362 -2.790 -2.967) 13.969 10.438 ( 3.080 -1.252 0.400) 3.348 10.679 ( 9.818 0.453 5.286) 11.160 10.875 ( 2.229 1.888 -2.023) 3.553 10.950 ( 4.598 2.378 -2.100) 5.587 11.415 ( -0.435 -2.932 2.186) 3.683 11.511 ( -1.905 -2.509 0.006) 3.150 11.965 ( -2.696 -0.657 1.640) 3.223 12.228 ( 3.692 -1.185 -0.825) 3.964 13.153 ( -1.063 -0.647 -2.244) 2.566 13.318 ( 1.933 1.440 1.610) 2.899 13.432 ( -0.072 -1.373 5.025) 5.210 13.709 ( 6.689 -0.426 -4.883) 8.292 14.245 ( -1.620 1.503 -1.486) 2.663 14.260 ( -1.861 0.161 -1.410) 2.340 14.635 ( -5.707 1.747 -0.712) 6.011 14.804 ( -2.427 -0.936 -0.827) 2.730 ======================= Grid point 397 (209/260) ======================= q-point: (-0.20 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.546 ( -31.543 22.189 23.389) 45.104 4.438 ( -20.047 22.740 30.762) 43.190 5.452 ( -19.883 11.731 -9.016) 24.784 5.964 ( -14.847 24.394 -12.468) 31.160 6.133 ( -7.384 9.093 20.143) 23.301 6.383 ( -5.077 3.407 23.018) 23.817 6.784 ( 4.429 -10.779 5.083) 12.714 7.074 ( -4.539 0.346 7.491) 8.766 7.627 ( -8.492 -10.620 0.456) 13.606 7.819 ( -2.770 1.996 1.332) 3.665 8.106 ( -1.240 9.155 8.261) 12.393 8.292 ( 5.978 0.409 0.309) 6.000 8.449 ( 0.794 -10.727 -12.032) 16.139 8.503 ( 3.997 -8.534 -4.597) 10.485 8.926 ( 10.958 -2.964 0.932) 11.390 8.998 ( -6.266 -1.337 1.615) 6.607 9.318 ( 5.593 6.550 -22.364) 23.965 9.631 ( 6.147 -4.567 1.984) 7.911 10.123 ( 3.405 -4.520 2.629) 6.240 10.377 ( 12.240 -3.106 5.400) 13.734 10.533 ( 7.981 -1.129 -1.467) 8.193 10.825 ( 0.283 3.643 -2.711) 4.550 10.934 ( 6.306 -1.757 2.828) 7.131 11.019 ( 5.370 -0.669 -1.018) 5.507 11.458 ( 1.784 -0.534 4.186) 4.582 11.510 ( 2.097 -1.891 2.888) 4.039 11.926 ( -2.734 1.644 0.883) 3.310 12.286 ( 2.729 -1.792 -0.148) 3.268 13.131 ( 0.371 0.597 -1.294) 1.473 13.330 ( -1.814 3.284 1.482) 4.034 13.503 ( 3.023 -2.050 4.674) 5.932 13.809 ( 8.137 -0.657 -4.031) 9.104 14.188 ( -4.324 4.717 0.598) 6.426 14.200 ( -1.465 -0.256 -4.763) 4.990 14.516 ( -5.721 1.030 -1.983) 6.141 14.711 ( -6.025 -2.120 -2.738) 6.950 ======================= Grid point 398 (210/260) ======================= q-point: (-0.10 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.341 ( -11.671 28.739 26.177) 40.588 4.378 ( -13.726 29.840 29.287) 44.006 4.936 ( -23.444 16.156 -13.539) 31.527 5.618 ( -5.904 29.064 -17.988) 34.686 6.244 ( -6.200 13.348 35.542) 38.468 6.578 ( 1.192 -11.515 23.615) 26.300 6.873 ( -1.638 -3.587 9.991) 10.741 7.069 ( -2.765 -6.037 6.949) 9.611 7.486 ( -4.867 -15.717 -4.156) 16.970 7.776 ( -7.963 5.450 9.757) 13.723 8.131 ( 0.829 8.416 -0.834) 8.498 8.311 ( 0.458 -13.290 -19.219) 23.371 8.419 ( 7.727 5.968 -5.318) 11.118 8.556 ( 2.597 -7.724 3.117) 8.725 8.812 ( -4.361 -0.425 -7.301) 8.514 9.185 ( 1.396 2.270 -20.868) 21.037 9.249 ( 13.159 -6.158 7.883) 16.529 9.784 ( 4.738 -4.713 8.639) 10.922 10.153 ( 0.194 -4.746 -4.941) 6.854 10.548 ( -0.185 3.344 4.409) 5.537 10.628 ( 3.346 -3.738 -4.091) 6.474 10.840 ( 5.578 2.137 0.509) 5.995 11.013 ( 3.108 0.239 -1.545) 3.479 11.128 ( 5.489 -3.766 -1.215) 6.767 11.547 ( 4.062 0.053 4.278) 5.900 11.640 ( 4.875 -3.987 5.599) 8.427 11.910 ( 2.310 2.824 1.917) 4.121 12.310 ( -0.051 -2.547 -0.832) 2.680 13.146 ( 1.248 1.206 0.707) 1.874 13.290 ( -2.734 4.674 0.034) 5.416 13.605 ( 3.703 -1.990 4.488) 6.149 13.919 ( 6.507 -2.622 -4.184) 8.168 14.107 ( -5.417 6.051 2.256) 8.430 14.138 ( -0.199 1.375 -5.222) 5.404 14.409 ( -3.395 0.271 -2.481) 4.214 14.551 ( -8.214 -1.788 -3.057) 8.945 ======================= Grid point 399 (211/260) ======================= q-point: ( 0.00 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.194 ( 9.715 31.337 21.189) 39.056 4.944 ( -6.805 23.043 -14.770) 28.204 5.110 ( -1.571 30.877 25.421) 40.027 6.018 ( 1.835 24.793 -18.097) 30.750 6.249 ( 2.526 -21.085 18.858) 28.401 6.706 ( 1.814 -12.026 21.461) 24.667 6.902 ( -10.028 -4.397 5.444) 12.228 6.953 ( -0.980 -8.718 -12.754) 15.480 7.160 ( -0.218 15.706 18.628) 24.367 7.854 ( -8.319 3.609 12.502) 15.445 7.869 ( -2.487 -10.926 -14.714) 18.495 8.233 ( -2.501 -3.988 -4.199) 6.308 8.391 ( -4.870 2.023 4.026) 6.635 8.608 ( 1.843 -1.514 3.287) 4.061 8.806 ( 8.772 2.604 -5.562) 10.708 8.985 ( -3.586 -1.466 -15.942) 16.406 9.454 ( 7.605 -2.254 11.545) 14.007 9.793 ( 2.393 -10.041 15.004) 18.212 10.021 ( -1.348 1.587 -14.448) 14.597 10.398 ( -3.239 -3.704 -13.726) 14.581 10.781 ( 1.535 4.135 9.432) 10.412 10.933 ( 1.722 -0.745 3.205) 3.714 11.041 ( 2.267 0.386 -3.256) 3.986 11.145 ( 5.820 -2.151 -6.885) 9.269 11.645 ( 0.850 -1.300 4.703) 4.953 11.659 ( 2.582 -0.313 2.713) 3.758 12.030 ( 2.859 -0.412 1.997) 3.511 12.199 ( -0.462 -4.153 -4.326) 6.015 13.210 ( -1.177 3.380 3.629) 5.097 13.352 ( 0.634 3.101 -1.873) 3.678 13.641 ( 2.888 -3.342 0.683) 4.470 13.801 ( -1.292 -6.333 -6.940) 9.484 14.153 ( -5.462 5.868 2.394) 8.367 14.229 ( 3.972 4.270 -1.288) 5.973 14.366 ( 1.427 -0.901 -0.615) 1.796 14.379 ( -5.181 -0.534 -1.254) 5.358 ======================= Grid point 400 (212/260) ======================= q-point: ( 0.10 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.656 ( 20.504 24.108 18.907) 36.866 4.816 ( 8.307 25.978 -18.067) 32.715 5.352 ( 4.953 28.509 24.712) 38.053 5.949 ( 7.723 23.678 -19.838) 31.840 6.472 ( 3.785 -15.002 16.209) 22.408 6.669 ( -13.158 1.349 5.910) 14.488 6.823 ( 1.174 -24.537 -12.604) 27.610 7.009 ( 6.173 -13.264 15.684) 21.449 7.353 ( 2.295 17.396 19.430) 26.180 7.619 ( -9.589 1.268 -13.396) 16.523 7.820 ( -9.833 4.415 16.532) 19.735 8.128 ( -4.112 -9.534 -2.895) 10.779 8.330 ( -4.640 4.781 4.111) 7.829 8.687 ( 1.906 -3.381 -1.978) 4.356 8.808 ( -0.030 -5.523 -8.267) 9.942 8.961 ( 10.458 2.753 -5.203) 12.001 9.644 ( 2.163 -2.659 10.715) 11.250 9.825 ( -3.032 4.265 -17.380) 18.151 9.977 ( 2.166 -9.859 14.360) 17.553 10.202 ( -5.053 -2.633 -13.389) 14.551 10.822 ( -2.775 6.331 4.061) 8.017 10.981 ( 0.525 -1.779 1.776) 2.568 11.034 ( -0.013 0.972 -4.252) 4.362 11.137 ( 1.572 -2.647 -10.021) 10.483 11.632 ( -2.753 1.018 1.056) 3.119 11.741 ( 2.923 -1.366 0.198) 3.233 12.010 ( -4.873 -0.444 -1.002) 4.995 12.213 ( 4.305 -6.459 -2.989) 8.318 13.180 ( -4.059 5.050 2.252) 6.859 13.380 ( 3.009 1.322 -0.920) 3.413 13.653 ( -2.856 -5.611 -0.815) 6.349 13.701 ( -2.665 -5.575 -4.174) 7.457 14.090 ( -2.867 5.736 2.489) 6.879 14.277 ( -0.047 2.485 -1.609) 2.961 14.342 ( 3.640 2.084 2.183) 4.729 14.446 ( 5.827 -0.737 1.207) 5.996 ======================= Grid point 401 (213/260) ======================= q-point: ( 0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.919 ( 19.690 23.426 -19.840) 36.471 5.187 ( 18.730 19.137 17.364) 31.914 5.699 ( 10.057 18.191 22.775) 30.834 5.945 ( 9.032 18.569 -20.130) 28.837 6.348 ( -14.662 9.083 0.467) 17.254 6.688 ( -3.652 -21.041 -8.868) 23.124 6.833 ( 11.042 -15.974 9.424) 21.585 7.231 ( 2.713 -7.924 8.593) 11.999 7.368 ( -4.810 2.295 -0.895) 5.404 7.534 ( -0.366 9.026 16.745) 19.026 7.814 ( -2.103 8.421 9.962) 13.212 8.062 ( -0.798 -10.246 -1.742) 10.423 8.295 ( -5.792 4.384 10.522) 12.786 8.592 ( -5.366 2.028 -2.741) 6.357 8.842 ( 5.723 -8.645 -7.028) 12.525 9.117 ( 7.699 0.559 2.779) 8.204 9.540 ( -4.272 5.200 -19.596) 20.719 9.812 ( 1.327 -1.188 6.616) 6.851 9.905 ( -10.353 0.007 -8.015) 13.092 10.177 ( 1.845 -7.068 7.698) 10.612 10.767 ( -3.815 6.017 -0.393) 7.136 10.937 ( -3.876 -0.366 -8.655) 9.490 10.980 ( -1.376 -0.290 -1.181) 1.837 11.080 ( 0.912 -4.259 -7.912) 9.031 11.558 ( -5.310 1.168 -2.202) 5.866 11.741 ( 0.003 -2.025 -6.274) 6.593 11.943 ( -1.465 1.499 1.912) 2.837 12.229 ( -0.276 -7.783 -3.361) 8.483 13.126 ( -3.221 4.800 1.510) 5.975 13.421 ( 1.675 0.037 -0.759) 1.840 13.545 ( -5.128 -6.383 -2.674) 8.613 13.636 ( -3.289 -4.800 -1.041) 5.911 14.097 ( 0.883 5.234 2.638) 5.927 14.269 ( 0.506 1.395 -0.208) 1.498 14.464 ( 6.012 3.541 3.370) 7.748 14.578 ( 6.286 -0.771 2.714) 6.890 ======================= Grid point 402 (214/260) ======================= q-point: ( 0.30 0.33 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.155 ( 23.235 16.640 -20.416) 35.123 5.593 ( 9.137 17.010 14.946) 24.417 5.847 ( -12.868 11.699 8.342) 19.288 5.959 ( 7.766 1.396 -13.940) 16.018 6.194 ( -3.007 7.268 -1.893) 8.090 6.526 ( -3.053 0.215 3.213) 4.438 7.067 ( 6.284 -6.104 2.872) 9.220 7.289 ( 6.909 -2.075 -0.459) 7.228 7.468 ( 3.746 -5.762 10.925) 12.907 7.636 ( -2.051 -6.360 14.754) 16.197 7.895 ( 5.144 4.299 -1.033) 6.783 8.092 ( 5.437 -4.234 -0.290) 6.898 8.290 ( -3.759 4.529 8.656) 10.468 8.516 ( -6.295 7.400 12.907) 16.155 8.861 ( 3.547 -6.877 -6.729) 10.255 9.226 ( -2.216 0.943 -3.220) 4.021 9.374 ( 6.964 6.825 -10.862) 14.596 9.567 ( -16.325 2.875 -7.467) 18.181 9.903 ( -0.180 0.894 4.818) 4.904 10.193 ( -2.718 -0.888 -2.185) 3.599 10.734 ( -0.432 -0.223 2.688) 2.732 10.768 ( -4.357 0.265 -11.273) 12.089 10.926 ( -2.685 -0.468 -3.888) 4.748 11.020 ( -0.829 -2.950 -6.942) 7.588 11.415 ( -5.994 0.759 -4.469) 7.515 11.682 ( 0.418 -2.120 -7.786) 8.080 11.960 ( 0.312 -0.657 2.687) 2.784 12.154 ( -4.226 -7.348 -3.002) 8.993 13.097 ( -1.227 3.509 1.566) 4.034 13.403 ( -2.032 -1.707 -3.962) 4.769 13.459 ( -3.509 -4.753 2.128) 6.280 13.574 ( -1.280 -4.252 -2.649) 5.170 14.149 ( 2.159 3.969 2.394) 5.113 14.284 ( 0.853 0.818 0.247) 1.207 14.603 ( 5.483 3.713 4.272) 7.881 14.706 ( 4.683 -0.298 3.384) 5.785 ======================= Grid point 403 (215/260) ======================= q-point: ( 0.40 0.33 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.375 ( 17.077 7.408 -18.256) 26.072 5.491 ( -21.552 6.605 7.429) 23.734 5.804 ( -14.896 5.073 3.465) 16.113 5.915 ( 7.171 3.114 -13.910) 15.957 6.123 ( 4.020 13.230 9.500) 16.776 6.681 ( 4.586 8.887 11.185) 15.004 7.152 ( 0.357 -1.549 1.385) 2.108 7.381 ( 6.908 -2.115 -3.565) 8.056 7.633 ( 1.215 -11.116 10.484) 15.328 7.739 ( 5.155 -9.708 5.195) 12.158 7.946 ( 0.493 0.942 1.128) 1.550 8.154 ( -2.095 -7.557 2.988) 8.392 8.370 ( 10.271 3.736 -2.337) 11.176 8.579 ( -2.085 9.554 15.506) 18.332 8.912 ( 3.654 5.294 3.807) 7.474 9.087 ( -0.490 5.893 -14.179) 15.362 9.198 ( -16.416 4.106 -3.270) 17.235 9.491 ( 2.184 4.793 5.932) 7.933 9.887 ( -2.345 2.572 -0.444) 3.508 10.112 ( 0.889 0.845 -9.900) 9.976 10.601 ( -3.961 -0.565 -9.088) 9.929 10.733 ( -3.370 -2.037 -5.171) 6.500 10.842 ( -0.056 1.925 -2.122) 2.866 10.950 ( -1.671 -0.354 -3.626) 4.008 11.308 ( -2.130 -2.431 -2.154) 3.884 11.614 ( -0.512 -4.226 -8.982) 9.940 11.986 ( 0.021 -2.845 2.262) 3.634 12.059 ( -3.139 -5.919 -1.273) 6.820 13.107 ( 0.709 2.047 1.750) 2.785 13.321 ( -2.492 -2.625 -3.932) 5.344 13.420 ( -3.393 -2.477 3.054) 5.194 13.551 ( 1.737 -4.531 -4.137) 6.377 14.207 ( 2.150 2.631 1.797) 3.844 14.297 ( 0.347 0.305 -0.080) 0.469 14.725 ( 3.551 3.370 4.540) 6.677 14.796 ( 2.010 0.587 3.121) 3.759 ======================= Grid point 404 (216/260) ======================= q-point: (-0.50 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.137 ( -23.384 8.014 8.138) 26.024 5.423 ( -21.577 6.314 8.616) 24.076 5.483 ( 3.705 -0.017 -9.969) 10.635 6.016 ( 13.518 -4.179 -12.677) 18.997 6.330 ( 2.589 16.781 15.502) 22.991 6.767 ( -0.573 11.206 1.932) 11.385 7.107 ( -6.758 3.717 5.168) 9.284 7.516 ( 10.896 -5.842 -8.286) 14.883 7.687 ( -2.006 -12.055 7.734) 14.463 7.860 ( 5.668 -9.208 -1.583) 10.928 7.964 ( -0.719 2.096 5.990) 6.387 8.122 ( -3.100 -7.247 1.631) 8.049 8.499 ( -2.522 2.468 11.116) 11.663 8.633 ( -2.265 4.411 0.974) 5.053 8.741 ( -14.580 11.346 -4.006) 18.904 9.017 ( 5.726 4.620 -12.573) 14.567 9.244 ( 8.791 10.790 13.432) 19.343 9.509 ( -4.418 3.772 8.198) 10.048 9.876 ( 2.750 1.169 -3.415) 4.538 10.059 ( 3.713 -0.084 -13.649) 14.146 10.473 ( -3.514 -0.017 -5.034) 6.139 10.576 ( -3.018 0.556 -10.428) 10.870 10.870 ( 2.130 1.975 0.449) 2.940 10.907 ( -0.199 1.151 -1.999) 2.315 11.294 ( 0.466 -5.072 1.048) 5.200 11.521 ( -0.855 -6.123 -8.895) 10.832 11.976 ( -2.739 -3.500 2.614) 5.156 12.055 ( 2.982 -4.433 -1.117) 5.458 13.145 ( 1.358 0.380 1.833) 2.312 13.259 ( -0.475 -1.285 -3.591) 3.844 13.392 ( -2.263 -1.841 2.911) 4.121 13.562 ( 3.530 -4.393 -4.830) 7.422 14.256 ( 1.770 1.483 1.147) 2.578 14.295 ( -0.097 0.181 -0.877) 0.900 14.796 ( -0.357 2.514 4.151) 4.866 14.834 ( 0.079 1.492 2.103) 2.580 ======================= Grid point 405 (217/260) ======================= q-point: (-0.40 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.764 ( -26.321 12.178 10.942) 30.998 5.102 ( -23.127 14.677 20.442) 34.178 5.529 ( 5.024 -9.725 -2.224) 11.170 6.147 ( 8.524 -12.636 -6.533) 16.583 6.385 ( -8.487 14.251 8.779) 18.767 6.770 ( 1.318 13.837 0.222) 13.902 7.024 ( -6.001 12.496 3.234) 14.235 7.494 ( -5.941 -4.651 -6.237) 9.789 7.776 ( 4.416 -10.309 -1.389) 11.301 7.913 ( -1.003 -2.545 4.800) 5.525 8.003 ( -3.828 0.102 9.219) 9.982 8.105 ( 4.276 -7.191 -1.762) 8.549 8.367 ( -13.143 11.004 -2.527) 17.327 8.478 ( -6.236 3.657 5.408) 9.028 8.660 ( -2.070 -0.747 1.916) 2.918 9.115 ( 11.086 0.627 -4.433) 11.956 9.353 ( -7.563 10.797 10.361) 16.767 9.594 ( 4.664 0.556 3.205) 5.687 9.914 ( 5.860 0.135 -4.189) 7.204 10.013 ( 4.399 0.975 -13.709) 14.430 10.400 ( -1.277 0.001 -0.489) 1.368 10.523 ( 3.858 -0.400 -2.300) 4.510 10.905 ( 1.879 2.477 -1.573) 3.485 10.924 ( 3.474 1.258 -1.150) 3.870 11.318 ( 0.588 -4.618 1.830) 5.003 11.456 ( 0.839 -6.139 -6.173) 8.747 11.960 ( -1.018 -1.440 2.027) 2.687 12.111 ( 3.909 -4.225 -1.302) 5.901 13.157 ( -0.942 -1.092 0.083) 1.445 13.272 ( 4.087 0.224 -1.353) 4.311 13.386 ( -0.991 -1.112 2.580) 2.979 13.601 ( 5.356 -3.783 -5.225) 8.384 14.280 ( -0.202 0.430 -1.759) 1.822 14.289 ( 0.935 1.047 0.387) 1.456 14.773 ( -4.666 2.422 2.278) 5.729 14.840 ( -1.622 0.802 1.522) 2.364 ======================= Grid point 406 (218/260) ======================= q-point: (-0.30 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.378 ( -27.417 20.512 16.450) 37.987 4.933 ( -17.033 18.523 26.070) 36.234 5.629 ( 2.997 -15.093 7.070) 16.934 6.137 ( -9.062 7.417 -2.010) 11.882 6.289 ( -2.563 -13.895 4.156) 14.728 6.761 ( -3.732 16.096 -3.014) 16.796 6.941 ( -5.860 22.267 2.688) 23.182 7.297 ( -9.484 3.152 -0.834) 10.029 7.620 ( -14.892 -3.160 0.275) 15.226 7.942 ( -10.152 -2.109 9.347) 13.960 8.036 ( 8.208 -8.972 -1.283) 12.228 8.228 ( 10.806 -5.982 -12.657) 17.685 8.240 ( 0.796 8.994 4.111) 9.921 8.425 ( -3.978 -1.409 2.925) 5.135 8.683 ( 3.159 -0.251 5.510) 6.356 9.211 ( -9.923 3.114 7.052) 12.566 9.323 ( 6.162 -0.990 3.218) 7.022 9.574 ( -1.190 -0.097 -12.358) 12.415 10.002 ( 3.979 0.397 -1.097) 4.146 10.075 ( 11.305 -0.478 -2.031) 11.496 10.426 ( 2.951 0.431 2.474) 3.875 10.662 ( 9.111 -2.483 4.031) 10.267 10.915 ( 0.999 1.980 -3.415) 4.072 10.977 ( 3.298 0.198 -1.874) 3.798 11.361 ( 3.070 -2.178 1.589) 4.085 11.439 ( 0.775 -4.171 -1.859) 4.632 11.968 ( 0.071 1.039 1.373) 1.723 12.171 ( 3.780 -4.058 -1.447) 5.732 13.140 ( -0.423 -0.111 -0.229) 0.494 13.354 ( 4.624 -1.754 0.770) 5.005 13.395 ( 0.252 1.359 0.986) 1.698 13.670 ( 7.053 -3.395 -5.366) 9.491 14.255 ( -0.348 1.145 -2.931) 3.166 14.297 ( -0.359 1.575 -0.049) 1.617 14.677 ( -6.983 2.393 0.787) 7.423 14.789 ( -4.650 -0.682 0.049) 4.700 ======================= Grid point 407 (219/260) ======================= q-point: (-0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.078 ( -21.291 29.191 20.655) 41.618 4.899 ( -12.202 22.630 28.787) 38.596 5.647 ( -10.326 -1.806 -0.870) 10.519 5.962 ( -5.239 -1.591 8.789) 10.355 6.305 ( -2.578 -16.681 6.156) 17.966 6.556 ( -9.527 18.458 -8.274) 22.359 6.889 ( -4.154 24.103 9.050) 26.079 7.195 ( -4.968 7.332 4.651) 10.004 7.348 ( -13.155 -9.750 -2.525) 16.568 7.860 ( -6.474 -1.920 9.380) 11.558 8.104 ( 4.607 -14.488 -11.597) 19.121 8.256 ( 4.849 1.466 -8.285) 9.711 8.353 ( 0.219 -1.239 4.862) 5.022 8.416 ( 5.444 2.511 0.009) 5.996 8.882 ( 10.578 -0.957 9.149) 14.019 9.024 ( -14.090 4.465 5.108) 15.638 9.408 ( -2.425 -0.599 -17.308) 17.487 9.486 ( 5.280 -7.214 7.274) 11.526 10.070 ( 4.287 -0.315 -1.730) 4.634 10.315 ( 12.698 -3.212 4.290) 13.783 10.531 ( 4.893 1.113 3.232) 5.969 10.840 ( 3.474 -5.660 -0.845) 6.695 10.908 ( 4.922 2.997 -0.454) 5.780 11.010 ( 2.732 -0.634 -2.712) 3.902 11.441 ( 0.435 -0.987 6.331) 6.422 11.475 ( 6.037 -1.306 -0.865) 6.237 11.975 ( -0.293 3.072 0.516) 3.129 12.220 ( 2.674 -4.266 -1.330) 5.208 13.144 ( 0.701 1.145 0.731) 1.529 13.394 ( -1.255 -0.385 2.209) 2.570 13.458 ( 6.030 0.726 -1.052) 6.164 13.761 ( 7.471 -4.005 -5.512) 10.111 14.219 ( -0.499 2.197 -3.566) 4.218 14.276 ( -1.665 3.231 -0.182) 3.639 14.540 ( -7.826 1.555 -0.391) 7.988 14.674 ( -7.156 -1.613 -1.335) 7.456 ======================= Grid point 408 (220/260) ======================= q-point: (-0.10 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.988 ( -7.335 33.875 22.183) 41.151 4.959 ( -7.566 26.569 28.431) 39.642 5.296 ( -16.516 17.499 -12.177) 26.968 6.067 ( 0.239 -18.120 18.616) 25.980 6.185 ( -4.606 18.526 -14.126) 23.748 6.511 ( 0.152 -9.344 16.052) 18.574 6.934 ( -2.545 20.231 13.817) 24.631 7.101 ( -3.935 -13.810 -12.673) 19.152 7.144 ( -10.483 5.283 11.194) 16.220 7.855 ( -5.070 -0.992 12.620) 13.637 8.024 ( 1.114 -14.023 -17.430) 22.399 8.268 ( 3.439 -3.346 -7.439) 8.852 8.389 ( -1.390 -0.857 7.700) 7.872 8.546 ( 7.242 5.981 -2.020) 9.607 8.820 ( -9.544 3.243 1.620) 10.210 9.150 ( 4.834 -2.702 2.708) 6.164 9.230 ( 2.994 0.251 -9.892) 10.338 9.637 ( 2.559 -9.854 12.084) 15.801 10.101 ( 2.719 0.327 -7.744) 8.214 10.513 ( 4.309 -6.574 -7.813) 11.082 10.629 ( 3.423 3.864 9.665) 10.957 10.866 ( 3.413 -0.755 0.790) 3.583 11.011 ( 3.175 -0.192 -1.118) 3.371 11.063 ( 6.702 -2.176 -3.558) 7.894 11.528 ( 2.728 -1.141 8.382) 8.888 11.591 ( 4.897 -1.234 1.869) 5.385 11.977 ( 0.870 3.630 0.209) 3.739 12.235 ( 0.283 -4.453 -2.064) 4.916 13.176 ( 1.261 2.146 2.267) 3.367 13.376 ( -1.524 2.439 -0.074) 2.877 13.559 ( 5.265 -1.465 0.084) 5.465 13.829 ( 4.529 -5.689 -6.291) 9.616 14.189 ( 0.532 3.647 -2.434) 4.417 14.235 ( -3.017 5.578 0.533) 6.364 14.406 ( -5.121 -0.313 -1.307) 5.294 14.519 ( -7.824 -1.503 -1.818) 8.172 ======================= Grid point 409 (221/260) ======================= q-point: ( 0.00 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.816 ( 4.540 28.679 17.506) 33.905 5.221 ( -1.778 -3.805 4.089) 5.862 5.709 ( -1.181 27.839 15.073) 31.679 5.928 ( 1.745 -1.927 12.168) 12.442 6.177 ( 5.585 -11.202 0.941) 12.553 6.315 ( 0.918 -25.220 1.228) 25.266 6.827 ( -4.119 14.775 -11.108) 18.939 7.038 ( -10.566 -1.271 -7.312) 12.912 7.538 ( 3.229 14.040 5.270) 15.340 7.686 ( -0.276 -6.535 -6.473) 9.203 7.790 ( -2.978 -0.883 10.401) 10.855 8.020 ( 3.214 -13.978 -1.301) 14.401 8.559 ( -3.760 9.603 6.740) 12.320 8.643 ( -8.807 2.448 6.888) 11.446 8.842 ( 1.367 1.593 -2.818) 3.513 8.926 ( -6.064 -4.811 -6.196) 9.915 9.446 ( 6.050 1.959 13.438) 14.867 9.567 ( 2.968 -10.099 16.795) 19.821 10.118 ( 0.764 7.280 -17.193) 18.686 10.279 ( -0.520 -7.666 -16.181) 17.912 10.856 ( 3.325 3.191 6.890) 8.289 10.908 ( 2.419 -1.914 3.668) 4.792 11.061 ( 3.395 1.753 -3.695) 5.316 11.104 ( 4.965 -2.123 -5.230) 7.518 11.631 ( 1.679 0.107 6.001) 6.233 11.645 ( 1.453 -0.969 4.408) 4.741 12.052 ( 0.481 2.360 -1.627) 2.907 12.116 ( -0.298 -3.793 -3.643) 5.268 13.291 ( 0.263 4.502 3.543) 5.735 13.369 ( -0.067 -2.083 2.002) 2.889 13.606 ( 1.595 1.050 -5.145) 5.488 13.679 ( -0.524 -5.344 -7.054) 8.865 14.262 ( -4.347 4.631 1.300) 6.483 14.306 ( 2.618 2.922 -0.867) 4.018 14.336 ( -1.472 -2.169 0.361) 2.646 14.356 ( -1.733 -1.695 -0.697) 2.523 ======================= Grid point 410 (222/260) ======================= q-point: ( 0.10 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.122 ( 13.307 20.003 14.981) 28.313 5.266 ( 7.490 12.109 -5.387) 15.223 5.793 ( 0.623 14.793 10.873) 18.370 6.138 ( 4.717 -14.288 10.230) 18.195 6.238 ( 8.513 1.156 -7.151) 11.178 6.413 ( 5.316 -11.205 -1.464) 12.488 6.743 ( -6.465 3.969 1.837) 7.806 6.818 ( -1.155 -3.583 -1.275) 3.974 7.539 ( -3.963 1.796 -2.482) 5.009 7.652 ( -0.601 -3.762 -0.551) 3.850 7.865 ( 3.340 6.929 4.938) 9.141 8.021 ( -4.299 -2.613 1.708) 5.313 8.487 ( -9.368 7.352 9.510) 15.239 8.593 ( -1.412 -4.352 5.890) 7.458 8.775 ( -3.618 3.717 -1.735) 5.470 8.925 ( 3.671 -6.692 1.845) 7.853 9.642 ( 3.084 2.736 12.541) 13.201 9.766 ( 3.156 -9.336 15.605) 18.456 9.950 ( -1.202 7.612 -19.610) 21.070 10.104 ( -2.474 -6.815 -17.289) 18.747 10.925 ( -0.037 3.124 2.445) 3.967 10.954 ( 0.752 -0.720 1.077) 1.498 11.058 ( 0.236 