----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 21:02:19]------------------------- 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: [2 3 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 5.514723080193857 0.000000000000000 0.000000000000000 b 0.000000000000000 3.970354160000000 0.000000000000000 c -2.858555900421121 0.000000000000000 7.395463018757192 Atomic positions (fractional): *1 K 0.22145271521686 0.24908382323711 0.43039347130822 39.098 2 K 0.22145271521686 0.25091617676289 0.93039347130822 39.098 3 K 0.77854728478314 0.75091617676289 0.56960652869178 39.098 4 K 0.77854728478314 0.74908382323711 0.06960652869178 39.098 *5 H 0.55608685081125 0.40397469725648 0.26406811886231 1.008 6 H 0.55608685081125 0.09602530274352 0.76406811886231 1.008 7 H 0.44391314918875 0.59602530274352 0.73593188113769 1.008 8 H 0.44391314918875 0.90397469725648 0.23593188113769 1.008 *9 O 0.69581312891683 0.22871722080781 0.29852800041614 15.999 10 O 0.69581312891683 0.27128277919219 0.79852800041614 15.999 11 O 0.30418687108317 0.77128277919219 0.70147199958386 15.999 12 O 0.30418687108317 0.72871722080781 0.20147199958386 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.514723080193857 0.000000000000000 0.000000000000000 b 0.000000000000000 3.970354160000000 0.000000000000000 c -2.858555900421121 0.000000000000000 7.395463018757192 Atomic positions (fractional): *1 K 0.22145271521686 0.24908382323711 0.43039347130822 39.098 > 1 2 K 0.22145271521686 0.25091617676289 0.93039347130822 39.098 > 2 3 K 0.77854728478314 0.75091617676289 0.56960652869178 39.098 > 3 4 K 0.77854728478314 0.74908382323711 0.06960652869178 39.098 > 4 *5 H 0.55608685081125 0.40397469725648 0.26406811886231 1.008 > 5 6 H 0.55608685081125 0.09602530274352 0.76406811886231 1.008 > 6 7 H 0.44391314918875 0.59602530274352 0.73593188113769 1.008 > 7 8 H 0.44391314918875 0.90397469725648 0.23593188113769 1.008 > 8 *9 O 0.69581312891683 0.22871722080781 0.29852800041614 15.999 > 9 10 O 0.69581312891683 0.27128277919219 0.79852800041614 15.999 > 10 11 O 0.30418687108317 0.77128277919219 0.70147199958386 15.999 > 11 12 O 0.30418687108317 0.72871722080781 0.20147199958386 15.999 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.029446160387714 0.000000000000000 0.000000000000000 b 0.000000000000000 11.911062480000000 0.000000000000000 c -5.717111800842242 0.000000000000000 14.790926037514383 Atomic positions (fractional): *1 K 0.11072635760843 0.08302794107904 0.21519673565411 39.098 > 1 2 K 0.61072635760843 0.08302794107904 0.21519673565411 39.098 > 1 3 K 0.11072635760843 0.41636127441237 0.21519673565411 39.098 > 1 4 K 0.61072635760843 0.41636127441237 0.21519673565411 39.098 > 1 5 K 0.11072635760843 0.74969460774570 0.21519673565411 39.098 > 1 6 K 0.61072635760843 0.74969460774570 0.21519673565411 39.098 > 1 7 K 0.11072635760843 0.08302794107904 0.71519673565411 39.098 > 1 8 K 0.61072635760843 0.08302794107904 0.71519673565411 39.098 > 1 9 K 0.11072635760843 0.41636127441237 0.71519673565411 39.098 > 1 10 K 0.61072635760843 0.41636127441237 0.71519673565411 39.098 > 1 11 K 0.11072635760843 0.74969460774570 0.71519673565411 39.098 > 1 12 K 0.61072635760843 0.74969460774570 0.71519673565411 39.098 > 1 13 K 0.11072635760843 0.08363872558763 0.46519673565411 39.098 > 2 14 K 0.61072635760843 0.08363872558763 0.46519673565411 39.098 > 2 15 K 0.11072635760843 0.41697205892096 0.46519673565411 39.098 > 2 16 K 0.61072635760843 0.41697205892096 0.46519673565411 39.098 > 2 17 K 0.11072635760843 0.75030539225430 0.46519673565411 39.098 > 2 18 K 0.61072635760843 0.75030539225430 0.46519673565411 39.098 > 2 19 K 0.11072635760843 0.08363872558763 0.96519673565411 39.098 > 2 20 K 0.61072635760843 0.08363872558763 0.96519673565411 39.098 > 2 21 K 0.11072635760843 0.41697205892096 0.96519673565411 39.098 > 2 22 K 0.61072635760843 0.41697205892096 0.96519673565411 39.098 > 2 23 K 0.11072635760843 0.75030539225430 0.96519673565411 39.098 > 2 24 K 0.61072635760843 0.75030539225430 0.96519673565411 39.098 > 2 25 K 0.38927364239157 0.25030539225430 0.28480326434589 39.098 > 3 26 K 0.88927364239157 0.25030539225430 0.28480326434589 39.098 > 3 27 K 0.38927364239157 0.58363872558763 0.28480326434589 39.098 > 3 28 K 0.88927364239157 0.58363872558763 0.28480326434589 39.098 > 3 29 K 0.38927364239157 0.91697205892096 0.28480326434589 39.098 > 3 30 K 0.88927364239157 0.91697205892096 0.28480326434589 39.098 > 3 31 K 0.38927364239157 0.25030539225430 0.78480326434589 39.098 > 3 32 K 0.88927364239157 0.25030539225430 0.78480326434589 39.098 > 3 33 K 0.38927364239157 0.58363872558763 0.78480326434589 39.098 > 3 34 K 0.88927364239157 0.58363872558763 0.78480326434589 39.098 > 3 35 K 0.38927364239157 0.91697205892096 0.78480326434589 39.098 > 3 36 K 0.88927364239157 0.91697205892096 0.78480326434589 39.098 > 3 37 K 0.38927364239157 0.24969460774570 0.03480326434589 39.098 > 4 38 K 0.88927364239157 0.24969460774570 0.03480326434589 39.098 > 4 39 K 0.38927364239157 0.58302794107904 0.03480326434589 39.098 > 4 40 K 0.88927364239157 0.58302794107904 0.03480326434589 39.098 > 4 41 K 0.38927364239157 0.91636127441237 0.03480326434589 39.098 > 4 42 K 0.88927364239157 0.91636127441237 0.03480326434589 39.098 > 4 43 K 0.38927364239157 0.24969460774570 0.53480326434589 39.098 > 4 44 K 0.88927364239157 0.24969460774570 0.53480326434589 39.098 > 4 45 K 0.38927364239157 0.58302794107904 0.53480326434589 39.098 > 4 46 K 0.88927364239157 0.58302794107904 0.53480326434589 39.098 > 4 47 K 0.38927364239157 0.91636127441237 0.53480326434589 39.098 > 4 48 K 0.88927364239157 0.91636127441237 0.53480326434589 39.098 > 4 *49 H 0.27804342540562 0.13465823241883 0.13203405943115 1.008 > 5 50 H 0.77804342540562 0.13465823241883 0.13203405943115 1.008 > 5 51 H 0.27804342540562 0.46799156575216 0.13203405943115 1.008 > 5 52 H 0.77804342540562 0.46799156575216 0.13203405943115 1.008 > 5 53 H 0.27804342540562 0.80132489908549 0.13203405943115 1.008 > 5 54 H 0.77804342540562 0.80132489908549 0.13203405943115 1.008 > 5 55 H 0.27804342540562 0.13465823241883 0.63203405943115 1.008 > 5 56 H 0.77804342540562 0.13465823241883 0.63203405943115 1.008 > 5 57 