1.446 -5.921) 6.100 11.094 ( 0.019 -1.774 -8.895) 9.070 11.658 ( -1.784 1.662 2.142) 3.246 11.701 ( 0.721 -2.373 1.759) 3.041 12.027 ( -1.756 2.138 -1.660) 3.227 12.097 ( 1.090 -4.731 -2.775) 5.592 13.292 ( -2.828 5.727 2.088) 6.720 13.383 ( 0.028 -2.061 1.514) 2.558 13.560 ( -2.677 -1.838 -4.481) 5.533 13.597 ( -1.872 -4.296 -4.287) 6.351 14.201 ( -2.373 4.846 1.458) 5.589 14.276 ( -2.069 -2.258 0.290) 3.076 14.394 ( 5.757 2.500 1.313) 6.412 14.430 ( 5.614 -1.068 1.447) 5.895 ======================= Grid point 411 (223/260) ======================= q-point: ( 0.20 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.384 ( 13.408 19.805 -12.272) 26.882 5.515 ( 16.187 9.838 9.627) 21.248 5.916 ( 1.786 6.077 10.235) 12.036 6.197 ( -0.516 -15.200 -5.967) 16.338 6.268 ( 4.415 4.577 -12.136) 13.701 6.441 ( -2.832 -7.001 -7.330) 10.524 6.726 ( 7.960 10.840 14.364) 19.677 7.004 ( 6.533 -13.586 16.672) 22.477 7.439 ( -2.224 6.632 -5.018) 8.609 7.616 ( -3.676 -6.210 1.236) 7.322 7.911 ( -3.702 2.002 4.073) 5.857 7.967 ( -0.418 1.775 2.148) 2.817 8.436 ( -3.116 8.081 5.067) 10.034 8.630 ( 3.838 -10.458 -6.207) 12.753 8.752 ( -3.801 13.208 14.038) 19.646 9.023 ( 1.493 -10.145 10.933) 14.989 9.670 ( -2.612 7.318 -12.498) 14.717 9.811 ( -5.678 -4.191 -6.300) 9.460 9.882 ( 3.680 2.699 0.502) 4.591 10.010 ( 3.126 -8.148 3.464) 9.389 10.884 ( -4.287 4.997 -3.972) 7.689 10.954 ( -1.431 1.954 -6.102) 6.565 10.960 ( -3.543 -2.274 -4.857) 6.428 11.004 ( 0.053 -2.995 -6.663) 7.306 11.606 ( -3.735 3.578 -2.694) 5.832 11.686 ( -0.822 -3.665 -4.652) 5.979 11.985 ( -2.115 3.067 0.756) 3.801 12.079 ( -1.481 -6.310 -1.614) 6.679 13.241 ( -3.456 6.465 0.621) 7.357 13.378 ( -2.355 -6.281 0.914) 6.770 13.469 ( -2.374 1.388 -3.411) 4.381 13.537 ( -2.306 -4.578 -1.795) 5.431 14.199 ( 0.438 4.446 1.508) 4.715 14.265 ( 0.161 -1.848 0.602) 1.951 14.526 ( 6.373 2.476 2.988) 7.461 14.561 ( 6.299 -1.079 2.990) 7.055 ======================= Grid point 412 (224/260) ======================= q-point: ( 0.30 0.44 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.511 ( 12.734 17.404 -16.751) 27.307 5.773 ( 5.052 -3.658 -5.043) 8.021 5.941 ( -6.898 3.201 3.286) 8.284 6.047 ( -4.315 -2.037 -12.092) 13.000 6.249 ( 3.816 9.789 2.223) 10.739 6.496 ( 7.685 -8.465 8.460) 14.223 7.019 ( 7.897 6.327 11.504) 15.321 7.233 ( 3.561 -10.431 11.659) 16.044 7.414 ( 3.903 5.707 -2.258) 7.273 7.550 ( -4.898 -4.912 3.524) 7.780 7.910 ( 0.007 1.299 5.375) 5.529 7.994 ( -0.154 -5.235 5.091) 7.304 8.429 ( 3.025 8.752 -6.752) 11.461 8.618 ( 1.638 -7.689 -6.741) 10.356 8.879 ( 0.338 15.475 23.083) 27.792 9.157 ( 1.265 -8.877 12.233) 15.167 9.499 ( -0.717 5.615 -15.235) 16.253 9.579 ( -9.454 -1.724 -11.089) 14.674 9.970 ( 1.927 5.096 3.260) 6.349 10.102 ( 1.387 -7.195 2.777) 7.836 10.743 ( -4.680 2.304 -7.119) 8.826 10.785 ( -3.913 -0.700 -9.698) 10.481 10.923 ( -1.143 0.938 -2.908) 3.263 10.963 ( -0.489 -2.557 -3.577) 4.424 11.482 ( -4.805 5.575 -7.017) 10.169 11.606 ( -1.499 -5.519 -8.859) 10.545 11.958 ( -2.392 0.974 2.373) 3.507 12.018 ( -3.796 -5.185 -0.301) 6.433 13.191 ( -2.239 5.690 0.530) 6.138 13.318 ( -3.433 -6.351 -0.723) 7.256 13.424 ( -1.251 1.454 -0.959) 2.144 13.484 ( -1.521 -4.132 -2.111) 4.883 14.229 ( 1.341 3.511 1.219) 3.951 14.280 ( 0.746 -1.364 0.495) 1.632 14.666 ( 5.397 2.336 4.000) 7.112 14.697 ( 5.096 -0.837 3.819) 6.423 ======================= Grid point 413 (225/260) ======================= q-point: ( 0.40 0.44 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.525 ( 2.911 6.666 -15.462) 17.087 5.593 ( -12.371 1.545 -8.291) 14.972 5.827 ( -8.522 1.146 0.694) 8.627 5.897 ( -1.208 -3.945 -8.091) 9.082 6.461 ( 7.818 17.378 13.852) 23.558 6.739 ( 7.218 -6.907 12.576) 16.061 7.159 ( 2.344 5.288 1.692) 6.027 7.309 ( 1.268 -6.166 0.492) 6.314 7.498 ( 1.239 -1.507 3.208) 3.754 7.552 ( 3.871 -6.777 1.563) 7.959 7.970 ( 1.255 1.377 3.170) 3.677 8.027 ( -1.539 -4.637 5.292) 7.202 8.470 ( 5.356 6.870 -0.356) 8.718 8.612 ( 2.109 -5.417 -1.269) 5.950 9.127 ( 5.616 10.180 18.035) 21.458 9.178 ( -2.579 2.404 -5.710) 6.711 9.295 ( -11.212 7.602 -6.452) 15.004 9.483 ( 2.265 -6.149 6.040) 8.912 9.977 ( -1.763 5.806 -1.510) 6.253 10.090 ( -0.784 -4.139 -5.172) 6.670 10.609 ( -2.785 2.196 -8.137) 8.876 10.675 ( -1.598 -3.519 -7.778) 8.685 10.885 ( -0.263 2.206 -1.339) 2.594 10.926 ( -0.786 -1.757 -1.843) 2.665 11.339 ( -3.379 5.422 -7.488) 9.843 11.488 ( -2.209 -7.861 -10.574) 13.359 11.939 ( -1.894 -1.073 2.431) 3.263 11.960 ( -1.920 -3.230 0.484) 3.788 13.171 ( -0.768 4.052 0.880) 4.217 13.257 ( -2.313 -4.012 -0.929) 4.724 13.396 ( -1.045 0.859 -0.491) 1.439 13.454 ( 0.784 -4.432 -3.150) 5.494 14.262 ( 1.281 2.389 0.672) 2.793 14.294 ( 0.526 -0.770 0.024) 0.933 14.780 ( 3.034 1.895 4.224) 5.535 14.801 ( 2.587 -0.283 3.784) 4.592 ======================= Grid point 414 (226/260) ======================= q-point: (-0.50 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.291 ( -15.235 6.842 -1.142) 16.740 5.405 ( -3.873 -4.237 -7.679) 9.587 5.632 ( -14.569 10.476 6.155) 18.970 5.851 ( -0.748 -10.451 -2.503) 10.772 6.680 ( 1.682 16.460 13.940) 21.635 6.915 ( 0.962 -2.442 9.679) 10.029 7.182 ( 2.736 6.594 -4.227) 8.297 7.364 ( 7.689 -8.892 -6.357) 13.365 7.525 ( 0.340 -1.014 1.617) 1.939 7.641 ( 6.234 -10.423 -3.556) 12.655 7.998 ( -0.093 1.255 3.198) 3.437 8.031 ( -1.046 -2.417 2.093) 3.364 8.577 ( 0.334 4.916 8.630) 9.938 8.659 ( 0.385 -2.047 3.230) 3.843 8.959 ( -14.968 8.304 -4.775) 17.771 9.057 ( -2.179 -1.378 -8.150) 8.548 9.446 ( 7.284 9.423 15.769) 19.761 9.567 ( -3.904 -0.677 12.573) 13.182 9.926 ( 0.463 4.449 -4.603) 6.418 10.030 ( 1.363 -3.989 -7.941) 8.991 10.499 ( -2.323 2.796 -7.299) 8.154 10.560 ( -2.329 -2.315 -9.485) 10.038 10.902 ( 1.919 1.139 0.541) 2.296 10.915 ( 0.743 -0.168 -0.536) 0.931 11.257 ( 0.271 2.207 -4.790) 5.281 11.371 ( -0.695 -7.792 -9.348) 12.190 11.932 ( -0.320 -0.306 1.646) 1.705 11.968 ( 2.083 -3.575 -0.077) 4.138 13.170 ( -0.529 2.111 1.154) 2.463 13.222 ( -0.600 -2.554 -0.519) 2.674 13.386 ( 1.007 1.924 -1.255) 2.509 13.462 ( 3.260 -4.948 -3.846) 7.064 14.287 ( 1.069 1.257 0.119) 1.655 14.300 ( 0.318 -0.028 -0.559) 0.644 14.838 ( -0.605 1.445 3.758) 4.072 14.851 ( -0.179 0.146 3.023) 3.032 ======================= Grid point 415 (227/260) ======================= q-point: (-0.40 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.028 ( -16.372 13.520 7.491) 22.515 5.296 ( -5.478 -12.427 3.186) 13.949 5.437 ( -14.365 17.601 12.442) 25.903 5.810 ( -4.032 -18.442 3.778) 19.252 6.703 ( -8.165 15.835 5.783) 18.731 6.947 ( -3.277 -3.491 3.407) 5.876 7.219 ( 5.355 10.372 -4.855) 12.642 7.415 ( 2.441 -3.646 -5.945) 7.389 7.579 ( 5.651 -3.759 -2.815) 7.348 7.723 ( 6.356 -12.324 -5.339) 14.859 8.030 ( -0.909 2.491 5.470) 6.079 8.066 ( 3.593 -0.664 3.408) 4.997 8.506 ( -11.561 4.959 -1.761) 12.702 8.596 ( -10.456 -2.350 -1.964) 10.896 8.756 ( -4.779 15.034 8.846) 18.086 9.024 ( 1.380 -9.560 1.590) 9.789 9.534 ( -10.023 6.328 11.268) 16.354 9.608 ( -2.438 -0.578 9.193) 9.529 9.949 ( 6.085 3.670 -3.866) 8.090 10.018 ( 4.304 -1.585 -8.301) 9.484 10.426 ( 0.272 2.673 -3.100) 4.102 10.490 ( 2.280 -2.814 -3.810) 5.257 10.934 ( 1.885 0.731 -1.259) 2.381 10.942 ( 2.184 0.256 -1.070) 2.445 11.264 ( 3.253 0.003 -2.021) 3.829 11.327 ( 2.919 -5.665 -5.958) 8.724 11.959 ( 2.129 1.580 0.592) 2.716 12.021 ( 3.777 -4.199 -0.784) 5.702 13.165 ( -0.665 1.981 0.766) 2.225 13.228 ( 0.726 -3.679 1.042) 3.892 13.415 ( 3.900 3.650 -2.593) 5.937 13.507 ( 5.477 -5.000 -4.503) 8.676 14.297 ( 0.249 0.868 -1.074) 1.403 14.304 ( 0.845 0.247 -0.496) 1.011 14.818 ( -4.304 1.879 2.524) 5.331 14.843 ( -3.208 -0.528 2.105) 3.873 ======================= Grid point 416 (228/260) ======================= q-point: (-0.30 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.821 ( -16.454 22.399 14.991) 31.578 5.258 ( -6.333 -19.187 12.623) 23.824 5.340 ( -9.867 19.989 18.093) 28.710 5.787 ( -3.994 -22.680 9.494) 24.909 6.523 ( -11.838 17.421 -2.840) 21.253 6.839 ( -7.948 -10.752 -4.200) 14.015 7.271 ( 3.106 13.230 -2.846) 13.885 7.406 ( 1.533 7.715 -2.706) 8.318 7.585 ( -2.851 -3.000 -4.844) 6.372 7.775 ( 4.444 -14.589 -6.282) 16.494 7.990 ( -13.459 9.963 9.058) 19.038 8.172 ( 2.727 -4.461 -0.131) 5.230 8.363 ( 3.300 0.845 -3.148) 4.638 8.389 ( -3.864 -1.019 -4.639) 6.123 8.798 ( -1.147 12.569 12.259) 17.595 9.086 ( -0.076 -13.030 8.446) 15.528 9.406 ( -12.232 7.619 7.948) 16.457 9.543 ( -7.223 -4.588 -0.205) 8.559 10.038 ( 5.154 2.689 -2.088) 6.177 10.073 ( 7.675 -0.420 -1.537) 7.839 10.469 ( 4.775 4.012 0.783) 6.285 10.576 ( 6.946 -5.601 0.824) 8.961 10.948 ( 1.531 1.191 -2.962) 3.540 10.967 ( 2.310 -0.800 -2.058) 3.196 11.336 ( 5.248 -0.094 0.211) 5.253 11.363 ( 4.130 -2.816 -1.835) 5.325 12.008 ( 2.702 2.915 -0.108) 3.976 12.083 ( 3.743 -4.253 -1.291) 5.811 13.168 ( 0.277 3.093 1.101) 3.295 13.259 ( 1.035 -5.376 2.214) 5.905 13.478 ( 5.706 4.948 -4.018) 8.555 13.581 ( 6.858 -5.052 -5.218) 9.989 14.288 ( 0.110 1.700 -1.793) 2.473 14.310 ( 0.457 -0.290 -1.004) 1.141 14.728 ( -7.183 2.435 1.314) 7.698 14.769 ( -6.233 -1.497 0.881) 6.471 ======================= Grid point 417 (229/260) ======================= q-point: (-0.20 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 452 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.689 ( -13.048 30.172 18.700) 37.819 5.254 ( -7.918 -19.188 16.485) 26.508 5.384 ( -4.398 16.024 22.746) 28.169 5.837 ( -1.578 -22.581 14.719) 27.001 6.255 ( -12.044 18.374 -6.907) 23.029 6.621 ( -8.793 -14.082 -8.790) 18.785 7.268 ( -0.701 14.344 -6.871) 15.920 7.395 ( -5.852 16.460 -2.845) 17.700 7.428 ( -4.321 4.352 0.107) 6.134 7.750 ( -2.854 -13.471 -2.016) 13.917 7.842 ( -4.794 -0.108 1.419) 5.001 8.073 ( -6.628 -14.135 -1.433) 15.677 8.464 ( 7.101 4.181 -0.397) 8.250 8.474 ( 8.949 2.709 -2.082) 9.579 8.936 ( 4.197 7.801 13.755) 16.360 9.123 ( -6.208 -1.956 7.360) 9.825 9.269 ( -7.560 -2.197 8.555) 11.626 9.386 ( -6.681 -6.626 -3.342) 9.985 10.128 ( 6.491 5.398 -3.004) 8.961 10.238 ( 9.331 -4.681 1.203) 10.508 10.583 ( 5.512 4.153 2.735) 7.423 10.700 ( 5.626 -7.099 -0.281) 9.062 10.963 ( 3.190 2.054 -2.231) 4.401 