H 0.27804342540562 0.46799156575216 0.63203405943115 1.008 > 5 58 H 0.77804342540562 0.46799156575216 0.63203405943115 1.008 > 5 59 H 0.27804342540562 0.80132489908549 0.63203405943115 1.008 > 5 60 H 0.77804342540562 0.80132489908549 0.63203405943115 1.008 > 5 61 H 0.27804342540562 0.03200843424784 0.38203405943115 1.008 > 6 62 H 0.77804342540562 0.03200843424784 0.38203405943115 1.008 > 6 63 H 0.27804342540562 0.36534176758117 0.38203405943115 1.008 > 6 64 H 0.77804342540562 0.36534176758117 0.38203405943115 1.008 > 6 65 H 0.27804342540562 0.69867510091451 0.38203405943115 1.008 > 6 66 H 0.77804342540562 0.69867510091451 0.38203405943115 1.008 > 6 67 H 0.27804342540562 0.03200843424784 0.88203405943115 1.008 > 6 68 H 0.77804342540562 0.03200843424784 0.88203405943115 1.008 > 6 69 H 0.27804342540562 0.36534176758117 0.88203405943115 1.008 > 6 70 H 0.77804342540562 0.36534176758117 0.88203405943115 1.008 > 6 71 H 0.27804342540562 0.69867510091451 0.88203405943115 1.008 > 6 72 H 0.77804342540562 0.69867510091451 0.88203405943115 1.008 > 6 73 H 0.22195657459438 0.19867510091451 0.36796594056885 1.008 > 7 74 H 0.72195657459438 0.19867510091451 0.36796594056885 1.008 > 7 75 H 0.22195657459438 0.53200843424784 0.36796594056885 1.008 > 7 76 H 0.72195657459438 0.53200843424784 0.36796594056885 1.008 > 7 77 H 0.22195657459438 0.86534176758117 0.36796594056885 1.008 > 7 78 H 0.72195657459438 0.86534176758117 0.36796594056885 1.008 > 7 79 H 0.22195657459438 0.19867510091451 0.86796594056885 1.008 > 7 80 H 0.72195657459438 0.19867510091451 0.86796594056885 1.008 > 7 81 H 0.22195657459438 0.53200843424784 0.86796594056885 1.008 > 7 82 H 0.72195657459438 0.53200843424784 0.86796594056885 1.008 > 7 83 H 0.22195657459438 0.86534176758117 0.86796594056885 1.008 > 7 84 H 0.72195657459438 0.86534176758117 0.86796594056885 1.008 > 7 85 H 0.22195657459438 0.30132489908549 0.11796594056885 1.008 > 8 86 H 0.72195657459438 0.30132489908549 0.11796594056885 1.008 > 8 87 H 0.22195657459438 0.63465823241883 0.11796594056885 1.008 > 8 88 H 0.72195657459438 0.63465823241883 0.11796594056885 1.008 > 8 89 H 0.22195657459438 0.96799156575216 0.11796594056885 1.008 > 8 90 H 0.72195657459438 0.96799156575216 0.11796594056885 1.008 > 8 91 H 0.22195657459438 0.30132489908549 0.61796594056885 1.008 > 8 92 H 0.72195657459438 0.30132489908549 0.61796594056885 1.008 > 8 93 H 0.22195657459438 0.63465823241883 0.61796594056885 1.008 > 8 94 H 0.72195657459438 0.63465823241883 0.61796594056885 1.008 > 8 95 H 0.22195657459438 0.96799156575216 0.61796594056885 1.008 > 8 96 H 0.72195657459438 0.96799156575216 0.61796594056885 1.008 > 8 *97 O 0.34790656445841 0.07623907360260 0.14926400020807 15.999 > 9 98 O 0.84790656445841 0.07623907360260 0.14926400020807 15.999 > 9 99 O 0.34790656445841 0.40957240693594 0.14926400020807 15.999 > 9 100 O 0.84790656445841 0.40957240693594 0.14926400020807 15.999 > 9 101 O 0.34790656445841 0.74290574026927 0.14926400020807 15.999 > 9 102 O 0.84790656445841 0.74290574026927 0.14926400020807 15.999 > 9 103 O 0.34790656445841 0.07623907360260 0.64926400020807 15.999 > 9 104 O 0.84790656445841 0.07623907360260 0.64926400020807 15.999 > 9 105 O 0.34790656445841 0.40957240693594 0.64926400020807 15.999 > 9 106 O 0.84790656445841 0.40957240693594 0.64926400020807 15.999 > 9 107 O 0.34790656445841 0.74290574026927 0.64926400020807 15.999 > 9 108 O 0.84790656445841 0.74290574026927 0.64926400020807 15.999 > 9 109 O 0.34790656445841 0.09042759306406 0.39926400020807 15.999 > 10 110 O 0.84790656445841 0.09042759306406 0.39926400020807 15.999 > 10 111 O 0.34790656445841 0.42376092639740 0.39926400020807 15.999 > 10 112 O 0.84790656445841 0.42376092639740 0.39926400020807 15.999 > 10 113 O 0.34790656445841 0.75709425973073 0.39926400020807 15.999 > 10 114 O 0.84790656445841 0.75709425973073 0.39926400020807 15.999 > 10 115 O 0.34790656445841 0.09042759306406 0.89926400020807 15.999 > 10 116 O 0.84790656445841 0.09042759306406 0.89926400020807 15.999 > 10 117 O 0.34790656445841 0.42376092639740 0.89926400020807 15.999 > 10 118 O 0.84790656445841 0.42376092639740 0.89926400020807 15.999 > 10 119 O 0.34790656445841 0.75709425973073 0.89926400020807 15.999 > 10 120 O 0.84790656445841 0.75709425973073 0.89926400020807 15.999 > 10 121 O 0.15209343554159 0.25709425973073 0.35073599979193 15.999 > 11 122 O 0.65209343554159 0.25709425973073 0.35073599979193 15.999 > 11 123 O 0.15209343554159 0.59042759306406 0.35073599979193 15.999 > 11 124 O 0.65209343554159 0.59042759306406 0.35073599979193 15.999 > 11 125 O 0.15209343554159 0.92376092639740 0.35073599979193 15.999 > 11 126 O 0.65209343554159 0.92376092639740 0.35073599979193 15.999 > 11 127 O 0.15209343554159 0.25709425973073 0.85073599979193 15.999 > 11 128 O 0.65209343554159 0.25709425973073 0.85073599979193 15.999 > 11 129 O 0.15209343554159 0.59042759306406 0.85073599979193 15.999 > 11 130 O 0.65209343554159 0.59042759306406 0.85073599979193 15.999 > 11 131 O 0.15209343554159 0.92376092639740 0.85073599979193 15.999 > 11 132 O 0.65209343554159 0.92376092639740 0.85073599979193 15.999 > 11 133 O 0.15209343554159 0.24290574026927 0.10073599979193 15.999 > 12 134 O 0.65209343554159 0.24290574026927 0.10073599979193 15.999 > 12 135 O 0.15209343554159 0.57623907360260 0.10073599979193 15.999 > 12 136 O 0.65209343554159 0.57623907360260 0.10073599979193 15.999 > 12 137 O 0.15209343554159 0.90957240693594 0.10073599979193 15.999 > 12 138 O 0.65209343554159 0.90957240693594 0.10073599979193 15.999 > 12 139 O 0.15209343554159 0.24290574026927 0.60073599979193 15.999 > 12 140 O 0.65209343554159 0.24290574026927 0.60073599979193 15.999 > 12 141 O 0.15209343554159 0.57623907360260 0.60073599979193 15.999 > 12 142 O 0.65209343554159 0.57623907360260 0.60073599979193 15.999 > 12 143 O 0.15209343554159 0.90957240693594 0.60073599979193 15.999 > 12 144 O 0.65209343554159 0.90957240693594 0.60073599979193 15.999 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.5504827 0.0000000 0.0087174 0.0000000 2.6028448 0.0000000 0.0087175 0.0000000 2.5321226 -------------------------- Born effective charges -------------------------- 1 K 1.1506082 0.0133385 -0.0034132 