10.993 ( 2.584 -1.066 -2.349) 3.651 11.433 ( 3.050 0.356 3.745) 4.843 11.451 ( 5.900 -1.177 1.065) 6.110 12.045 ( 1.585 3.816 -0.777) 4.205 12.129 ( 2.519 -4.449 -1.646) 5.371 13.195 ( 1.257 4.068 1.932) 4.675 13.301 ( 1.101 -5.876 2.995) 6.687 13.547 ( 5.856 5.517 -5.256) 9.611 13.660 ( 6.614 -5.544 -5.996) 10.509 14.272 ( 0.079 2.529 -2.250) 3.386 14.305 ( 0.172 -0.386 -1.420) 1.482 14.585 ( -8.943 2.710 0.443) 9.355 14.637 ( -8.214 -2.192 -0.139) 8.503 ======================= Grid point 418 (230/260) ======================= q-point: (-0.10 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.673 ( -5.569 32.769 19.043) 38.307 5.239 ( -7.264 -16.471 13.072) 22.247 5.540 ( -0.673 18.783 24.151) 30.603 5.933 ( -4.916 -3.654 10.496) 12.153 6.049 ( -1.226 -1.671 1.531) 2.576 6.409 ( -5.097 -17.630 -9.586) 20.705 7.054 ( -8.170 16.957 -14.094) 23.514 7.266 ( -9.376 1.383 -0.970) 9.527 7.429 ( 3.136 19.573 2.169) 19.941 7.719 ( -0.148 -13.763 0.128) 13.765 7.788 ( -2.971 -1.666 2.564) 4.264 7.997 ( -0.657 -16.416 -1.070) 16.464 8.540 ( 1.084 8.373 2.985) 8.955 8.623 ( 6.881 0.649 -0.778) 6.956 8.959 ( -11.628 8.652 2.781) 14.758 9.098 ( -5.077 -3.980 1.025) 6.532 9.227 ( 3.927 2.222 7.459) 8.718 9.395 ( 1.288 -12.540 13.808) 18.697 10.185 ( 4.878 7.345 -10.421) 13.651 10.357 ( 5.001 -8.646 -8.865) 13.355 10.712 ( 4.656 4.344 7.097) 9.535 10.804 ( 5.018 -4.461 3.301) 7.482 11.018 ( 3.586 0.772 -1.911) 4.136 11.036 ( 5.332 -0.933 -3.314) 6.347 11.530 ( 2.847 1.249 6.419) 7.132 11.563 ( 3.947 -1.694 3.511) 5.547 12.055 ( 0.671 4.059 -1.505) 4.381 12.142 ( 0.655 -4.554 -2.394) 5.187 13.243 ( 1.589 4.463 2.903) 5.556 13.343 ( 0.559 -4.670 3.113) 5.641 13.596 ( 4.484 4.532 -5.916) 8.697 13.707 ( 3.910 -6.016 -6.848) 9.919 14.262 ( 1.046 3.145 -1.742) 3.745 14.300 ( 0.713 0.106 -1.123) 1.335 14.423 ( -8.499 2.508 0.124) 8.862 14.480 ( -8.138 -2.503 -0.519) 8.530 ======================= Grid point 459 (231/260) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.495 ( -14.047 0.000 -24.710) 28.424 3.495 ( 14.047 0.000 24.710) 28.424 4.254 ( 9.379 0.000 -29.022) 30.500 4.254 ( -9.379 0.000 29.022) 30.500 6.979 ( -6.195 0.000 -7.179) 9.482 6.979 ( 6.195 0.000 7.179) 9.482 7.419 ( 13.884 0.000 -23.454) 27.255 7.419 ( -13.884 0.000 23.454) 27.255 7.648 ( -4.388 0.000 -15.228) 15.848 7.648 ( 4.388 0.000 15.228) 15.848 7.893 ( -0.105 0.000 -3.690) 3.691 7.893 ( 0.105 0.000 3.690) 3.691 8.339 ( -5.775 0.000 -4.691) 7.440 8.339 ( 5.775 0.000 4.691) 7.440 8.935 ( 2.037 0.000 -9.902) 10.110 8.935 ( -2.037 0.000 9.902) 10.110 9.992 ( -11.809 0.000 -3.619) 12.351 9.992 ( 11.809 0.000 3.619) 12.351 10.135 ( 0.044 0.000 -10.119) 10.119 10.135 ( -0.044 0.000 10.119) 10.119 10.755 ( 4.591 0.000 -10.400) 11.368 10.755 ( -4.591 0.000 10.400) 11.368 11.205 ( -3.404 0.000 -3.737) 5.055 11.205 ( 3.404 0.000 3.737) 5.055 11.637 ( -4.906 0.000 -1.119) 5.032 11.637 ( 4.906 0.000 1.119) 5.032 12.266 ( -9.966 0.000 -0.935) 10.009 12.266 ( 9.966 0.000 0.935) 10.009 13.147 ( -5.518 0.000 1.707) 5.776 13.147 ( 5.518 0.000 -1.707) 5.776 13.879 ( -1.528 0.000 -7.234) 7.394 13.879 ( 1.528 0.000 7.234) 7.394 13.983 ( 3.026 0.000 -4.321) 5.275 13.983 ( -3.026 0.000 4.321) 5.275 14.378 ( -6.886 0.000 -0.459) 6.902 14.378 ( 6.886 0.000 0.459) 6.902 ======================= Grid point 461 (232/260) ======================= q-point: ( 0.10 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.309 ( 18.712 0.000 -28.195) 33.840 4.084 ( 28.248 0.000 -2.481) 28.357 4.362 ( 28.567 0.000 -7.899) 29.639 4.421 ( 0.612 0.000 28.372) 28.378 6.724 ( -5.825 0.000 -22.399) 23.144 6.949 ( -13.344 0.000 -2.384) 13.556 7.277 ( -7.651 0.000 2.180) 7.955 7.385 ( -2.641 0.000 -4.830) 5.505 7.610 ( 4.029 0.000 -2.168) 4.575 7.876 ( 2.642 0.000 9.991) 10.334 7.989 ( 16.738 0.000 -3.674) 17.136 7.991 ( -0.988 0.000 19.928) 19.953 8.209 ( -4.775 0.000 -2.241) 5.275 8.489 ( 5.423 0.000 6.332) 8.337 8.868 ( 0.151 0.000 -10.586) 10.587 8.960 ( -2.955 0.000 7.413) 7.980 9.628 ( -19.108 0.000 -5.448) 19.870 9.862 ( -9.496 0.000 -9.585) 13.492 10.290 ( 1.830 0.000 13.455) 13.579 10.367 ( 13.350 0.000 4.880) 14.214 10.694 ( -11.351 0.000 8.525) 14.196 10.709 ( 1.487 0.000 -12.905) 12.990 11.085 ( -4.987 0.000 -5.496) 7.422 11.259 ( 0.573 0.000 -0.248) 0.624 11.556 ( -2.673 0.000 -1.853) 3.253 11.753 ( 6.281 0.000 1.620) 6.486 11.997 ( -14.671 0.000 -6.673) 16.117 12.366 ( 2.292 0.000 -2.878) 3.679 13.084 ( -2.735 0.000 1.567) 3.152 13.248 ( 6.966 0.000 -2.248) 7.319 13.773 ( -2.932 0.000 -7.246) 7.817 13.880 ( -6.784 0.000 2.662) 7.287 14.009 ( 0.979 0.000 7.241) 7.307 14.020 ( 4.675 0.000 -3.065) 5.590 14.324 ( 0.078 0.000 3.180) 3.181 14.539 ( 8.267 0.000 2.610) 8.669 ======================= Grid point 462 (233/260) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.650 ( 40.434 0.000 -26.120) 48.137 4.394 ( 28.534 0.000 -26.716) 39.089 4.731 ( 7.855 0.000 26.173) 27.327 5.144 ( 42.469 0.000 11.353) 43.960 6.444 ( -3.800 0.000 -21.639) 21.971 6.580 ( -24.134 0.000 3.631) 24.406 7.166 ( -0.006 0.000 -14.387) 14.387 7.265 ( -7.448 0.000 -0.487) 7.463 7.668 ( 4.030 0.000 -2.393) 4.687 8.000 ( 4.447 0.000 5.266) 6.892 8.080 ( -0.213 0.000 -2.141) 2.152 8.210 ( -7.596 0.000 33.242) 34.099 8.283 ( 19.541 0.000 -10.385) 22.129 8.647 ( 4.068 0.000 11.299) 12.009 8.773 ( -1.280 0.000 -8.641) 8.735 8.961 ( -1.915 0.000 4.054) 4.483 9.239 ( -18.750 0.000 -3.650) 19.102 9.579 ( -14.116 0.000 -5.896) 15.298 10.391 ( -6.891 0.000 13.135) 14.833 10.489 ( -13.346 0.000 5.349) 14.378 10.539 ( 0.632 0.000 -6.605) 6.635 10.650 ( 6.081 0.000 -6.950) 9.235 10.948 ( -4.992 0.000 -4.884) 6.984 11.182 ( -7.883 0.000 -5.299) 9.498 11.510 ( -0.111 0.000 -2.460) 2.462 11.713 ( -6.293 0.000 -8.316) 10.429 11.881 ( 5.406 0.000 2.129) 5.810 12.329 ( -2.336 0.000 -4.203) 4.808 13.073 ( -0.209 0.000 1.924) 1.935 13.348 ( 6.089 0.000 -3.269) 6.911 13.659 ( -2.990 0.000 -6.680) 7.319 13.744 ( -8.816 0.000 1.858) 9.010 14.099 ( 1.878 0.000 7.195) 7.436 14.102 ( 6.017 0.000 -1.295) 6.155 14.404 ( 4.064 0.000 4.633) 6.163 14.698 ( 5.899 0.000 3.311) 6.765 ======================= Grid point 463 (234/260) ======================= q-point: ( 0.30 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.226 ( 42.185 0.000 -22.976) 48.036 4.747 ( 33.512 0.000 -25.036) 41.831 5.129 ( 12.292 0.000 23.698) 26.696 5.801 ( 8.800 0.000 2.626) 9.183 6.228 ( -6.901 0.000 -8.323) 10.812 6.273 ( -5.203 0.000 7.699) 9.292 7.068 ( 4.396 0.000 -11.785) 12.579 7.146 ( -0.701 0.000 -6.531) 6.569 7.726 ( 4.394 0.000 -0.776) 4.462 8.069 ( 4.409 0.000 -7.257) 8.491 8.090 ( 2.530 0.000 -1.074) 2.749 8.336 ( -11.682 0.000 34.940) 36.841 8.474 ( 13.482 0.000 -20.327) 24.392 8.702 ( -1.481 0.000 0.805) 1.686 8.828 ( 1.436 0.000 14.452) 14.523 8.913 ( -11.533 0.000 -2.819) 11.873 8.962 ( -1.165 0.000 2.416) 2.682 9.264 ( -17.094 0.000 1.076) 17.128 10.119 ( -19.748 0.000 6.019) 20.645 10.394 ( -2.987 0.000 -15.337) 15.625 10.488 ( -2.398 0.000 8.349) 8.687 10.675 ( -0.611 0.000 -7.111) 7.137 10.838 ( -3.205 0.000 -2.154) 3.861 10.922 ( -11.812 0.000 -7.376) 13.926 11.521 ( 2.833 0.000 -1.117) 3.045 11.632 ( 1.470 0.000 -4.935) 5.150 11.982 ( 3.749 0.000 1.997) 4.248 12.237 ( -3.360 0.000 -3.947) 5.184 13.107 ( 1.760 0.000 2.696) 3.220 13.404 ( 3.055 0.000 -4.188) 5.184 13.557 ( -1.923 0.000 -6.255) 6.543 13.617 ( -7.035 0.000 3.047) 7.666 14.192 ( 2.105 0.000 6.055) 6.411 14.204 ( 5.593 0.000 -0.428) 5.610 14.525 ( 4.726 0.000 4.334) 6.412 14.795 ( 1.855 0.000 2.402) 3.035 ======================= Grid point 464 (235/260) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.746 ( 34.130 0.000 -19.783) 39.449 5.177 ( 34.248 0.000 -21.567) 40.473 5.554 ( 12.905 0.000 20.174) 23.949 5.562 ( -24.899 0.000 7.777) 26.085 6.004 ( -19.364 0.000 10.732) 22.139 6.290 ( -3.160 0.000 -12.791) 13.176 7.182 ( 15.172 0.000 -16.641) 22.519 7.231 ( 9.155 0.000 9.807) 13.416 7.865 ( 12.007 0.000 2.310) 12.227 8.083 ( 0.431 0.000 -3.935) 3.959 8.121 ( 7.504 0.000 -8.199) 11.115 8.338 ( -11.218 0.000 16.687) 20.107 8.404 ( -4.405 0.000 -11.316) 12.144 8.658 ( -11.370 0.000 -2.935) 11.743 8.758 ( 3.439 0.000 2.164) 4.063 8.923 ( -7.988 0.000 6.415) 10.245 8.978 ( 3.106 0.000 2.099) 3.748 9.052 ( -8.911 0.000 9.480) 13.010 9.941 ( -5.167 0.000 9.714) 11.003 10.209 ( -3.412 0.000 -14.014) 14.424 10.461 ( -5.539 0.000 2.333) 6.010 10.537 ( -4.181 0.000 -10.775) 11.558 10.727 ( -4.753 0.000 0.660) 4.798 10.776 ( -2.144 0.000 -2.363) 3.191 11.576 ( 2.735 0.000 0.678) 2.817 11.631 ( 1.435 0.000 -3.252) 3.555 12.052 ( 2.172 0.000 1.999) 2.952 12.155 ( -2.262 0.000 -2.971) 3.734 13.179 ( 3.152 0.000 3.483) 4.698 13.372 ( -2.398 0.000 -4.379) 4.992 13.506 ( 2.022 0.000 -6.065) 6.393 13.541 ( -4.833 0.000 4.484) 6.593 14.270 ( 1.417 0.000 4.406) 4.628 14.284 ( 3.470 0.000 -0.941) 3.596 14.643 ( 4.486 0.000 3.392) 5.623 14.805 ( -1.869 0.000 0.241) 1.885 ======================= Grid point 465 (236/260) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.166 ( 28.518 0.000 -14.631) 32.052 5.166 ( -28.518 0.000 14.631) 32.052 5.602 ( 27.872 0.000 -16.299) 32.287 5.602 ( -27.872 0.000 16.299) 32.287 6.007 ( -8.579 0.000 -21.370) 23.028 6.007 ( 8.579 0.000 21.370) 23.028 7.325 ( 12.955 0.000 -19.532) 23.438 7.325 ( -12.955 0.000 19.532) 23.438 8.100 ( 4.623 0.000 -4.432) 6.405 8.100 ( -4.623 0.000 4.432) 6.405 8.181 ( -13.613 0.000 -1.824) 13.734 8.181 ( 13.613 0.000 1.824) 13.734 8.391 ( -13.620 0.000 1.951) 13.759 8.391 ( 13.620 0.000 -1.951) 13.759 8.839 ( 6.385 0.000 -5.227) 8.251 8.839 ( -6.385 0.000 5.227) 8.251 9.018 ( 5.552 0.000 -9.438) 10.950 9.018 ( -5.552 0.000 9.438) 10.950 10.040 ( -3.161 0.000 -11.970) 12.381 10.040 ( 3.161 0.000 11.970) 12.381 10.416 ( 0.754 0.000 -6.334) 6.379 10.416 ( -0.754 0.000 6.334) 6.379 10.722 ( -0.443 0.000 -3.912) 3.937 10.722 ( 0.443 0.000 3.912) 3.937 11.618 ( -0.542 0.000 -2.038) 2.109 11.618 ( 0.542 0.000 2.038) 2.109 12.101 ( -1.489 0.000 -2.266) 2.712 12.101 ( 1.489 0.000 2.266) 2.712 13.275 ( -3.730 0.000 -4.083) 5.530 13.275 ( 3.730 0.000 4.083) 5.530 13.509 ( 3.413 0.000 -5.546) 6.512 13.509 ( -3.413 0.000 5.546) 