0.0031491 1.1154641 -0.0248538 -0.0041211 -0.0200898 1.1598859 2 K 1.1506082 -0.0133385 -0.0034132 -0.0031491 1.1154641 0.0248538 -0.0041211 0.0200898 1.1598859 3 K 1.1506082 0.0133385 -0.0034132 0.0031491 1.1154641 -0.0248538 -0.0041211 -0.0200898 1.1598859 4 K 1.1506082 -0.0133385 -0.0034132 -0.0031491 1.1154641 0.0248538 -0.0041211 0.0200898 1.1598859 5 H 0.4685726 -0.3441403 0.1035092 -0.3865006 0.6837550 -0.1482194 0.1035758 -0.1313856 0.2372753 6 H 0.4685726 0.3441403 0.1035092 0.3865006 0.6837550 0.1482194 0.1035758 0.1313856 0.2372753 7 H 0.4685726 -0.3441403 0.1035092 -0.3865006 0.6837550 -0.1482194 0.1035758 -0.1313856 0.2372753 8 H 0.4685726 0.3441403 0.1035092 0.3865006 0.6837550 0.1482194 0.1035758 0.1313856 0.2372753 9 O -1.6191809 0.0084716 -0.1000960 0.0106720 -1.7992191 -0.0034472 -0.0994547 0.0029530 -1.3971612 10 O -1.6191809 -0.0084716 -0.1000960 -0.0106720 -1.7992191 0.0034472 -0.0994547 -0.0029530 -1.3971612 11 O -1.6191809 0.0084716 -0.1000960 0.0106720 -1.7992191 -0.0034472 -0.0994547 0.0029530 -1.3971612 12 O -1.6191809 -0.0084716 -0.1000960 -0.0106720 -1.7992191 0.0034472 -0.0994547 -0.0029530 -1.3971612 ---------------------------------------------------------------------------- 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: 2034 Number of blocks in projector: 2034 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: 246 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 246 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 246 Use standard eigh solver. Tree of FC basis block matrices: - (2034, 2008), data: False |-- (246, 243), data: True |-- (246, 243), data: True |-- (246, 243), data: True |-- (432, 427), data: True |-- (432, 426), data: True |-- (432, 426), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.006 Solver_block: 100 / 400 - Time: 4.593 Solver_block: 200 / 400 - Time: 4.691 Solver_block: 300 / 400 - Time: 4.701 Solver_block: 400 / 400 - Time: 4.681 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 18.725 --------------------------------- 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: 2034 Number of blocks in projector: 2034 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: 246 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 246 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 246 Use standard eigh solver. Tree of FC basis block matrices: - (2034, 2008), data: False |-- (246, 243), data: True |-- (246, 243), data: True |-- (246, 243), 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 21:02:59]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 21:03:00]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 3 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.514723080193857 0.000000000000000 0.000000000000000 b 0.000000000000000 3.970354160000000 0.000000000000000 c -2.858555900421121 0.000000000000000 7.395463018757192 Atomic positions (fractional): 1 K 0.22145271521686 0.24908382323711 0.43039347130822 39.098 2 K 0.22145271521686 0.25091617676289 0.93039347130822 39.098 3 K 0.77854728478314 0.75091617676289 0.56960652869178 39.098 4 K 0.77854728478314 0.74908382323711 0.06960652869178 39.098 5 H 0.55608685081125 0.40397469725648 0.26406811886231 1.008 6 H 0.55608685081125 0.09602530274352 0.76406811886231 1.008 7 H 0.44391314918875 0.59602530274352 0.73593188113769 1.008 8 H 0.44391314918875 0.90397469725648 0.23593188113769 1.008 9 O 0.69581312891683 0.22871722080781 0.29852800041614 15.999 10 O 0.69581312891683 0.27128277919219 0.79852800041614 15.999 11 O 0.30418687108317 0.77128277919219 0.70147199958386 15.999 12 O 0.30418687108317 0.72871722080781 0.20147199958386 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.029446160387714 0.000000000000000 0.000000000000000 b 0.000000000000000 11.911062480000000 0.000000000000000 c -5.717111800842242 0.000000000000000 14.790926037514383 Atomic positions (fractional): 1 K 0.11072635760843 0.08302794107904 0.21519673565411 39.098 > 1 2 K 0.61072635760843 0.08302794107904 0.21519673565411 39.098 > 1 3 K 0.11072635760843 0.41636127441237 0.21519673565411 39.098 > 1 4 K 0.61072635760843 0.41636127441237 0.21519673565411 39.098 > 1 5 K 0.11072635760843 0.74969460774570 0.21519673565411 39.098 > 1 6 K 0.61072635760843 0.74969460774570 0.21519673565411 39.098 > 1 7 K 0.11072635760843 0.08302794107904 0.71519673565411 39.098 > 1 8 K 0.61072635760843 0.08302794107904 0.71519673565411 39.098 > 1 9 K 0.11072635760843 0.41636127441237 0.71519673565411 39.098 > 1 10 K 0.61072635760843 0.41636127441237 0.71519673565411 39.098 > 1 11 K 0.11072635760843 0.74969460774570 0.71519673565411 39.098 > 1 12 K 0.61072635760843 0.74969460774570 0.71519673565411 39.098 > 1 13 K 0.11072635760843 0.08363872558763 0.46519673565411 39.098 > 13 14 K 0.61072635760843 0.08363872558763 0.46519673565411 39.098 > 13 15 K 0.11072635760843 0.41697205892096 0.46519673565411 39.098 > 13 16 K 0.61072635760843 0.41697205892096 0.46519673565411 39.098 > 13 17 K 0.11072635760843 0.75030539225430 0.46519673565411 39.098 > 13 18 K 0.61072635760843 0.75030539225430 0.46519673565411 39.098 > 13 19 K 0.11072635760843 0.08363872558763 0.96519673565411 39.098 > 13 20 K 0.61072635760843 0.08363872558763 0.96519673565411 39.098 > 13 21 K 0.11072635760843 0.41697205892096 0.96519673565411 39.098 > 13 22 K 0.61072635760843 0.41697205892096 0.96519673565411 39.098 > 13 23 K 0.11072635760843 0.75030539225430 0.96519673565411 39.098 > 13 24 K 0.61072635760843 0.75030539225430 0.96519673565411 39.098 > 13 25 K 0.38927364239157 0.25030539225430 0.28480326434589 39.098 > 25 26 K 0.88927364239157 0.25030539225430 0.28480326434589 39.098 > 25 27 K 0.38927364239157 0.58363872558763 0.28480326434589 39.098 > 25 28 K 0.88927364239157 0.58363872558763 0.28480326434589 39.098 > 25 29 K 0.38927364239157 0.91697205892096 0.28480326434589 39.098 > 25 30 K 0.88927364239157 0.91697205892096 0.28480326434589 39.098 > 25 31 K 0.38927364239157 0.25030539225430 0.78480326434589 39.098 > 25 32 K 0.88927364239157 0.25030539225430 0.78480326434589 39.098 > 25 33 K 0.38927364239157 0.58363872558763 0.78480326434589 39.098 > 25 34 K 0.88927364239157 0.58363872558763 0.78480326434589 39.098 > 25 35 K 0.38927364239157 0.91697205892096 0.78480326434589 39.098 > 25 36 K 0.88927364239157 0.91697205892096 0.78480326434589 39.098 > 25 37 K 0.38927364239157 0.24969460774570 0.03480326434589 39.098 > 37 38 K 0.88927364239157 0.24969460774570 0.03480326434589 39.098 > 37 39 K 0.38927364239157 0.58302794107904 0.03480326434589 39.098 > 37 40 K 0.88927364239157 0.58302794107904 0.03480326434589 39.098 > 37 41 K 0.38927364239157 0.91636127441237 0.03480326434589 39.098 > 37 42 K 0.88927364239157 0.91636127441237 0.03480326434589 39.098 > 37 43 K 0.38927364239157 0.24969460774570 0.53480326434589 39.098 > 37 44 K 0.88927364239157 0.24969460774570 0.53480326434589 39.098 > 37 45 K 0.38927364239157 0.58302794107904 0.53480326434589 39.098 > 37 46 K 0.88927364239157 0.58302794107904 0.53480326434589 39.098 > 37 47 K 0.38927364239157 0.91636127441237 0.53480326434589 39.098 > 37 48 K 0.88927364239157 0.91636127441237 0.53480326434589 39.098 > 37 49 H 0.27804342540562 0.13465823241883 0.13203405943115 1.008 > 49 50 H 0.77804342540562 0.13465823241883 0.13203405943115 1.008 > 49 51 H 0.27804342540562 0.46799156575216 0.13203405943115 1.008 > 49 52 H 0.77804342540562 0.46799156575216 0.13203405943115 1.008 > 49 53 H 0.27804342540562 0.80132489908549 0.13203405943115 1.008 > 49 54 H 0.77804342540562 0.80132489908549 0.13203405943115 1.008 > 49 55 H 0.27804342540562 0.13465823241883 0.63203405943115 1.008 > 49 56 H 0.77804342540562 0.13465823241883 0.63203405943115 1.008 > 49 57 H 0.27804342540562 0.46799156575216 0.63203405943115 1.008 > 49 58 H 0.77804342540562 0.46799156575216 0.63203405943115 1.008 > 49 59 H 0.27804342540562 0.80132489908549 0.63203405943115 1.008 > 49 60 H 0.77804342540562 0.80132489908549 0.63203405943115 1.008 > 49 61 H 0.27804342540562 0.03200843424784 0.38203405943115 1.008 > 61 62 H 0.77804342540562 0.03200843424784 0.38203405943115 1.008 > 61 63 H 0.27804342540562 0.36534176758117 0.38203405943115 1.008 > 61 64 H 0.77804342540562 0.36534176758117 0.38203405943115 1.008 > 61 65 H 0.27804342540562 0.69867510091451 0.38203405943115 1.008 > 61 66 H 0.77804342540562 0.69867510091451 0.38203405943115 1.008 > 61 67 H 0.27804342540562 0.03200843424784 0.88203405943115 1.008 > 61 68 H 0.77804342540562 0.03200843424784 0.88203405943115 1.008 > 61 69 H 0.27804342540562 0.36534176758117 0.88203405943115 1.008 > 61 70 H 0.77804342540562 0.36534176758117 0.88203405943115 1.008 > 61 71 H 0.27804342540562 0.69867510091451 0.88203405943115 1.008 > 61 72 H 0.77804342540562 0.69867510091451 0.88203405943115 1.008 > 61 73 H 0.22195657459438 0.19867510091451 0.36796594056885 1.008 > 73 74 H 0.72195657459438 0.19867510091451 0.36796594056885 1.008 > 73 75 H 0.22195657459438 0.53200843424784 0.36796594056885 1.008 > 73 76 H 0.72195657459438 0.53200843424784 0.36796594056885 1.008 > 73 77 H 0.22195657459438 0.86534176758117 0.36796594056885 1.008 > 73 78 H 0.72195657459438 0.86534176758117 0.36796594056885 1.008 > 73 79 H 0.22195657459438 0.19867510091451 0.86796594056885 1.008 > 73 80 H 0.72195657459438 0.19867510091451 0.86796594056885 1.008 > 73 81 H 0.22195657459438 0.53200843424784 0.86796594056885 1.008 > 73 82 H 0.72195657459438 0.53200843424784 0.86796594056885 1.008 > 73 83 H 0.22195657459438 0.86534176758117 0.86796594056885 1.008 > 73 84 H 0.72195657459438 0.86534176758117 0.86796594056885 1.008 > 73 85 H 0.22195657459438 0.30132489908549 0.11796594056885 1.008 > 85 86 H 0.72195657459438 0.30132489908549 0.11796594056885 1.008 > 85 87 H 0.22195657459438 0.63465823241883 0.11796594056885 1.008 > 85 88 H 0.72195657459438 0.63465823241883 0.11796594056885 1.008 > 85 89 H 0.22195657459438 0.96799156575216 0.11796594056885 1.008 > 85 90 H 0.72195657459438 0.96799156575216 0.11796594056885 1.008 > 85 91 H 0.22195657459438 0.30132489908549 0.61796594056885 1.008 > 85 92 H 0.72195657459438 0.30132489908549 0.61796594056885 1.008 > 85 93 H 0.22195657459438 0.63465823241883 0.61796594056885 1.008 > 85 94 H 0.72195657459438 0.63465823241883 0.61796594056885 1.008 > 85 95 H 0.22195657459438 0.96799156575216 0.61796594056885 1.008 > 85 96 H 0.72195657459438 0.96799156575216 0.61796594056885 1.008 > 85 97 O 0.34790656445841 0.07623907360260 0.14926400020807 15.999 > 97 98 O 0.84790656445841 0.07623907360260 0.14926400020807 15.999 > 97 99 O 0.34790656445841 0.40957240693594 0.14926400020807 15.999 > 97 100 O 0.84790656445841 0.40957240693594 0.14926400020807 15.999 > 97 101 O 0.34790656445841 0.74290574026927 0.14926400020807 15.999 > 97 102 O 0.84790656445841 0.74290574026927 0.14926400020807 15.999 > 97 103 O 0.34790656445841 0.07623907360260 0.64926400020807 15.999 > 97 104 O 0.84790656445841 0.07623907360260 0.64926400020807 15.999 > 97 105 O 0.34790656445841 0.40957240693594 0.64926400020807 15.999 > 97 106 O 0.84790656445841 0.40957240693594 0.64926400020807 15.999 > 97 107 O 0.34790656445841 0.74290574026927 0.64926400020807 15.999 > 97 108 O 0.84790656445841 0.74290574026927 0.64926400020807 15.999 > 97 109 O 0.34790656445841 0.09042759306406 0.39926400020807 15.999 > 109 110 O 0.84790656445841 0.09042759306406 0.39926400020807 15.999 > 109 111 O 0.34790656445841 0.42376092639740 0.39926400020807 15.999 > 109 112 O 0.84790656445841 0.42376092639740 0.39926400020807 15.999 > 109 113 O 0.34790656445841 0.75709425973073 0.39926400020807 15.999 > 109 114 O 0.84790656445841 0.75709425973073 0.39926400020807 15.999 > 109 115 O 0.34790656445841 0.09042759306406 0.89926400020807 15.999 > 109 116 O 0.84790656445841 0.09042759306406 0.89926400020807 15.999 > 109 117 O 0.34790656445841 0.42376092639740 0.89926400020807 15.999 > 109 118 O 0.84790656445841 0.42376092639740 0.89926400020807 15.999 > 109 119 O 0.34790656445841 0.75709425973073 0.89926400020807 15.999 > 109 120 O 0.84790656445841 0.75709425973073 0.89926400020807 15.999 > 109 121 O 0.15209343554159 0.25709425973073 0.35073599979193 15.999 > 121 122 O 0.65209343554159 0.25709425973073 0.35073599979193 15.999 > 121 123 O 0.15209343554159 0.59042759306406 0.35073599979193 15.999 > 121 124 O 0.65209343554159 0.59042759306406 0.35073599979193 15.999 > 121 125 O 0.15209343554159 0.92376092639740 0.35073599979193 15.999 > 121 126 O 0.65209343554159 0.92376092639740 0.35073599979193 15.999 > 121 127 O 0.15209343554159 0.25709425973073 0.85073599979193 15.999 > 121 128 O 0.65209343554159 0.25709425973073 0.85073599979193 15.999 > 121 129 O 0.15209343554159 0.59042759306406 0.85073599979193 15.999 > 121 130 O 0.65209343554159 0.59042759306406 0.85073599979193 15.999 > 121 131 O 0.15209343554159 0.92376092639740 0.85073599979193 15.999 > 121 132 O 0.65209343554159 0.92376092639740 0.85073599979193 15.999 > 121 133 O 0.15209343554159 0.24290574026927 0.10073599979193 15.999 > 133 134 O 0.65209343554159 0.24290574026927 0.10073599979193 15.999 > 133 135 O 0.15209343554159 0.57623907360260 0.10073599979193 15.999 > 133 136 O 0.65209343554159 0.57623907360260 0.10073599979193 15.999 > 133 137 O 0.15209343554159 0.90957240693594 0.10073599979193 15.999 > 133 138 O 0.65209343554159 0.90957240693594 0.10073599979193 15.999 > 133 139 O 0.15209343554159 0.24290574026927 0.60073599979193 15.999 > 133 140 O 0.65209343554159 0.24290574026927 0.60073599979193 15.999 > 133 141 O 0.15209343554159 0.57623907360260 0.60073599979193 15.999 > 133 142 O 0.65209343554159 0.57623907360260 0.60073599979193 15.999 > 133 143 O 0.15209343554159 0.90957240693594 0.60073599979193 15.999 > 133 144 O 0.65209343554159 0.90957240693594 0.60073599979193 15.999 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.5504827 0.0000000 0.0087174 0.0000000 2.6028448 0.0000000 0.0087175 0.0000000 2.5321226 -------------------------- Born effective charges -------------------------- 1 K 1.1506082 0.0133385 -0.0034132 0.0031491 1.1154641 -0.0248538 -0.0041211 -0.0200898 1.1598859 2 K 1.1506082 -0.0133385 -0.0034132 -0.0031491 1.1154641 0.0248538 -0.0041211 0.0200898 1.1598859 3 K 1.1506082 0.0133385 -0.0034132 0.0031491 1.1154641 -0.0248538 -0.0041211 -0.0200898 1.1598859 4 K 1.1506082 -0.0133385 -0.0034132 -0.0031491 1.1154641 0.0248538 -0.0041211 0.0200898 1.1598859 5 H 0.4685726 -0.3441403 0.1035092 -0.3865006 0.6837550 -0.1482194 0.1035758 -0.1313856 0.2372753 6 H 0.4685726 0.3441403 0.1035092 0.3865006 0.6837550 0.1482194 0.1035758 0.1313856 0.2372753 7 H 0.4685726 -0.3441403 0.1035092 -0.3865006 0.6837550 -0.1482194 0.1035758 -0.1313856 0.2372753 8 H 0.4685726 0.3441403 0.1035092 0.3865006 0.6837550 0.1482194 0.1035758 0.1313856 0.2372753 9 O -1.6191809 0.0084716 -0.1000960 0.0106720 -1.7992191 -0.0034472 -0.0994547 0.0029530 -1.3971612 10 O -1.6191809 -0.0084716 -0.1000960 -0.0106720 -1.7992191 0.0034472 -0.0994547 -0.0029530 -1.3971612 11 O -1.6191809 0.0084716 -0.1000960 0.0106720 -1.7992191 -0.0034472 -0.0994547 0.0029530 -1.3971612 12 O -1.6191809 -0.0084716 -0.1000960 -0.0106720 -1.7992191 0.0034472 -0.0994547 -0.0029530 -1.3971612 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0036 0.0000 0.0093] [ 0.0036 0.0000 -0.0093] Computing fc3[ 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] [-0.0036 0.0000 0.0093] [ 0.0036 0.0000 -0.0093] Computing fc3[ 97, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0036 0.0000 0.0093] [ 0.0036 0.0000 -0.0093] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000002 (yyy) 0.00000002 (yyy) 0.00000002 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (yx) -0.00000000 (yx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 21:03:20]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 21:03:21]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 3 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.514723080193857 0.000000000000000 0.000000000000000 b 0.000000000000000 3.970354160000000 0.000000000000000 c -2.858555900421121 0.000000000000000 7.395463018757192 Atomic positions (fractional): 1 K 0.22145271521686 0.24908382323711 0.43039347130822 39.098 2 K 0.22145271521686 0.25091617676289 0.93039347130822 39.098 3 K 0.77854728478314 0.75091617676289 0.56960652869178 39.098 4 K 0.77854728478314 0.74908382323711 0.06960652869178 39.098 5 H 0.55608685081125 0.40397469725648 0.26406811886231 1.008 6 H 0.55608685081125 0.09602530274352 0.76406811886231 1.008 7 H 0.44391314918875 0.59602530274352 0.73593188113769 1.008 8 H 0.44391314918875 0.90397469725648 0.23593188113769 1.008 9 O 0.69581312891683 0.22871722080781 0.29852800041614 15.999 10 O 0.69581312891683 0.27128277919219 0.79852800041614 15.999 11 O 0.30418687108317 0.77128277919219 0.70147199958386 15.999 12 O 0.30418687108317 0.72871722080781 0.20147199958386 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.029446160387714 0.000000000000000 0.000000000000000 b 0.000000000000000 11.911062480000000 0.000000000000000 c -5.717111800842242 0.000000000000000 14.790926037514383 Atomic positions (fractional): 1 K 0.11072635760843 0.08302794107904 0.21519673565411 39.098 > 1 2 K 0.61072635760843 0.08302794107904 0.21519673565411 39.098 > 1 3 K 0.11072635760843 0.41636127441237 0.21519673565411 39.098 > 1 4 K 0.61072635760843 0.41636127441237 0.21519673565411 39.098 > 1 5 K 0.11072635760843 0.74969460774570 0.21519673565411 39.098 > 1 6 K 0.61072635760843 0.74969460774570 0.21519673565411 39.098 > 1 7 K 0.11072635760843 0.08302794107904 0.71519673565411 39.098 > 1 8 K 0.61072635760843 0.08302794107904 0.71519673565411 39.098 > 1 9 K 0.11072635760843 0.41636127441237 0.71519673565411 39.098 > 1 10 K 0.61072635760843 0.41636127441237 0.71519673565411 39.098 > 1 11 K 0.11072635760843 0.74969460774570 0.71519673565411 39.098 > 1 12 K 0.61072635760843 0.74969460774570 0.71519673565411 39.098 > 1 13 K 0.11072635760843 0.08363872558763 0.46519673565411 39.098 > 13 14 K 0.61072635760843 0.08363872558763 0.46519673565411 39.098 > 13 15 K 0.11072635760843 0.41697205892096 0.46519673565411 39.098 > 13 16 K 0.61072635760843 0.41697205892096 0.46519673565411 39.098 > 13 17 K 0.11072635760843 0.75030539225430 0.46519673565411 39.098 > 13 18 K 0.61072635760843 0.75030539225430 0.46519673565411 39.098 > 13 19 K 0.11072635760843 0.08363872558763 0.96519673565411 39.098 > 13 20 K 0.61072635760843 0.08363872558763 0.96519673565411 39.098 > 13 21 K 0.11072635760843 0.41697205892096 0.96519673565411 39.098 > 13 22 K 0.61072635760843 0.41697205892096 0.96519673565411 39.098 > 13 23 K 0.11072635760843 0.75030539225430 0.96519673565411 