6.512 14.308 ( 0.662 0.000 -2.497) 2.583 14.308 ( -0.662 0.000 2.497) 2.583 14.742 ( -3.834 0.000 -1.914) 4.285 14.742 ( 3.834 0.000 1.914) 4.285 ======================= Grid point 471 (237/260) ======================= q-point: ( 0.00 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.648 ( -13.678 14.605 -24.156) 31.367 3.648 ( 13.678 14.605 24.156) 31.367 4.469 ( 8.077 20.080 -27.612) 35.083 4.469 ( -8.077 20.080 27.612) 35.083 6.957 ( -7.175 -1.655 -7.672) 10.634 6.957 ( 7.175 -1.655 7.672) 10.634 7.411 ( -4.383 -4.672 -12.458) 14.009 7.411 ( 4.383 -4.672 12.458) 14.009 7.571 ( -9.473 -4.551 -4.226) 11.328 7.571 ( 9.473 -4.551 4.226) 11.328 7.932 ( -4.759 4.054 0.583) 6.279 7.932 ( 4.759 4.054 -0.583) 6.279 8.351 ( -3.129 1.782 -4.952) 6.122 8.351 ( 3.129 1.782 4.952) 6.122 8.912 ( 0.293 -2.798 -9.165) 9.587 8.912 ( -0.293 -2.798 9.165) 9.587 9.893 ( -11.640 -6.819 -10.282) 16.962 9.893 ( 11.640 -6.819 10.282) 16.962 10.184 ( -7.187 2.336 -10.546) 12.974 10.184 ( 7.187 2.336 10.546) 12.974 10.789 ( 4.614 3.115 -9.346) 10.879 10.789 ( -4.614 3.115 9.346) 10.879 11.165 ( -2.593 -3.407 -3.863) 5.767 11.165 ( 2.593 -3.407 3.863) 5.767 11.655 ( -4.814 1.356 -0.949) 5.091 11.655 ( 4.814 1.356 0.949) 5.091 12.244 ( -8.425 -2.257 -2.819) 9.167 12.244 ( 8.425 -2.257 2.819) 9.167 13.165 ( -0.710 1.825 -0.757) 2.100 13.165 ( 0.710 1.825 0.757) 2.100 13.863 ( -1.857 -1.877 -6.801) 7.296 13.863 ( 1.857 -1.877 6.801) 7.296 14.012 ( 3.445 2.966 -3.647) 5.828 14.012 ( -3.445 2.966 3.647) 5.828 14.373 ( -6.144 -0.393 -0.347) 6.167 14.373 ( 6.144 -0.393 0.347) 6.167 ======================= Grid point 473 (238/260) ======================= q-point: ( 0.10 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.448 ( 16.165 13.731 -27.357) 34.616 4.237 ( 27.722 13.677 7.589) 31.830 4.521 ( 22.503 15.872 -16.438) 32.071 4.652 ( 4.115 21.239 26.326) 34.074 6.690 ( -10.693 -2.172 -12.023) 16.236 7.027 ( -8.059 5.857 -9.250) 13.595 7.185 ( 0.663 -5.099 -9.211) 10.549 7.362 ( -5.934 -9.535 -7.966) 13.769 7.599 ( 2.487 -0.342 11.096) 11.377 7.742 ( 1.813 -6.721 5.824) 9.077 7.985 ( 1.788 -2.735 20.021) 20.286 8.065 ( 7.083 6.219 2.219) 9.683 8.259 ( -0.699 4.265 -3.674) 5.673 8.472 ( 4.751 0.143 4.080) 6.264 8.824 ( -1.374 -4.566 -8.959) 10.149 8.974 ( -0.214 0.293 6.668) 6.678 9.551 ( -15.691 -5.176 -9.591) 19.105 9.925 ( -10.236 4.100 -7.575) 13.378 10.153 ( 4.966 -9.281 9.445) 14.143 10.405 ( 6.963 0.718 8.931) 11.347 10.707 ( -9.164 1.907 2.353) 9.651 10.768 ( 0.274 4.405 -7.113) 8.370 11.062 ( -4.035 -1.986 -4.825) 6.596 11.213 ( 0.540 -4.009 -0.269) 4.054 11.572 ( -3.188 1.241 -1.728) 3.833 11.761 ( 5.501 0.162 0.654) 5.542 11.980 ( -13.411 -1.218 -6.350) 14.888 12.358 ( 2.870 -1.222 -2.109) 3.766 13.093 ( -3.439 1.093 1.777) 4.022 13.267 ( 6.697 1.721 -2.279) 7.280 13.756 ( -3.324 -1.739 -6.420) 7.436 13.883 ( -6.169 -0.515 3.118) 6.932 14.008 ( 0.418 0.494 5.853) 5.889 14.056 ( 4.408 3.412 -2.628) 6.163 14.334 ( 0.775 0.958 3.139) 3.373 14.525 ( 8.058 -1.226 2.483) 8.520 ======================= Grid point 474 (239/260) ======================= q-point: ( 0.20 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.734 ( 36.962 8.929 -25.997) 46.063 4.567 ( 24.702 15.875 -22.509) 36.998 4.910 ( 11.131 15.400 19.613) 27.308 5.260 ( 38.384 11.995 13.060) 42.282 6.391 ( -13.524 -3.000 -6.192) 15.174 6.684 ( -14.029 7.522 -11.554) 19.670 7.146 ( -0.458 -3.839 -14.536) 15.041 7.203 ( -3.482 -4.480 -2.601) 6.242 7.694 ( 2.778 3.437 0.315) 4.430 7.844 ( 4.974 -12.527 5.624) 14.605 8.121 ( 0.800 1.528 -2.242) 2.828 8.201 ( -5.053 -0.695 32.056) 32.459 8.357 ( 14.150 4.013 -5.865) 15.834 8.588 ( 2.300 -1.453 7.499) 7.977 8.719 ( -2.566 -5.164 -6.362) 8.586 9.023 ( 0.497 3.719 4.115) 5.569 9.187 ( -14.749 -3.142 -8.548) 17.334 9.645 ( -14.674 4.840 -4.330) 16.047 10.267 ( -1.033 -10.167 7.928) 12.934 10.441 ( -16.252 -2.490 5.607) 17.371 10.566 ( 0.187 2.436 -6.371) 6.824 10.732 ( 2.812 4.505 -3.645) 6.441 10.952 ( -4.142 0.467 -3.500) 5.443 11.149 ( -6.402 -3.073 -5.011) 8.692 11.507 ( -1.798 -0.283 -2.348) 2.971 11.697 ( -5.180 -1.760 -8.092) 9.768 11.893 ( 4.589 1.303 1.486) 4.996 12.334 ( -2.207 -0.086 -3.470) 4.114 13.072 ( -0.694 0.250 2.183) 2.304 13.357 ( 5.351 0.757 -3.246) 6.305 13.643 ( -3.265 -1.548 -5.741) 6.784 13.753 ( -8.627 0.418 1.795) 8.821 14.088 ( 2.058 -0.497 6.191) 6.543 14.134 ( 5.329 2.736 -0.611) 6.022 14.422 ( 4.468 1.654 4.287) 6.409 14.683 ( 6.046 -1.363 3.192) 6.971 ======================= Grid point 475 (240/260) ======================= q-point: ( 0.30 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.260 ( 40.600 4.256 -22.983) 46.848 4.864 ( 28.515 10.977 -23.001) 38.244 5.294 ( 12.961 14.283 18.990) 27.067 5.862 ( 2.598 5.612 2.902) 6.831 6.160 ( -1.695 -1.706 5.271) 5.794 6.403 ( -8.680 7.846 -2.101) 11.887 7.029 ( 5.008 -4.630 -12.825) 14.525 7.162 ( 3.678 2.636 -7.253) 8.549 7.750 ( 3.782 2.550 1.042) 4.678 7.974 ( 7.242 -7.618 -2.288) 10.757 8.113 ( 0.712 0.824 -3.096) 3.282 8.330 ( -7.506 -1.395 25.725) 26.834 8.539 ( 10.023 5.381 -18.794) 21.969 8.593 ( -2.786 -11.015 5.952) 12.827 8.722 ( -1.179 -3.662 13.798) 14.325 8.885 ( -9.013 -0.459 -5.636) 10.640 9.081 ( 1.433 6.136 0.239) 6.306 9.337 ( -17.393 5.938 3.954) 18.799 10.103 ( -18.418 -1.447 4.407) 18.993 10.276 ( -2.808 -9.660 -4.197) 10.900 10.486 ( -1.815 1.449 -5.648) 6.106 10.746 ( -1.630 3.661 -3.859) 5.564 10.850 ( -4.166 1.132 -1.778) 4.670 10.925 ( -9.541 0.485 -6.295) 11.441 11.492 ( 1.738 -2.722 -0.715) 3.308 11.623 ( 1.367 -1.021 -5.095) 5.373 11.984 ( 3.846 0.112 1.057) 3.990 12.246 ( -3.785 0.353 -2.911) 4.788 13.100 ( 1.393 -0.405 2.821) 3.172 13.396 ( 1.799 -0.906 -4.123) 4.589 13.550 ( -1.495 -0.604 -5.164) 5.410 13.627 ( -6.847 0.639 2.619) 7.358 14.177 ( 2.313 -0.938 5.140) 5.714 14.226 ( 4.538 1.616 0.222) 4.822 14.546 ( 5.036 1.985 3.918) 6.682 14.785 ( 2.336 -0.849 2.397) 3.453 ======================= Grid point 476 (241/260) ======================= q-point: ( 0.40 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.772 ( 34.063 2.637 -19.389) 39.283 5.218 ( 30.479 4.552 -21.145) 37.374 5.563 ( -21.421 0.800 8.854) 23.192 5.692 ( 7.916 10.824 14.602) 19.825 6.043 ( -21.054 3.727 14.854) 26.035 6.341 ( -1.584 5.120 -12.023) 13.164 7.165 ( 17.983 -1.179 -13.779) 22.685 7.275 ( 7.207 3.597 6.252) 10.196 7.893 ( 10.778 2.366 3.198) 11.489 8.062 ( 3.176 -2.946 -3.309) 5.451 8.106 ( 5.424 -0.334 -6.533) 8.498 8.337 ( -8.401 -1.185 9.829) 12.984 8.397 ( -5.222 -1.376 -6.261) 8.268 8.658 ( -5.179 -0.755 -3.068) 6.067 8.725 ( -2.231 -1.476 1.605) 3.120 8.789 ( -0.880 -5.703 4.501) 7.318 9.061 ( -2.479 3.022 2.702) 4.752 9.159 ( -9.367 9.989 9.569) 16.706 9.920 ( -5.029 -1.905 6.850) 8.708 10.145 ( -3.893 -6.201 -10.223) 12.574 10.424 ( -1.604 -0.538 -1.916) 2.556 10.572 ( -7.830 1.290 -7.764) 11.102 10.782 ( -3.233 4.050 -0.881) 5.257 10.791 ( -2.427 1.819 -0.864) 3.154 11.539 ( 2.627 -3.494 0.978) 4.479 11.613 ( 0.878 -1.785 -3.449) 3.982 12.051 ( 2.862 -0.235 0.686) 2.953 12.163 ( -3.073 0.349 -1.560) 3.464 13.166 ( 2.786 -1.089 3.439) 4.558 13.348 ( -2.608 -2.138 -4.240) 5.417 13.513 ( 1.758 0.477 -4.949) 5.273 13.550 ( -4.552 0.615 3.712) 5.905 14.253 ( 1.858 -1.257 3.667) 4.298 14.290 ( 2.270 0.212 -0.387) 2.313 14.664 ( 4.542 2.018 2.945) 5.777 14.806 ( -1.233 0.245 0.468) 1.341 ======================= Grid point 477 (242/260) ======================= q-point: ( 0.50 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.187 ( 27.665 1.886 -14.206) 31.156 5.187 ( -27.665 1.886 14.206) 31.156 5.610 ( 25.042 1.229 -17.201) 30.405 5.610 ( -25.042 1.229 17.201) 30.405 6.104 ( -6.736 8.791 -19.538) 22.459 6.104 ( 6.736 8.791 19.538) 22.459 7.339 ( 12.535 1.073 -18.511) 22.382 7.339 ( -12.535 1.073 18.511) 22.382 8.068 ( -0.615 -2.825 -3.630) 4.641 8.068 ( 0.615 -2.825 3.630) 4.641 8.209 ( -1.609 1.794 -12.597) 12.825 8.209 ( 1.609 1.794 12.597) 12.825 8.409 ( -11.412 2.114 1.429) 11.693 8.409 ( 11.412 2.114 -1.429) 11.693 8.775 ( 5.280 -5.284 -6.338) 9.796 8.775 ( -5.280 -5.284 6.338) 9.796 9.085 ( 5.673 6.494 -13.974) 16.420 9.085 ( -5.673 6.494 13.974) 16.420 9.993 ( -3.228 -4.113 -9.358) 10.719 9.993 ( 3.228 -4.113 9.358) 10.719 10.425 ( -1.895 0.732 -3.426) 3.982 10.425 ( 1.895 0.732 3.426) 3.982 10.757 ( 0.431 3.002 -2.170) 3.729 10.757 ( -0.431 3.002 2.170) 3.729 11.588 ( -0.290 -2.930 -3.089) 4.268 11.588 ( 0.290 -2.930 3.089) 4.268 12.105 ( -1.080 0.029 -1.949) 2.228 12.105 ( 1.080 0.029 1.949) 2.228 13.255 ( -3.439 -1.783 -3.921) 5.512 13.255 ( 3.439 -1.783 3.921) 5.512 13.517 ( 3.205 0.555 -5.422) 6.323 13.517 ( -3.205 0.555 5.422) 6.323 14.298 ( -0.003 -0.926 -2.230) 2.415 14.298 ( 0.003 -0.926 2.230) 2.415 14.757 ( -3.236 1.419 -1.652) 3.900 14.757 ( 3.236 1.419 1.652) 3.900 ======================= Grid point 483 (243/260) ======================= q-point: ( 0.00 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.053 ( -11.763 24.451 -22.184) 35.047 4.053 ( 11.763 24.451 22.184) 35.047 4.997 ( 4.938 29.999 -25.005) 39.365 4.997 ( -4.938 29.999 25.005) 39.365 6.908 ( -10.541 -4.975 -4.093) 12.354 6.908 ( 10.541 -4.975 4.093) 12.354 7.164 ( -3.440 -15.312 -2.908) 15.960 7.164 ( 3.440 -15.312 2.908) 15.960 7.524 ( -2.860 -1.970 -27.614) 27.832 7.524 ( 2.860 -1.970 27.614) 27.832 8.055 ( 0.831 6.998 -8.442) 10.997 8.055 ( -0.831 6.998 8.442) 10.997 8.434 ( 2.592 6.431 -8.231) 10.762 8.434 ( -2.592 6.431 8.231) 10.762 8.808 ( -2.162 -6.884 -8.256) 10.965 8.808 ( 2.162 -6.884 8.256) 10.965 9.774 ( -8.501 -4.392 -12.795) 15.977 9.774 ( 8.501 -4.392 12.795) 15.977 10.193 ( -5.629 -1.742 -12.074) 13.435 10.193 ( 5.629 -1.742 12.074) 13.435 10.868 ( 4.143 4.258 -7.510) 9.576 10.868 ( -4.143 4.258 7.510) 9.576 11.088 ( -0.929 -3.926 -4.262) 5.869 11.088 ( 0.929 -3.926 4.262) 5.869 11.678 ( -4.004 0.839 -0.405) 4.111 11.678 ( 4.004 0.839 0.405) 4.111 12.179 ( -6.388 -3.854 -4.834) 8.889 12.179 ( 6.388 -3.854 4.834) 8.889 13.218 ( -0.005 3.202 -2.477) 4.048 13.218 ( 0.005 3.202 2.477) 4.048 13.798 ( -2.020 -4.474 -5.494) 7.368 13.798 ( 2.020 -4.474 5.494) 7.368 14.095 ( 4.673 4.849 -2.795) 7.291 14.095 ( -4.673 