39.098 > 13 24 K 0.61072635760843 0.75030539225430 0.96519673565411 39.098 > 13 25 K 0.38927364239157 0.25030539225430 0.28480326434589 39.098 > 25 26 K 0.88927364239157 0.25030539225430 0.28480326434589 39.098 > 25 27 K 0.38927364239157 0.58363872558763 0.28480326434589 39.098 > 25 28 K 0.88927364239157 0.58363872558763 0.28480326434589 39.098 > 25 29 K 0.38927364239157 0.91697205892096 0.28480326434589 39.098 > 25 30 K 0.88927364239157 0.91697205892096 0.28480326434589 39.098 > 25 31 K 0.38927364239157 0.25030539225430 0.78480326434589 39.098 > 25 32 K 0.88927364239157 0.25030539225430 0.78480326434589 39.098 > 25 33 K 0.38927364239157 0.58363872558763 0.78480326434589 39.098 > 25 34 K 0.88927364239157 0.58363872558763 0.78480326434589 39.098 > 25 35 K 0.38927364239157 0.91697205892096 0.78480326434589 39.098 > 25 36 K 0.88927364239157 0.91697205892096 0.78480326434589 39.098 > 25 37 K 0.38927364239157 0.24969460774570 0.03480326434589 39.098 > 37 38 K 0.88927364239157 0.24969460774570 0.03480326434589 39.098 > 37 39 K 0.38927364239157 0.58302794107904 0.03480326434589 39.098 > 37 40 K 0.88927364239157 0.58302794107904 0.03480326434589 39.098 > 37 41 K 0.38927364239157 0.91636127441237 0.03480326434589 39.098 > 37 42 K 0.88927364239157 0.91636127441237 0.03480326434589 39.098 > 37 43 K 0.38927364239157 0.24969460774570 0.53480326434589 39.098 > 37 44 K 0.88927364239157 0.24969460774570 0.53480326434589 39.098 > 37 45 K 0.38927364239157 0.58302794107904 0.53480326434589 39.098 > 37 46 K 0.88927364239157 0.58302794107904 0.53480326434589 39.098 > 37 47 K 0.38927364239157 0.91636127441237 0.53480326434589 39.098 > 37 48 K 0.88927364239157 0.91636127441237 0.53480326434589 39.098 > 37 49 H 0.27804342540562 0.13465823241883 0.13203405943115 1.008 > 49 50 H 0.77804342540562 0.13465823241883 0.13203405943115 1.008 > 49 51 H 0.27804342540562 0.46799156575216 0.13203405943115 1.008 > 49 52 H 0.77804342540562 0.46799156575216 0.13203405943115 1.008 > 49 53 H 0.27804342540562 0.80132489908549 0.13203405943115 1.008 > 49 54 H 0.77804342540562 0.80132489908549 0.13203405943115 1.008 > 49 55 H 0.27804342540562 0.13465823241883 0.63203405943115 1.008 > 49 56 H 0.77804342540562 0.13465823241883 0.63203405943115 1.008 > 49 57 H 0.27804342540562 0.46799156575216 0.63203405943115 1.008 > 49 58 H 0.77804342540562 0.46799156575216 0.63203405943115 1.008 > 49 59 H 0.27804342540562 0.80132489908549 0.63203405943115 1.008 > 49 60 H 0.77804342540562 0.80132489908549 0.63203405943115 1.008 > 49 61 H 0.27804342540562 0.03200843424784 0.38203405943115 1.008 > 61 62 H 0.77804342540562 0.03200843424784 0.38203405943115 1.008 > 61 63 H 0.27804342540562 0.36534176758117 0.38203405943115 1.008 > 61 64 H 0.77804342540562 0.36534176758117 0.38203405943115 1.008 > 61 65 H 0.27804342540562 0.69867510091451 0.38203405943115 1.008 > 61 66 H 0.77804342540562 0.69867510091451 0.38203405943115 1.008 > 61 67 H 0.27804342540562 0.03200843424784 0.88203405943115 1.008 > 61 68 H 0.77804342540562 0.03200843424784 0.88203405943115 1.008 > 61 69 H 0.27804342540562 0.36534176758117 0.88203405943115 1.008 > 61 70 H 0.77804342540562 0.36534176758117 0.88203405943115 1.008 > 61 71 H 0.27804342540562 0.69867510091451 0.88203405943115 1.008 > 61 72 H 0.77804342540562 0.69867510091451 0.88203405943115 1.008 > 61 73 H 0.22195657459438 0.19867510091451 0.36796594056885 1.008 > 73 74 H 0.72195657459438 0.19867510091451 0.36796594056885 1.008 > 73 75 H 0.22195657459438 0.53200843424784 0.36796594056885 1.008 > 73 76 H 0.72195657459438 0.53200843424784 0.36796594056885 1.008 > 73 77 H 0.22195657459438 0.86534176758117 0.36796594056885 1.008 > 73 78 H 0.72195657459438 0.86534176758117 0.36796594056885 1.008 > 73 79 H 0.22195657459438 0.19867510091451 0.86796594056885 1.008 > 73 80 H 0.72195657459438 0.19867510091451 0.86796594056885 1.008 > 73 81 H 0.22195657459438 0.53200843424784 0.86796594056885 1.008 > 73 82 H 0.72195657459438 0.53200843424784 0.86796594056885 1.008 > 73 83 H 0.22195657459438 0.86534176758117 0.86796594056885 1.008 > 73 84 H 0.72195657459438 0.86534176758117 0.86796594056885 1.008 > 73 85 H 0.22195657459438 0.30132489908549 0.11796594056885 1.008 > 85 86 H 0.72195657459438 0.30132489908549 0.11796594056885 1.008 > 85 87 H 0.22195657459438 0.63465823241883 0.11796594056885 1.008 > 85 88 H 0.72195657459438 0.63465823241883 0.11796594056885 1.008 > 85 89 H 0.22195657459438 0.96799156575216 0.11796594056885 1.008 > 85 90 H 0.72195657459438 0.96799156575216 0.11796594056885 1.008 > 85 91 H 0.22195657459438 0.30132489908549 0.61796594056885 1.008 > 85 92 H 0.72195657459438 0.30132489908549 0.61796594056885 1.008 > 85 93 H 0.22195657459438 0.63465823241883 0.61796594056885 1.008 > 85 94 H 0.72195657459438 0.63465823241883 0.61796594056885 1.008 > 85 95 H 0.22195657459438 0.96799156575216 0.61796594056885 1.008 > 85 96 H 0.72195657459438 0.96799156575216 0.61796594056885 1.008 > 85 97 O 0.34790656445841 0.07623907360260 0.14926400020807 15.999 > 97 98 O 0.84790656445841 0.07623907360260 0.14926400020807 15.999 > 97 99 O 0.34790656445841 0.40957240693594 0.14926400020807 15.999 > 97 100 O 0.84790656445841 0.40957240693594 0.14926400020807 15.999 > 97 101 O 0.34790656445841 0.74290574026927 0.14926400020807 15.999 > 97 102 O 0.84790656445841 0.74290574026927 0.14926400020807 15.999 > 97 103 O 0.34790656445841 0.07623907360260 0.64926400020807 15.999 > 97 104 O 0.84790656445841 0.07623907360260 0.64926400020807 15.999 > 97 105 O 0.34790656445841 0.40957240693594 0.64926400020807 15.999 > 97 106 O 0.84790656445841 0.40957240693594 0.64926400020807 15.999 > 97 107 O 0.34790656445841 0.74290574026927 0.64926400020807 15.999 > 97 108 O 0.84790656445841 0.74290574026927 0.64926400020807 15.999 > 97 109 O 0.34790656445841 0.09042759306406 0.39926400020807 15.999 > 109 110 O 0.84790656445841 0.09042759306406 0.39926400020807 15.999 > 109 111 O 0.34790656445841 0.42376092639740 0.39926400020807 15.999 > 109 112 O 0.84790656445841 0.42376092639740 0.39926400020807 15.999 > 109 113 O 0.34790656445841 0.75709425973073 0.39926400020807 15.999 > 109 114 O 0.84790656445841 0.75709425973073 0.39926400020807 15.999 > 109 115 O 0.34790656445841 0.09042759306406 0.89926400020807 15.999 > 109 116 O 0.84790656445841 0.09042759306406 0.89926400020807 15.999 > 109 117 O 0.34790656445841 0.42376092639740 0.89926400020807 15.999 > 109 118 O 0.84790656445841 0.42376092639740 0.89926400020807 15.999 > 109 119 O 0.34790656445841 0.75709425973073 0.89926400020807 15.999 > 109 120 O 0.84790656445841 0.75709425973073 0.89926400020807 15.999 > 109 121 O 0.15209343554159 0.25709425973073 0.35073599979193 15.999 > 121 122 O 0.65209343554159 0.25709425973073 0.35073599979193 15.999 > 121 123 O 0.15209343554159 0.59042759306406 0.35073599979193 15.999 > 121 124 O 0.65209343554159 0.59042759306406 0.35073599979193 15.999 > 121 125 O 0.15209343554159 0.92376092639740 0.35073599979193 15.999 > 121 126 O 0.65209343554159 0.92376092639740 0.35073599979193 15.999 > 121 127 O 0.15209343554159 0.25709425973073 0.85073599979193 15.999 > 121 128 O 0.65209343554159 0.25709425973073 0.85073599979193 15.999 > 121 129 O 0.15209343554159 0.59042759306406 0.85073599979193 15.999 > 121 130 O 0.65209343554159 0.59042759306406 0.85073599979193 15.999 > 121 131 O 0.15209343554159 0.92376092639740 0.85073599979193 15.999 > 121 132 O 0.65209343554159 0.92376092639740 0.85073599979193 15.999 > 121 133 O 0.15209343554159 0.24290574026927 0.10073599979193 15.999 > 133 134 O 0.65209343554159 0.24290574026927 0.10073599979193 15.999 > 133 135 O 0.15209343554159 0.57623907360260 0.10073599979193 15.999 > 133 136 O 0.65209343554159 0.57623907360260 0.10073599979193 15.999 > 133 137 O 0.15209343554159 0.90957240693594 0.10073599979193 15.999 > 133 138 O 0.65209343554159 0.90957240693594 0.10073599979193 15.999 > 133 139 O 0.15209343554159 0.24290574026927 0.60073599979193 15.999 > 133 140 O 0.65209343554159 0.24290574026927 0.60073599979193 15.999 > 133 141 O 0.15209343554159 0.57623907360260 0.60073599979193 15.999 > 133 142 O 0.65209343554159 0.57623907360260 0.60073599979193 15.999 > 133 143 O 0.15209343554159 0.90957240693594 0.60073599979193 15.999 > 133 144 O 0.65209343554159 0.90957240693594 0.60073599979193 15.999 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.5504827 0.0000000 0.0087174 0.0000000 2.6028448 0.0000000 0.0087175 0.0000000 2.5321226 -------------------------- Born effective charges -------------------------- 1 K 1.1506082 0.0133385 -0.0034132 0.0031491 1.1154641 -0.0248538 -0.0041211 -0.0200898 1.1598859 2 K 1.1506082 -0.0133385 -0.0034132 -0.0031491 1.1154641 0.0248538 -0.0041211 0.0200898 1.1598859 3 K 1.1506082 0.0133385 -0.0034132 0.0031491 1.1154641 -0.0248538 -0.0041211 -0.0200898 1.1598859 4 K 1.1506082 -0.0133385 -0.0034132 -0.0031491 1.1154641 0.0248538 -0.0041211 0.0200898 1.1598859 5 H 0.4685726 -0.3441403 0.1035092 -0.3865006 0.6837550 -0.1482194 0.1035758 -0.1313856 0.2372753 6 H 0.4685726 0.3441403 0.1035092 0.3865006 0.6837550 0.1482194 0.1035758 0.1313856 0.2372753 7 H 0.4685726 -0.3441403 0.1035092 -0.3865006 0.6837550 -0.1482194 0.1035758 -0.1313856 0.2372753 8 H 0.4685726 0.3441403 0.1035092 0.3865006 0.6837550 0.1482194 0.1035758 0.1313856 0.2372753 9 O -1.6191809 0.0084716 -0.1000960 0.0106720 -1.7992191 -0.0034472 -0.0994547 0.0029530 -1.3971612 10 O -1.6191809 -0.0084716 -0.1000960 -0.0106720 -1.7992191 0.0034472 -0.0994547 -0.0029530 -1.3971612 11 O -1.6191809 0.0084716 -0.1000960 0.0106720 -1.7992191 -0.0034472 -0.0994547 0.0029530 -1.3971612 12 O -1.6191809 -0.0084716 -0.1000960 -0.0106720 -1.7992191 0.0034472 -0.0994547 -0.0029530 -1.3971612 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000002 (yyy) 0.00000002 (yyy) 0.00000002 (yyy) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 13 7 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.76, Number of G-points: 285, Lambda: 0.13 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/252) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 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 2.370 ( 0.000 0.000 0.000) 0.000 2.920 ( 0.000 0.000 0.000) 0.000 2.979 ( 0.000 0.000 0.000) 0.000 3.177 ( 0.000 0.000 0.000) 0.000 3.267 ( 0.000 0.000 0.000) 0.000 3.612 ( 0.000 0.000 0.000) 0.000 3.820 ( 0.000 0.000 0.000) 0.000 4.471 ( 0.000 0.000 0.000) 0.000 4.588 ( 0.000 0.000 0.000) 0.000 4.631 ( 0.000 0.000 0.000) 0.000 4.981 ( 0.000 0.000 0.000) 0.000 4.991 ( 0.000 0.000 0.000) 0.000 5.258 ( 0.000 0.000 0.000) 0.000 5.312 ( 0.000 0.000 0.000) 0.000 5.469 ( 0.000 0.000 0.000) 0.000 6.436 ( 0.000 0.000 0.000) 0.000 7.371 ( 0.000 0.000 0.000) 0.000 7.456 ( 0.000 0.000 0.000) 0.000 7.521 ( 0.000 0.000 0.000) 0.000 8.347 ( 0.000 0.000 0.000) 0.000 8.377 ( 0.000 0.000 0.000) 0.000 24.684 ( 0.000 0.000 0.000) 0.000 24.708 ( 0.000 0.000 0.000) 0.000 27.421 ( 0.000 0.000 0.000) 0.000 27.481 ( 0.000 0.000 0.000) 0.000 29.644 ( 0.000 0.000 0.000) 0.000 30.357 ( 0.000 0.000 0.000) 0.000 34.548 ( 0.000 0.000 0.000) 0.000 35.081 ( 0.000 0.000 0.000) 0.000 94.102 ( 0.000 0.000 0.000) 0.000 94.108 ( 0.000 0.000 0.000) 0.000 97.128 ( 0.000 0.000 0.000) 0.000 97.299 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/252) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.339 ( 15.018 0.000 8.596) 17.304 0.588 ( 27.786 0.000 10.849) 29.829 0.922 ( 43.069 0.000 18.445) 46.852 2.356 ( -0.935 0.000 -1.363) 1.652 2.696 ( -7.055 0.000 -18.695) 19.982 2.976 ( 1.322 0.000 -4.314) 4.512 3.268 ( -0.841 0.000 2.371) 2.516 3.412 ( 9.137 0.000 14.635) 17.253 3.600 ( -2.203 0.000 3.651) 4.264 3.782 ( -3.854 0.000 -0.131) 3.857 4.473 ( -0.104 0.000 0.469) 0.481 4.608 ( 2.419 0.000 -1.610) 2.906 4.610 ( -1.610 0.000 -1.311) 2.076 4.943 ( -2.819 0.000 -3.270) 4.318 5.041 ( 6.066 0.000 -2.539) 6.576 5.323 ( -0.046 0.000 2.990) 2.991 5.441 ( -2.786 0.000 0.098) 2.787 6.367 ( -3.677 0.000 -7.949) 8.759 7.305 ( -6.071 0.000 -2.262) 6.479 7.351 ( -9.412 0.000 11.081) 14.539 7.659 ( 9.251 0.000 -2.273) 9.526 8.120 ( 5.317 0.000 3.546) 6.391 8.362 ( -0.775 0.000 -2.128) 2.265 9.284 ( -1.627 0.000 -2.697) 3.150 24.686 ( 0.249 0.000 -0.104) 0.270 24.714 ( 0.595 0.000 0.195) 0.626 27.419 ( -0.088 0.000 -0.237) 0.253 27.483 ( 0.215 0.000 0.018) 0.216 29.651 ( 0.582 0.000 0.308) 0.658 30.356 ( -0.181 0.000 0.236) 0.298 34.549 ( -0.193 0.000 0.715) 0.741 