4.849 2.795) 7.291 14.367 ( -4.665 -0.181 -0.113) 4.670 14.367 ( 4.665 -0.181 0.113) 4.670 ======================= Grid point 485 (244/260) ======================= q-point: ( 0.10 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.849 ( 11.351 24.989 -24.715) 36.934 4.584 ( 24.839 19.763 16.543) 35.794 4.963 ( 14.604 25.766 -24.320) 38.323 5.205 ( 6.038 31.150 23.245) 39.333 6.644 ( -13.866 -3.443 -4.723) 15.047 7.028 ( -0.540 -16.372 -8.223) 18.329 7.120 ( 3.723 -0.418 -21.608) 21.930 7.134 ( -2.169 -4.316 1.605) 5.090 7.376 ( 4.255 -11.869 0.149) 12.609 7.789 ( -0.594 -0.977 24.735) 24.761 7.927 ( -6.046 2.594 5.598) 8.638 8.183 ( 4.012 3.592 1.871) 5.701 8.358 ( -2.061 5.652 0.539) 6.040 8.542 ( 3.196 5.171 5.589) 8.258 8.708 ( 0.372 -3.976 -9.693) 10.484 8.936 ( 4.926 -3.972 5.430) 8.338 9.472 ( -11.710 -2.394 -13.667) 18.156 9.974 ( -6.752 -1.768 -9.727) 11.972 9.981 ( 1.705 -5.032 10.221) 11.520 10.383 ( 3.318 -2.956 11.544) 12.370 10.768 ( -7.870 3.898 -1.870) 8.979 10.854 ( -0.595 3.544 -5.768) 6.795 11.019 ( -2.225 -1.981 -2.712) 4.029 11.118 ( -0.122 -5.005 -0.124) 5.009 11.598 ( -3.764 1.341 -1.596) 4.303 11.738 ( 1.564 -2.422 -2.762) 3.993 11.969 ( -7.950 0.330 -3.974) 8.894 12.302 ( 3.251 -4.325 -0.431) 5.428 13.136 ( -4.290 3.059 1.589) 5.504 13.310 ( 5.399 2.381 -1.777) 6.162 13.698 ( -3.756 -4.080 -4.868) 7.379 13.832 ( -3.946 -4.416 4.247) 7.288 14.050 ( -1.798 3.620 3.719) 5.493 14.149 ( 3.728 5.378 -2.193) 6.902 14.358 ( 2.402 1.227 2.652) 3.783 14.498 ( 7.539 -1.228 2.246) 7.961 ======================= Grid point 486 (245/260) ======================= q-point: ( 0.20 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.026 ( 28.916 19.634 -24.443) 42.651 4.974 ( 18.141 22.865 -17.740) 34.156 5.231 ( 19.400 14.708 7.423) 25.452 5.651 ( 23.573 25.202 18.048) 38.942 6.333 ( -17.220 -3.415 -1.001) 17.584 6.824 ( -13.026 0.143 -9.474) 16.107 6.925 ( 3.513 -8.203 -17.376) 19.534 7.215 ( 5.062 2.336 -5.578) 7.886 7.543 ( 9.213 -15.109 5.365) 18.492 7.813 ( -2.732 7.307 4.270) 8.894 8.037 ( -1.515 -9.305 20.799) 22.836 8.212 ( -0.416 -0.183 0.372) 0.587 8.368 ( 1.063 -2.237 0.007) 2.477 8.617 ( -0.391 -1.292 3.542) 3.790 8.694 ( 3.122 9.137 1.691) 9.803 9.067 ( 3.701 1.151 0.758) 3.949 9.153 ( -7.941 -0.506 -11.465) 13.956 9.718 ( -12.514 1.392 -6.158) 14.016 10.070 ( -1.019 -7.765 6.727) 10.324 10.389 ( -13.380 -2.729 4.626) 14.417 10.629 ( -1.047 3.567 -7.821) 8.660 10.791 ( -0.437 1.425 -1.594) 2.182 10.963 ( -2.714 0.354 -1.256) 3.011 11.067 ( -4.023 -4.750 -4.201) 7.510 11.501 ( -5.185 -0.203 -2.260) 5.660 11.645 ( -2.251 -2.993 -7.875) 8.720 11.930 ( 2.463 2.137 0.494) 3.298 12.300 ( -1.937 -3.565 -1.832) 4.452 13.095 ( -1.893 2.028 2.181) 3.529 13.373 ( 3.159 0.824 -2.619) 4.185 13.593 ( -3.169 -3.612 -4.254) 6.418 13.740 ( -7.866 -2.139 2.753) 8.604 14.094 ( 1.613 1.548 4.899) 5.385 14.205 ( 3.578 3.919 -0.460) 5.327 14.465 ( 5.712 2.417 3.227) 6.991 14.653 ( 6.481 -1.345 2.946) 7.245 ======================= Grid point 487 (246/260) ======================= q-point: ( 0.30 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.426 ( 34.387 12.305 -22.019) 42.647 5.147 ( 21.032 15.556 -24.481) 35.828 5.604 ( 11.637 14.052 12.399) 22.060 5.962 ( -15.801 2.314 1.079) 16.005 6.229 ( 8.720 8.923 14.874) 19.413 6.525 ( -11.826 2.213 -0.092) 12.032 6.936 ( 14.201 -1.007 -16.342) 21.674 7.249 ( 5.264 4.854 -5.216) 8.859 7.754 ( 9.449 -8.530 2.224) 12.922 7.858 ( 3.774 3.112 4.380) 6.566 8.104 ( -3.103 -3.631 5.833) 7.539 8.235 ( 0.067 -7.454 5.931) 9.526 8.355 ( -3.044 -9.583 1.120) 10.117 8.621 ( 5.984 1.491 -14.098) 15.388 8.768 ( -5.261 7.698 12.483) 15.581 8.904 ( -4.660 3.074 -0.501) 5.605 9.214 ( 4.748 7.600 -2.176) 9.222 9.438 ( -13.862 2.542 2.587) 14.329 10.044 ( -8.508 -5.179 2.456) 10.259 10.125 ( -10.025 -2.773 -2.671) 10.739 10.524 ( -2.186 1.844 -8.634) 9.096 10.796 ( -3.003 1.922 -3.197) 4.788 10.851 ( -5.649 -1.717 -1.701) 6.145 10.948 ( -3.779 1.340 -2.472) 4.711 11.422 ( -1.406 -3.750 0.073) 4.006 11.587 ( 1.226 -2.528 -6.109) 6.724 11.986 ( 2.979 0.041 -0.182) 2.985 12.225 ( -4.212 -2.770 -0.958) 5.131 13.101 ( 0.230 0.624 2.743) 2.822 13.369 ( -0.948 -1.397 -3.331) 3.734 13.525 ( -0.211 -2.198 -3.933) 4.511 13.626 ( -6.707 -1.064 2.959) 7.408 14.168 ( 1.970 0.391 4.217) 4.671 14.263 ( 2.519 1.815 0.175) 3.110 14.600 ( 5.901 3.122 2.869) 7.266 14.770 ( 3.573 -0.508 2.406) 4.338 ======================= Grid point 488 (247/260) ======================= q-point: ( 0.40 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.861 ( 30.514 6.366 -17.889) 35.940 5.354 ( 24.444 8.177 -23.400) 34.812 5.568 ( -20.514 -0.630 5.439) 21.233 5.917 ( -4.164 9.010 11.974) 15.553 6.148 ( -12.088 7.097 17.378) 22.327 6.503 ( 0.133 10.814 -7.628) 13.235 7.146 ( 19.203 -0.402 -12.105) 22.703 7.349 ( 2.873 2.784 6.411) 7.556 7.937 ( 6.670 1.676 2.606) 7.355 7.956 ( 4.651 -7.603 -1.160) 8.988 8.093 ( -2.461 -4.109 6.203) 7.837 8.274 ( 1.368 -1.971 -3.200) 4.000 8.314 ( 3.593 -5.982 -2.470) 7.402 8.611 ( 6.027 -1.843 -11.547) 13.155 8.740 ( -1.200 0.699 -0.879) 1.643 8.818 ( -15.973 10.028 9.290) 21.024 9.178 ( -2.472 8.247 7.305) 11.291 9.369 ( -3.438 10.177 4.173) 11.525 9.874 ( -5.495 -2.215 1.894) 6.220 10.006 ( -3.340 -6.012 -5.438) 8.768 10.438 ( -0.824 1.064 -4.387) 4.589 10.585 ( -8.388 0.175 -7.108) 10.996 10.825 ( -1.051 2.105 0.613) 2.431 10.871 ( -3.219 3.432 -0.975) 4.805 11.442 ( 1.781 -5.856 2.160) 6.491 11.555 ( -0.145 -4.013 -4.758) 6.226 12.035 ( 3.132 -1.488 -0.994) 3.607 12.147 ( -4.000 -2.251 0.627) 4.633 13.145 ( 1.773 -0.738 3.129) 3.671 13.299 ( -3.029 -2.319 -3.444) 5.139 13.509 ( 1.659 -1.298 -3.922) 4.452 13.551 ( -4.476 -0.888 3.403) 5.692 14.233 ( 1.765 -0.451 2.982) 3.495 14.291 ( 0.600 0.036 -0.383) 0.713 14.719 ( 4.679 3.189 1.973) 5.997 14.819 ( 0.240 0.996 0.960) 1.404 ======================= Grid point 489 (248/260) ======================= q-point: ( 0.50 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.231 ( 24.082 2.235 -11.892) 26.951 5.231 ( -24.082 2.235 11.892) 26.951 5.659 ( 26.095 3.237 -19.471) 32.719 5.659 ( -26.095 3.237 19.471) 32.719 6.332 ( -4.356 13.120 -16.049) 21.182 6.332 ( 4.356 13.120 16.049) 21.182 7.348 ( 11.788 -0.605 -15.848) 19.761 7.348 ( -11.788 -0.605 15.848) 19.761 7.983 ( 0.998 -6.117 -1.845) 6.466 7.983 ( -0.998 -6.117 1.845) 6.466 8.191 ( -1.588 -4.222 -12.621) 13.403 8.191 ( 1.588 -4.222 12.621) 13.403 8.513 ( -16.050 8.294 2.927) 18.302 8.513 ( 16.050 8.294 -2.927) 18.302 8.688 ( 4.100 -1.552 -7.932) 9.063 8.688 ( -4.100 -1.552 7.932) 9.063 9.275 ( 2.326 11.822 -13.454) 18.060 9.275 ( -2.326 11.822 13.454) 18.060 9.899 ( -2.628 -4.526 -5.172) 7.358 9.899 ( 2.628 -4.526 5.172) 7.358 10.440 ( -2.750 0.654 -1.692) 3.294 10.440 ( 2.750 0.654 1.692) 3.294 10.824 ( -0.268 3.262 -0.838) 3.379 10.824 ( 0.268 3.262 0.838) 3.379 11.501 ( -0.354 -5.562 -5.029) 7.506 11.501 ( 0.354 -5.562 5.029) 7.506 12.087 ( 0.863 -2.045 -1.799) 2.857 12.087 ( -0.863 -2.045 1.799) 2.857 13.215 ( -2.660 -1.818 -3.503) 4.759 13.215 ( 2.660 -1.818 3.503) 4.759 13.516 ( 3.042 -1.045 -5.157) 6.078 13.516 ( -3.042 -1.045 5.157) 6.078 14.278 ( -0.964 -0.737 -1.646) 2.045 14.278 ( 0.964 -0.737 1.646) 2.045 14.797 ( -1.885 2.439 -1.171) 3.298 14.797 ( 1.885 2.439 1.171) 3.298 ======================= Grid point 495 (249/260) ======================= q-point: ( 0.00 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.596 ( -8.232 27.992 -19.188) 34.921 4.596 ( 8.232 27.992 19.188) 34.921 5.602 ( 2.064 27.649 -23.252) 36.185 5.602 ( -2.064 27.649 23.252) 36.185 6.613 ( -1.212 -21.628 -17.632) 27.931 6.613 ( 1.212 -21.628 17.632) 27.931 6.971 ( -11.254 -6.066 -3.856) 13.354 6.971 ( 11.254 -6.066 3.856) 13.354 7.506 ( -2.479 1.641 -17.306) 17.560 7.506 ( 2.479 1.641 17.306) 17.560 8.119 ( 2.598 -3.257 -8.756) 9.697 8.119 ( -2.598 -3.257 8.756) 9.697 8.591 ( 9.329 8.169 -15.599) 19.927 8.591 ( -9.329 8.169 15.599) 19.927 8.717 ( 1.880 0.409 -7.454) 7.698 8.717 ( -1.880 0.409 7.454) 7.698 9.720 ( -5.634 -0.766 -14.658) 15.722 9.720 ( 5.634 -0.766 14.658) 15.722 10.105 ( -3.180 -6.941 -15.502) 17.280 10.105 ( 3.180 -6.941 15.502) 17.280 10.946 ( 3.141 3.064 -6.162) 7.564 10.946 ( -3.141 3.064 6.162) 7.564 11.018 ( 0.478 -2.552 -4.955) 5.594 11.018 ( -0.478 -2.552 4.955) 5.594 11.691 ( -1.837 0.523 -0.027) 1.911 11.691 ( 1.837 0.523 0.027) 1.911 12.101 ( -3.651 -3.472 -4.682) 6.879 12.101 ( 3.651 -3.472 4.682) 6.879 13.289 ( -0.470 3.706 -3.737) 5.284 13.289 ( 0.470 3.706 3.737) 5.284 13.688 ( -1.912 -6.074 -4.146) 7.599 13.688 ( 1.912 -6.074 4.146) 7.599 14.197 ( 0.660 4.981 -0.943) 5.112 14.197 ( -0.660 4.981 0.943) 5.112 14.364 ( -3.798 -0.327 -0.343) 3.827 14.364 ( 3.798 -0.327 0.343) 3.827 ======================= Grid point 497 (250/260) ======================= q-point: ( 0.10 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.421 ( 7.655 30.321 -21.179) 37.769 5.010 ( 19.095 21.234 16.336) 32.899 5.491 ( 7.666 24.965 -24.824) 36.031 5.816 ( 5.062 26.029 20.963) 33.802 6.446 ( -1.675 -18.527 -18.246) 26.057 6.715 ( -10.192 -9.104 -2.192) 13.841 6.824 ( 5.466 -20.929 13.544) 25.522 7.168 ( 6.564 3.227 -5.176) 8.960 7.340 ( 1.023 2.697 -10.445) 10.836 7.680 ( 1.108 -4.060 16.225) 16.762 8.037 ( -4.875 2.062 -2.382) 5.804 8.118 ( -4.658 -8.882 6.136) 11.757 8.491 ( -6.497 6.805 1.755) 9.570 8.591 ( 3.256 1.255 -6.463) 7.345 8.778 ( 0.645 6.868 12.119) 13.945 8.889 ( 12.581 2.488 -0.288) 12.828 9.453 ( -8.691 0.789 -16.404) 18.580 9.882 ( -0.784 -2.935 1.876) 3.571 9.923 ( -2.529 -5.015 -4.483) 7.187 10.281 ( 1.578 -7.289 13.816) 15.700 10.851 ( -5.507 3.761 -7.221) 9.829 10.900 ( -3.575 1.030 -3.813) 5.327 10.991 ( -0.389 -0.685 -0.789) 1.115 11.025 ( -1.612 -3.653 0.330) 4.007 11.624 ( -3.931 1.164 -1.888) 4.513 11.686 ( -1.308 -2.107 -5.550) 6.079 11.988 ( -3.105 1.344 -1.112) 3.561 12.195 ( 2.127 -5.690 1.295) 6.211 13.208 ( -3.959 3.963 -0.196) 5.605 13.363 ( 3.264 2.755 0.097) 4.272 13.595 ( -4.335 -5.677 -3.176) 7.817 13.720 ( -2.751 -6.292 4.183) 8.041 14.140 ( -2.323 4.810 2.465) 5.882 14.252 ( 1.562 4.099 -1.011) 4.501 14.379 ( 5.045 0.999 1.529) 5.365 14.480 ( 7.058 -0.650 2.026) 7.372 ======================= Grid point 498 (251/260) ======================= q-point: ( 0.20 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.503 ( 20.030 26.502 -21.707) 39.683 5.444 ( 11.210 22.303 -20.425) 32.253 5.499 ( 18.152 11.361 6.433) 22.360 6.123 ( 8.955 14.219 17.813) 24.488 6.219 ( -8.212 -8.529 -13.101) 17.658 6.554 ( -3.307 -9.719 -3.091) 10.722 7.029 ( 2.064 -2.695 2.463) 4.194 7.140 ( 6.298 1.058 -2.420) 6.830 7.419 ( 8.771 1.664 -3.105) 9.452 7.825 ( 0.411 -9.428 14.834) 17.582 7.954 ( -3.190 4.227 2.800) 5.990 8.073 ( -4.980 -9.818 5.214) 12.181 8.387 ( -4.319 3.520 -2.664) 6.176 8.607 ( 4.590 -2.662 -9.256) 10.670 8.916 ( -1.808 11.769 23.094) 25.983 9.115 ( 9.968 4.507 -4.973) 12.017 9.161 ( -4.303 1.830 -13.533) 14.318 9.685 ( -8.002 -4.393 -11.048) 14.331 9.977 ( -1.277 -1.688 7.014) 7.326 10.319 ( -7.887 -4.787 4.322) 10.188 10.697 ( -2.648 2.777 -10.699) 11.367 10.795 ( -3.380 -1.065 0.616) 3.597 10.949 ( -4.266 -1.808 -2.428) 5.231 10.989 ( -0.895 -1.885 -1.225) 2.420 11.500 ( -7.280 0.156 -2.930) 7.849 11.592 ( -0.850 -2.025 -8.186) 8.475 11.973 ( 0.378 2.073 0.762) 2.241 12.199 ( -2.173 -5.800 0.306) 6.201 13.149 ( -2.506 3.281 0.508) 4.160 13.399 ( 0.355 1.997 -0.312) 2.052 13.494 ( -3.194 -5.976 -2.961) 7.394 13.665 ( -6.252 -4.929 3.731) 8.792 14.153 ( 0.742 3.868 3.043) 4.977 14.271 ( 1.112 2.129 0.280) 2.418 14.517 ( 7.490 2.731 1.950) 8.208 14.633 ( 7.003 -0.727 2.638) 7.518 ======================= Grid point 499 (252/260) ======================= q-point: ( 0.30 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.746 ( 24.649 18.680 -20.185) 36.932 5.449 ( 12.974 13.634 -25.417) 31.626 5.750 ( -2.438 -2.679 -2.104) 4.189 6.047 ( -0.551 8.249 5.489) 9.924 6.255 ( -5.582 -8.040 6.454) 11.724 6.641 ( 9.170 11.731 6.922) 16.420 7.038 ( 5.296 7.750 -4.987) 10.629 7.283 ( 4.984 -1.923 0.449) 5.361 7.601 ( 10.970 -4.569 2.503) 12.144 7.913 ( -3.472 -12.604 10.032) 16.479 7.961 ( -3.790 5.326 9.760) 11.746 8.072 ( 6.207 -5.778 -1.458) 8.604 8.300 ( -2.752 1.229 -1.802) 3.512 8.594 ( 3.717 -4.278 -10.650) 12.064 8.910 ( -1.945 6.576 -16.332) 17.713 9.087 ( -2.631 13.951 24.766) 28.547 9.358 ( 12.475 3.167 -0.754) 12.893 9.430 ( -11.333 -0.546 -5.667) 12.683 9.973 ( -3.543 -0.950 2.273) 4.315 10.117 ( -11.093 0.527 -4.362) 11.932 10.552 ( -2.998 0.963 -9.437) 9.948 10.767 ( -5.927 -5.838 -4.266) 9.349 10.847 ( -0.712 2.520 1.630) 3.084 10.959 ( -1.856 -0.263 -0.424) 1.922 11.360 ( -5.218 -1.787 -0.621) 5.550 11.522 ( -0.035 -3.896 -7.688) 8.619 11.985 ( 0.442 0.019 -0.140) 0.464 12.140 ( -4.317 -5.083 1.143) 6.766 13.127 ( -0.666 2.029 1.199) 2.449 13.351 ( -4.163 -0.541 -0.924) 4.298 13.456 ( 1.005 -4.174 -2.984) 5.228 13.577 ( -6.198 -3.668 3.508) 8.011 14.199 ( 1.394 2.556 2.652) 3.938 14.292 ( 0.604 0.897 0.387) 1.149 14.666 ( 6.692 3.217 1.911) 7.667 14.765 ( 4.873 -0.099 2.314) 5.395 ======================= Grid point 500 (253/260) ======================= q-point: ( 0.40 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.026 ( 21.692 9.586 -15.762) 28.476 5.519 ( 4.463 3.188 -12.873) 13.993 5.530 ( -1.329 1.306 -9.506) 9.687 5.974 ( -16.965 -3.011 10.249) 20.048 6.374 ( 9.383 14.606 10.243) 20.157 6.758 ( -1.165 13.430 -1.150) 13.529 7.151 ( 11.043 0.342 -5.112) 12.174 7.355 ( 0.032 -1.983 4.968) 5.349 7.745 ( 1.427 -12.293 2.253) 12.579 7.878 ( -6.404 -12.307 5.491) 14.921 7.989 ( 2.103 1.340 4.914) 5.511 8.192 ( -1.285 -4.246 -2.119) 4.917 8.344 ( 15.216 5.310 -0.427) 16.121 8.610 ( 6.804 0.638 -6.118) 9.172 8.799 ( 1.539 5.883 -12.273) 13.696 9.059 ( -15.988 10.111 2.400) 19.068 9.349 ( 0.454 8.454 18.104) 19.986 9.558 ( 8.481 8.011 -1.329) 11.742 9.862 ( -8.010 1.709 -1.198) 8.278 9.934 ( -3.911 -0.970 -5.045) 6.457 10.453 ( -0.905 0.353 -5.222) 5.311 10.574 ( -7.115 -1.608 -6.722) 9.919 10.868 ( -0.352 2.039 2.022) 2.893 10.916 ( -2.306 1.062 -0.451) 2.578 11.318 ( -0.401 -5.633 2.520) 6.184 11.450 ( -1.466 -6.267 -6.384) 9.065 11.994 ( 1.435 -2.305 -1.216) 2.975 12.075 ( -4.159 -4.424 2.105) 6.426 13.143 ( 1.109 0.753 1.587) 2.078 13.265 ( -3.862 -0.982 -1.376) 4.216 13.455 ( 1.707 -3.683 -3.218) 5.180 13.507 ( -4.574 -3.344 3.457) 6.637 14.243 ( 1.309 1.400 1.834) 2.653 14.295 ( -0.377 0.317 -0.169) 0.521 14.784 ( 4.564 3.000 1.216) 5.595 14.841 ( 1.701 1.026 1.257) 2.351 ======================= Grid point 501 (254/260) ======================= q-point: ( 0.50 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.272 ( 16.361 1.754 -7.716) 18.174 5.272 ( -16.361 1.754 7.716) 18.174 5.724 ( 20.687 2.884 -15.890) 26.245 5.724 ( -20.687 2.884 15.890) 26.245 6.621 ( -3.279 15.081 -12.480) 19.848 6.621 ( 3.279 15.081 12.480) 19.848 7.309 ( 8.521 -3.189 -11.595) 14.738 7.309 ( -8.521 -3.189 11.595) 14.738 7.795 ( 3.573 -12.003 -3.831) 13.096 7.795 ( -3.573 -12.003 3.831) 13.096 8.095 ( -4.054 -3.813 -4.829) 7.368 8.095 ( 4.054 -3.813 4.829) 7.368 8.639 ( -10.254 2.993 -0.939) 10.723 8.639 ( 10.254 2.993 0.939) 10.723 8.782 ( 12.413 9.524 -9.681) 18.399 8.782 ( -12.413 9.524 9.681) 18.399 9.538 ( -4.045 13.260 -10.632) 17.470 9.538 ( 4.045 13.260 10.632) 17.470 9.830 ( -2.166 -1.928 -3.093) 4.240 9.830 ( 2.166 -1.928 3.093) 4.240 10.446 ( -0.990 -0.191 -2.536) 2.729 10.446 ( 0.990 -0.191 2.536) 2.729 10.880 ( -0.806 2.146 -0.779) 2.421 10.880 ( 0.806 2.146 0.779) 2.421 11.368 ( -0.727 -7.212 -6.009) 9.416 11.368 ( 0.727 -7.212 6.009) 9.416 12.024 ( 2.705 -3.800 -1.981) 5.068 12.024 ( -2.705 -3.800 1.981) 5.068 13.192 ( -1.370 -0.301 -2.794) 3.126 13.192 ( 1.370 -0.301 2.794) 3.126 13.468 ( 2.958 -3.522 -4.467) 6.411 13.468 ( -2.958 -3.522 4.467) 6.411 14.277 ( -1.042 0.549 -0.976) 1.529 14.277 ( 1.042 0.549 0.976) 1.529 14.847 ( -0.696 2.198 -0.739) 2.421 14.847 ( 0.696 2.198 0.739) 2.421 ======================= Grid point 507 (255/260) ======================= q-point: ( 0.00 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.119 ( -3.484 19.904 -12.138) 23.572 5.119 ( 3.484 19.904 12.138) 23.572 5.965 ( 2.777 -0.035 -13.215) 13.504 5.965 ( -2.777 -0.035 13.215) 13.504 6.268 ( -3.574 -2.819 -15.508) 16.162 6.268 ( 3.574 -2.819 15.508) 16.162 6.821 ( -5.988 -7.235 -11.935) 15.187 6.821 ( 5.988 -7.235 11.935) 15.187 7.610 ( -3.973 7.173 -2.408) 8.546 7.610 ( 3.973 7.173 2.408) 8.546 7.950 ( 3.378 -9.794 -5.554) 11.755 7.950 ( -3.378 -9.794 5.554) 11.755 8.735 ( -2.037 5.216 -6.090) 8.273 8.735 ( 2.037 5.216 6.090) 8.273 8.779 ( -5.660 2.415 -0.421) 6.168 8.779 ( 5.660 2.415 0.421) 6.168 9.760 ( -2.947 5.120 -17.553) 18.521 9.760 ( 2.947 5.120 17.553) 18.521 9.927 ( -1.700 -9.662 -18.511) 20.950 9.927 ( 1.700 -9.662 18.511) 20.950 10.965 ( -0.337 -0.532 -1.580) 1.701 10.965 ( 0.337 -0.532 1.580) 1.701 11.010 ( -0.299 0.876 -2.242) 2.425 11.010 ( 0.299 0.876 2.242) 2.425 11.700 ( 0.304 0.270 -0.318) 0.516 11.700 ( -0.304 0.270 0.318) 0.516 12.050 ( -1.034 -1.395 -2.000) 2.649 12.050 ( 1.034 -1.395 2.000) 2.649 13.363 ( -0.727 3.073 -2.833) 4.242 13.363 ( 0.727 3.073 2.833) 4.242 13.573 ( -1.174 -4.331 -2.615) 5.194 13.573 ( 1.174 -4.331 2.615) 5.194 14.287 ( -3.477 3.618 -0.005) 5.018 14.287 ( 3.477 3.618 0.005) 5.018 14.345 ( -3.883 -1.648 -0.268) 4.226 14.345 ( 3.883 -1.648 0.268) 4.226 ======================= Grid point 509 (256/260) ======================= q-point: ( 0.10 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.027 ( 6.308 27.614 -16.133) 32.597 5.337 ( 11.359 4.393 4.519) 12.990 5.927 ( 3.576 14.181 -8.767) 17.051 6.072 ( -0.862 -2.857 -14.925) 15.221 6.085 ( 4.039 -5.433 5.630) 8.806 6.377 ( 1.070 -20.087 -5.431) 20.836 6.769 ( 3.980 13.019 10.663) 17.292 7.073 ( 7.445 -12.877 15.694) 21.623 7.480 ( -6.156 11.326 -2.163) 13.071 7.677 ( 0.280 -2.285 0.742) 2.418 7.890 ( -0.833 -3.938 -1.546) 4.312 8.001 ( 2.968 -7.835 -2.332) 8.697 8.592 ( -9.260 3.101 2.297) 10.032 8.617 ( -4.618 1.071 -3.652) 5.984 8.922 ( 4.187 6.335 13.365) 15.371 8.973 ( 10.762 2.020 1.709) 11.082 9.531 ( -4.478 7.472 -19.218) 21.100 9.731 ( -2.352 -10.640 -18.319) 21.314 9.927 ( 0.506 5.250 13.762) 14.738 10.095 ( 0.499 -10.107 15.445) 18.465 10.898 ( -2.696 1.048 -9.417) 9.851 10.913 ( -4.137 -0.043 -6.494) 7.700 10.976 ( -1.705 0.187 2.061) 2.681 10.992 ( -2.613 -0.680 0.670) 2.782 11.644 ( -3.589 0.790 -3.424) 5.022 11.659 ( -2.247 -0.801 -5.470) 5.967 12.024 ( -0.962 2.316 1.125) 2.749 12.090 ( 0.401 -4.365 2.110) 4.865 13.299 ( -2.905 5.057 -2.019) 6.172 13.391 ( 0.377 -2.123 -0.948) 2.356 13.514 ( -3.860 0.199 0.937) 3.977 13.593 ( -2.273 -5.812 3.800) 7.306 14.231 ( -1.978 3.882 1.500) 4.608 14.285 ( -1.464 -1.024 0.572) 1.876 14.416 ( 7.588 2.587 0.783) 8.054 14.461 ( 7.166 -1.540 1.404) 7.463 ======================= Grid point 510 (257/260) ======================= q-point: ( 0.20 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.061 ( 12.630 27.509 -18.399) 35.423 5.532 ( 10.153 -13.926 -9.157) 19.516 5.834 ( 1.497 14.310 -21.339) 25.737 6.070 ( -2.239 -8.874 -1.981) 9.364 6.134 ( 8.387 7.456 -1.565) 11.331 6.438 ( 7.994 -14.083 7.531) 17.859 7.025 ( 7.987 12.970 14.737) 21.194 7.312 ( 4.025 -9.071 12.104) 15.652 7.384 ( -1.736 10.934 -0.220) 11.073 7.654 ( -2.871 -11.696 2.859) 12.378 7.921 ( 6.306 3.796 -2.814) 7.880 8.031 ( 0.245 -2.655 3.422) 4.338 8.445 ( -7.647 2.411 -0.320) 8.025 8.515 ( -3.105 -4.628 -4.464) 7.140 9.109 ( 2.343 6.405 14.672) 16.180 9.174 ( 7.942 -0.046 2.236) 8.251 9.310 ( -0.932 11.924 -16.310) 20.225 9.542 ( -2.705 -9.775 -14.842) 17.976 10.009 ( -1.329 5.403 7.542) 9.373 10.174 ( -3.233 -9.164 7.404) 12.216 10.736 ( -4.571 1.277 -10.840) 11.834 10.761 ( -5.308 -1.518 -6.213) 8.311 10.939 ( -2.823 0.878 0.013) 2.957 10.964 ( -1.310 -1.229 0.361) 1.832 11.516 ( -5.921 1.567 -5.165) 8.012 11.555 ( -2.921 -1.933 -7.360) 8.152 12.018 ( -1.433 2.566 1.819) 3.456 12.089 ( -2.395 -4.603 2.000) 5.561 13.233 ( -2.422 5.221 -1.519) 5.953 13.358 ( -2.021 -6.755 -2.477) 7.474 13.462 ( -3.403 3.900 2.569) 5.778 13.557 ( -4.811 -5.269 3.779) 8.074 14.232 ( 0.207 3.497 1.803) 3.939 14.281 ( 0.069 -1.129 1.002) 1.511 14.573 ( 8.054 2.583 1.600) 8.608 14.614 ( 7.548 -1.388 2.082) 7.952 ======================= Grid point 511 (258/260) ======================= q-point: ( 0.30 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.154 ( 13.458 20.643 -18.121) 30.588 5.538 ( 2.112 -15.573 -14.792) 21.582 5.707 ( 3.798 11.180 -18.196) 21.691 5.943 ( -3.718 -12.176 -5.334) 13.803 6.399 ( 12.489 16.149 8.915) 22.276 6.696 ( 10.337 -9.849 9.742) 17.285 7.187 ( -0.426 10.653 5.767) 12.121 7.353 ( -1.364 5.333 2.435) 6.019 7.472 ( 2.877 -5.680 6.322) 8.972 7.645 ( -3.075 -13.161 6.246) 14.889 8.062 ( -2.094 3.738 8.464) 9.487 8.074 ( 7.958 3.095 1.232) 8.627 8.329 ( -2.178 2.819 -1.898) 4.036 8.458 ( 4.747 -8.285 -8.025) 12.473 9.083 ( -0.477 9.838 -14.715) 17.707 9.261 ( -0.616 -6.371 -2.382) 6.830 9.368 ( 2.449 9.150 9.992) 13.768 9.467 ( 5.781 -0.227 1.986) 6.117 10.003 ( -2.928 3.972 0.608) 4.972 10.098 ( -6.279 -3.411 -2.476) 7.562 10.573 ( -3.864 1.564 -8.440) 9.414 10.639 ( -3.744 -5.382 -5.265) 8.409 10.900 ( -1.488 2.432 1.131) 3.067 10.940 ( -1.540 -1.529 0.448) 2.216 11.364 ( -6.032 2.142 -3.915) 7.503 11.435 ( -3.296 -4.370 -7.330) 9.148 11.995 ( -2.404 1.231 1.214) 2.961 12.045 ( -3.981 -3.796 2.253) 5.944 13.191 ( -1.096 4.365 -0.819) 4.574 13.296 ( -2.725 -5.280 -1.350) 6.093 13.425 ( -2.349 1.897 0.968) 3.170 13.493 ( -5.133 -4.199 3.163) 7.347 14.256 ( 0.676 2.614 1.458) 3.069 14.293 ( 0.186 -0.896 0.759) 1.189 14.723 ( 6.616 2.334 1.675) 7.213 14.757 ( 5.881 -0.930 1.975) 6.273 ======================= Grid point 512 (259/260) ======================= q-point: ( 0.40 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 450 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.231 ( 9.278 10.033 -12.958) 18.832 5.412 ( -3.702 -7.443 -8.283) 11.735 5.689 ( 7.950 8.150 -12.128) 16.635 5.853 ( -4.336 -7.727 -0.214) 8.863 6.691 ( 11.352 15.625 7.591) 20.752 6.930 ( 6.657 -3.261 5.436) 9.193 7.167 ( -2.680 6.090 0.445) 6.669 7.315 ( -4.786 -3.080 2.293) 6.137 7.536 ( 0.697 -5.050 1.638) 5.354 7.622 ( -4.427 -10.802 4.527) 12.521 8.038 ( -2.635 3.093 2.609) 4.829 8.112 ( -4.638 -3.950 1.503) 6.275 8.468 ( 14.734 6.527 0.787) 16.134 8.580 ( 10.351 -3.871 -0.830) 11.082 8.968 ( -0.040 9.146 -11.729) 14.873 9.111 ( -7.785 -3.881 -6.601) 10.919 9.556 ( 4.202 9.748 16.387) 19.525 9.652 ( 8.497 0.439 4.355) 9.558 9.919 ( -5.699 2.966 -1.790) 6.669 9.951 ( -4.594 0.845 -6.859) 8.298 10.462 ( -1.781 1.175 -5.566) 5.961 10.516 ( -3.878 -3.639 -6.334) 8.270 10.902 ( -0.214 1.251 2.003) 2.371 10.920 ( -1.088 -0.459 0.672) 1.359 11.253 ( -3.255 0.018 -0.954) 3.392 11.319 ( -3.202 -5.815 -5.501) 8.621 11.962 ( -1.440 -0.288 0.265) 1.492 11.992 ( -3.519 -3.185 1.999) 5.150 13.180 ( 0.461 2.859 -0.321) 2.914 13.241 ( -2.470 -2.231 -0.418) 3.354 13.398 ( -0.582 -0.772 -0.675) 1.179 13.432 ( -3.885 -3.413 2.485) 5.738 14.277 ( 0.555 1.582 0.871) 1.890 14.297 ( -0.188 -0.338 0.233) 0.452 14.833 ( 3.930 1.749 1.023) 4.422 14.852 ( 2.917 -0.127 1.180) 3.149 ======================= Grid point 513 (260/260) ======================= q-point: ( 0.50 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.298 ( 5.704 0.679 -2.658) 6.330 5.298 ( -5.704 0.679 2.658) 6.330 5.766 ( 7.834 1.080 -6.062) 9.964 5.766 ( -7.834 1.080 6.062) 9.964 6.920 ( -2.024 13.041 -8.723) 15.819 6.920 ( 2.024 13.041 8.723) 15.819 7.214 ( 1.573 -6.529 -7.220) 9.861 7.214 ( -1.573 -6.529 7.220) 9.861 7.569 ( 2.206 -7.606 -3.000) 8.469 7.569 ( -2.206 -7.606 3.000) 8.469 8.046 ( -1.860 -1.142 -1.007) 2.404 8.046 ( 1.860 -1.142 1.007) 2.404 8.685 ( -2.736 1.399 -1.367) 3.363 8.685 ( 2.736 1.399 1.367) 3.363 8.931 ( 6.063 3.926 -2.852) 7.766 8.931 ( -6.063 3.926 2.852) 7.766 9.762 ( -3.212 7.225 -11.513) 13.967 9.762 ( 3.212 7.225 11.513) 13.967 9.819 ( 0.480 0.194 -10.627) 10.639 9.819 ( -0.480 0.194 10.627) 10.639 10.431 ( -0.146 -0.974 -2.035) 2.261 10.431 ( 0.146 -0.974 2.035) 2.261 10.911 ( -0.158 0.930 -0.210) 0.967 10.911 ( 0.158 0.930 0.210) 0.967 11.241 ( -0.555 -4.121 -3.193) 5.243 11.241 ( 0.555 -4.121 3.193) 5.243 11.958 ( 1.339 -2.040 -0.937) 2.614 11.958 ( -1.339 -2.040 0.937) 2.614 13.200 ( 0.017 0.693 -1.477) 1.632 13.200 ( -0.017 0.693 1.477) 1.632 13.398 ( 1.700 -2.543 -2.260) 3.803 13.398 ( -1.700 -2.543 2.260) 3.803 14.291 ( -0.414 0.540 -0.321) 0.753 14.291 ( 0.414 0.540 0.321) 0.753 14.879 ( -0.126 0.858 -0.264) 0.906 14.879 ( 0.126 0.858 0.264) 0.906 =================== 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 3/32400 10.0 98331.672 53405.308 71792.417 0.000 -19.821 0.000 3/32400 20.0 26033.529 22916.440 24530.890 0.000 -4869.618 0.000 3/32400 30.0 9568.499 9723.689 9069.737 0.000 -2053.581 0.000 3/32400 40.0 4093.559 4488.311 3874.064 0.000 -843.238 0.000 3/32400 50.0 2029.195 2324.438 1940.015 0.000 -402.611 0.000 3/32400 60.0 1150.218 1351.781 1111.632 0.000 -224.220 0.000 3/32400 70.0 729.067 869.484 710.718 0.000 -141.188 0.000 3/32400 80.0 504.621 606.703 495.218 0.000 -97.396 0.000 3/32400 90.0 373.682 451.179 368.715 0.000 -71.857 0.000 3/32400 100.0 291.385 352.491 288.850 0.000 -55.744 0.000 3/32400 110.0 236.414 286.147 235.324 0.000 -44.933 0.000 3/32400 120.0 197.824 239.366 197.642 0.000 -37.315 0.000 3/32400 130.0 169.600 205.049 170.010 0.000 -31.731 0.000 3/32400 140.0 148.242 179.029 149.049 0.000 -27.503 0.000 3/32400 150.0 131.612 158.745 132.687 0.000 -24.214 0.000 3/32400 160.0 118.347 142.556 119.604 0.000 -21.597 0.000 3/32400 170.0 107.546 129.372 108.926 0.000 -19.474 0.000 3/32400 180.0 98.594 118.449 100.056 0.000 -17.722 0.000 3/32400 190.0 91.062 109.262 92.574 0.000 -16.256 0.000 3/32400 200.0 84.638 101.433 86.180 0.000 -15.012 0.000 3/32400 210.0 79.097 94.686 80.652 0.000 -13.945 0.000 3/32400 220.0 74.269 88.811 75.825 0.000 -13.022 0.000 3/32400 230.0 70.022 83.650 71.571 0.000 -12.214 0.000 3/32400 240.0 66.258 79.080 67.794 0.000 -11.503 0.000 3/32400 250.0 62.897 75.005 64.416 0.000 -10.872 0.000 3/32400 260.0 59.877 71.347 61.375 0.000 -10.308 0.000 3/32400 270.0 57.148 68.045 58.623 0.000 -9.802 0.000 3/32400 280.0 54.670 65.049 56.120 0.000 -9.344 0.000 3/32400 290.0 52.407 62.317 53.832 0.000 -8.929 0.000 3/32400 300.0 50.334 59.816 51.732 0.000 -8.550 0.000 3/32400 310.0 48.425 57.517 49.797 0.000 -8.203 0.000 3/32400 320.0 46.663 55.395 48.009 0.000 -7.885 0.000 3/32400 330.0 45.030 53.431 46.350 0.000 -7.591 0.000 3/32400 340.0 43.513 51.608 44.807 0.000 -7.319 0.000 3/32400 350.0 42.099 49.910 43.367 0.000 -7.067 0.000 3/32400 360.0 40.777 48.325 42.021 0.000 -6.832 0.000 3/32400 370.0 39.540 46.841 40.759 0.000 -6.613 0.000 3/32400 380.0 38.378 45.450 39.574 0.000 -6.408 0.000 3/32400 390.0 37.285 44.141 38.458 0.000 -6.216 0.000 3/32400 400.0 36.255 42.909 37.405 0.000 -6.035 0.000 3/32400 410.0 35.282 41.746 36.411 0.000 -5.865 0.000 3/32400 420.0 34.362 40.647 35.469 0.000 -5.705 0.000 3/32400 430.0 33.490 39.606 34.577 0.000 -5.553 0.000 3/32400 440.0 32.663 38.619 33.730 0.000 -5.410 0.000 3/32400 450.0 31.877 37.681 32.924 0.000 -5.274 0.000 3/32400 460.0 31.129 36.789 32.157 0.000 -5.145 0.000 3/32400 470.0 30.417 35.940 31.426 0.000 -5.023 0.000 3/32400 480.0 29.737 35.130 30.729 0.000 -4.906 0.000 3/32400 490.0 29.087 34.357 30.062 0.000 -4.795 0.000 3/32400 500.0 28.467 33.619 29.425 0.000 -4.689 0.000 3/32400 510.0 27.873 32.912 28.815 0.000 -4.588 0.000 3/32400 520.0 27.303 32.235 28.230 0.000 -4.491 0.000 3/32400 530.0 26.757 31.586 27.668 0.000 -4.398 0.000 3/32400 540.0 26.233 30.963 27.130 0.000 -4.309 0.000 3/32400 550.0 25.730 30.365 26.612 0.000 -4.224 0.000 3/32400 560.0 25.246 29.791 26.114 0.000 -4.142 0.000 3/32400 570.0 24.780 29.238 25.635 0.000 -4.063 0.000 3/32400 580.0 24.332 28.706 25.173 0.000 -3.988 0.000 3/32400 590.0 23.900 28.193 24.728 0.000 -3.915 0.000 3/32400 600.0 23.483 27.698 24.299 0.000 -3.845 0.000 3/32400 610.0 23.081 27.221 23.884 0.000 -3.777 0.000 3/32400 620.0 22.692 26.761 23.484 0.000 -3.712 0.000 3/32400 630.0 22.317 26.316 23.097 0.000 -3.649 0.000 3/32400 640.0 21.954 25.886 22.723 0.000 -3.588 0.000 3/32400 650.0 21.603 25.470 22.361 0.000 -3.529 0.000 3/32400 660.0 21.263 25.067 22.011 0.000 -3.473 0.000 3/32400 670.0 20.934 24.677 21.671 0.000 -3.418 0.000 3/32400 680.0 20.615 24.299 21.342 0.000 -3.364 0.000 3/32400 690.0 20.305 23.933 21.023 0.000 -3.313 0.000 3/32400 700.0 20.006 23.578 20.714 0.000 -3.263 0.000 3/32400 710.0 19.714 23.234 20.414 0.000 -3.215 0.000 3/32400 720.0 19.432 22.899 20.122 0.000 -3.168 0.000 3/32400 730.0 19.157 22.575 19.838 0.000 -3.122 0.000 3/32400 740.0 18.891 22.259 19.563 0.000 -3.078 0.000 3/32400 750.0 18.631 21.952 19.295 0.000 -3.035 0.000 3/32400 760.0 18.379 21.654 19.035 0.000 -2.993 0.000 3/32400 770.0 18.134 21.364 18.781 0.000 -2.952 0.000 3/32400 780.0 17.895 21.081 18.535 0.000 -2.913 0.000 3/32400 790.0 17.662 20.807 18.295 0.000 -2.874 0.000 3/32400 800.0 17.436 20.539 18.061 0.000 -2.837 0.000 3/32400 810.0 17.215 20.278 17.833 0.000 -2.800 0.000 3/32400 820.0 17.000 20.024 17.610 0.000 -2.765 0.000 3/32400 830.0 16.790 19.776 17.394 0.000 -2.730 0.000 3/32400 840.0 16.585 19.534 17.182 0.000 -2.696 0.000 3/32400 850.0 16.386 19.298 16.976 0.000 -2.663 0.000 3/32400 860.0 16.191 19.068 16.774 0.000 -2.631 0.000 3/32400 870.0 16.001 18.844 16.578 0.000 -2.600 0.000 3/32400 880.0 15.815 18.624 16.386 0.000 -2.569 0.000 3/32400 890.0 15.634 18.410 16.198 0.000 -2.539 0.000 3/32400 900.0 15.456 18.201 16.015 0.000 -2.510 0.000 3/32400 910.0 15.283 17.996 15.836 0.000 -2.482 0.000 3/32400 920.0 15.114 17.796 15.661 0.000 -2.454 0.000 3/32400 930.0 14.948 17.601 15.489 0.000 -2.427 0.000 3/32400 940.0 14.786 17.409 15.322 0.000 -2.400 0.000 3/32400 950.0 14.628 17.222 15.158 0.000 -2.374 0.000 3/32400 960.0 14.472 17.039 14.997 0.000 -2.349 0.000 3/32400 970.0 14.321 16.860 14.840 0.000 -2.324 0.000 3/32400 980.0 14.172 16.685 14.687 0.000 -2.299 0.000 3/32400 990.0 14.026 16.513 14.536 0.000 -2.275 0.000 3/32400 1000.0 13.884 16.345 14.389 0.000 -2.252 0.000 3/32400 Thermal conductivity related properties were written into "kappa-m10910.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:33:10]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|