35.166 ( -1.873 0.000 -0.593) 1.964 94.103 ( 0.057 0.000 0.158) 0.168 94.108 ( 0.007 0.000 0.027) 0.028 97.127 ( 0.611 0.000 -2.014) 2.105 98.284 ( -0.183 0.000 -0.736) 0.759 ======================= Grid point 2 (3/252) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.658 ( 13.973 0.000 7.061) 15.655 1.152 ( 26.050 0.000 10.183) 27.970 1.807 ( 40.218 0.000 17.602) 43.901 2.317 ( -1.803 0.000 -2.601) 3.165 2.509 ( 1.762 0.000 -18.725) 18.808 2.970 ( 2.487 0.000 -7.022) 7.450 3.268 ( -1.484 0.000 3.592) 3.886 3.519 ( -3.402 0.000 1.215) 3.613 3.640 ( -1.710 0.000 9.274) 9.430 3.708 ( -4.333 0.000 6.320) 7.663 4.467 ( -1.098 0.000 0.174) 1.112 4.567 ( -1.117 0.000 -2.426) 2.671 4.638 ( 2.200 0.000 -2.811) 3.569 4.840 ( -6.094 0.000 -2.695) 6.664 5.139 ( 6.501 0.000 -5.973) 8.829 5.345 ( 0.282 0.000 2.328) 2.345 5.394 ( -1.800 0.000 1.061) 2.089 6.247 ( -1.337 0.000 -8.442) 8.547 7.134 ( -9.894 0.000 -4.198) 10.748 7.295 ( -5.971 0.000 12.350) 13.717 7.770 ( 3.341 0.000 -0.729) 3.419 8.277 ( 8.641 0.000 3.980) 9.513 8.329 ( -0.232 0.000 -3.497) 3.505 9.217 ( -3.627 0.000 -2.747) 4.550 24.691 ( 0.441 0.000 -0.144) 0.464 24.731 ( 0.995 0.000 0.331) 1.049 27.415 ( -0.114 0.000 -0.369) 0.387 27.489 ( 0.361 0.000 0.038) 0.363 29.668 ( 1.076 0.000 0.078) 1.079 30.353 ( -0.424 0.000 0.326) 0.535 34.551 ( -0.266 0.000 1.174) 1.203 35.114 ( -3.075 0.000 -0.922) 3.210 94.105 ( 0.083 0.000 0.249) 0.262 94.108 ( 0.019 0.000 0.050) 0.053 97.124 ( 1.144 0.000 -3.205) 3.403 98.272 ( -0.498 0.000 -0.689) 0.851 ======================= Grid point 3 (4/252) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.936 ( 11.738 0.000 4.970) 12.747 1.667 ( 23.058 0.000 9.045) 24.769 2.252 ( -3.251 0.000 -1.188) 3.461 2.509 ( 11.507 0.000 -15.975) 19.688 2.614 ( 35.503 0.000 13.709) 38.058 2.969 ( 2.885 0.000 -7.023) 7.592 3.264 ( -1.681 0.000 3.514) 3.896 3.391 ( -8.842 0.000 -4.166) 9.774 3.625 ( -2.531 0.000 5.924) 6.442 3.657 ( -11.534 0.000 10.524) 15.613 4.429 ( -1.760 0.000 -2.830) 3.333 4.550 ( 0.333 0.000 -0.932) 0.990 4.639 ( 0.504 0.000 -3.913) 3.945 4.687 ( -9.362 0.000 -0.644) 9.384 5.158 ( 1.045 0.000 -6.691) 6.772 5.363 ( 0.436 0.000 0.975) 1.068 5.405 ( 1.368 0.000 1.660) 2.152 6.249 ( 6.878 0.000 -5.339) 8.707 6.905 ( -11.145 0.000 -5.188) 12.293 7.300 ( -3.469 0.000 13.266) 13.712 7.756 ( -3.093 0.000 -3.413) 4.606 8.316 ( 1.252 0.000 -2.866) 3.128 8.473 ( 9.497 0.000 4.171) 10.373 9.118 ( -4.995 0.000 -2.856) 5.754 24.699 ( 0.487 0.000 -0.115) 0.500 24.753 ( 1.036 0.000 0.350) 1.094 27.411 ( -0.080 0.000 -0.351) 0.360 27.496 ( 0.378 0.000 0.048) 0.381 29.688 ( 1.078 0.000 -0.010) 1.078 30.345 ( -0.585 0.000 0.254) 0.638 34.555 ( -0.209 0.000 1.194) 1.212 35.049 ( -3.113 0.000 -0.926) 3.248 94.109 ( 0.072 0.000 0.240) 0.250 94.109 ( 0.027 0.000 0.058) 0.064 97.124 ( 1.332 0.000 -3.127) 3.399 98.258 ( -0.541 0.000 -0.606) 0.812 ======================= Grid point 4 (5/252) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.140 ( 7.306 0.000 2.623) 7.763 2.096 ( 17.072 0.000 6.782) 18.370 2.185 ( -2.751 0.000 -1.232) 3.014 2.683 ( 17.367 0.000 -11.191) 20.660 2.974 ( 1.961 0.000 -4.268) 4.696 3.172 ( -10.911 0.000 -5.214) 12.093 3.254 ( 7.629 0.000 3.389) 8.348 3.265 ( 16.431 0.000 8.757) 18.619 3.442 ( -17.506 0.000 7.824) 19.175 3.637 ( -0.645 0.000 4.416) 4.463 4.380 ( 0.605 0.000 -7.399) 7.423 4.496 ( -12.893 0.000 6.001) 14.221 4.557 ( 1.219 0.000 -2.512) 2.793 4.611 ( -0.389 0.000 -3.296) 3.318 5.120 ( -0.539 0.000 -3.764) 3.802 5.374 ( 0.317 0.000 0.219) 0.385 5.445 ( 1.412 0.000 1.455) 2.027 6.371 ( 8.111 0.000 -3.396) 8.794 6.690 ( -8.016 0.000 -3.902) 8.916 7.356 ( -0.963 0.000 14.511) 14.543 7.632 ( -5.238 0.000 -8.455) 9.946 8.326 ( 1.174 0.000 -1.310) 1.759 8.670 ( 8.890 0.000 3.876) 9.698 8.996 ( -6.238 0.000 -3.007) 6.925 24.706 ( 0.324 0.000 -0.057) 0.329 24.771 ( 0.661 0.000 0.226) 0.699 27.408 ( -0.032 0.000 -0.208) 0.211 27.502 ( 0.242 0.000 0.035) 0.244 29.704 ( 0.659 0.000 -0.028) 0.659 30.337 ( -0.442 0.000 0.120) 0.458 34.559 ( -0.100 0.000 0.748) 0.755 34.996 ( -1.943 0.000 -0.577) 2.027 94.110 ( 0.021 0.000 0.040) 0.046 94.111 ( 0.041 0.000 0.144) 0.149 97.127 ( 0.914 0.000 -1.889) 2.099 98.246 ( -0.345 0.000 -0.361) 0.499 ======================= Grid point 5 (6/252) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.219 ( 0.000 0.000 0.000) 0.000 2.152 ( 0.000 0.000 0.000) 0.000 2.302 ( 0.000 0.000 0.000) 0.000 2.924 ( 0.000 0.000 -0.000) 0.000 2.952 ( -0.000 0.000 0.000) 0.000 2.977 ( 0.000 0.000 -0.000) 0.000 3.254 ( 0.000 0.000 0.000) 0.000 3.261 ( 0.000 0.000 0.000) 0.000 3.564 ( 0.000 0.000 0.000) 0.000 3.649 ( 0.000 0.000 0.000) 0.000 4.344 ( -0.000 0.000 0.000) 0.000 4.382 ( 0.000 0.000 -0.000) 0.000 4.560 ( 0.000 0.000 0.000) 0.000 4.593 ( 0.000 0.000 0.000) 0.000 5.100 ( 0.000 0.000 0.000) 0.000 5.378 ( 0.000 0.000 0.000) 0.000 5.465 ( 0.000 0.000 -0.000) 0.000 6.441 ( 0.000 0.000 0.000) 0.000 6.597 ( 0.000 0.000 0.000) 0.000 7.455 ( 0.000 0.000 -0.000) 0.000 7.493 ( 0.000 0.000 0.000) 0.000 8.333 ( 0.000 0.000 0.000) 0.000 8.833 ( 0.000 0.000 0.000) 0.000 8.861 ( -0.000 0.000 -0.000) 0.000 24.709 ( 0.000 0.000 0.000) 0.000 24.778 ( 0.000 0.000 0.000) 0.000 27.407 ( 0.000 0.000 0.000) 0.000 27.505 ( 0.000 0.000 0.000) 0.000 29.710 ( 0.000 0.000 0.000) 0.000 30.333 ( 0.000 0.000 0.000) 0.000 34.561 ( 0.000 0.000 0.000) 0.000 34.976 ( 0.000 0.000 0.000) 0.000 94.110 ( 0.000 0.000 0.000) 0.000 94.112 ( 0.000 0.000 0.000) 0.000 97.129 ( 0.000 0.000 0.000) 0.000 98.242 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 11 (7/252) ======================= q-point: ( 0.00 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.587 ( 0.000 30.988 0.000) 30.988 0.601 ( 0.000 30.704 0.000) 30.704 0.914 ( 0.000 46.320 0.000) 46.320 2.447 ( 0.000 7.780 0.000) 7.780 2.909 ( 0.000 -1.461 0.000) 1.461 2.969 ( 0.000 -0.856 0.000) 0.856 3.187 ( 0.000 0.841 0.000) 0.841 3.301 ( 0.000 3.029 0.000) 3.029 3.669 ( 0.000 5.666 0.000) 5.666 3.857 ( 0.000 3.844 0.000) 3.844 4.421 ( 0.000 -3.949 0.000) 3.949 4.611 ( 0.000 -1.776 0.000) 1.776 4.846 ( 0.000 7.549 0.000) 7.549 4.947 ( 0.000 -3.393 0.000) 3.393 5.244 ( 0.000 -1.506 0.000) 1.506 5.288 ( 0.000 -2.406 0.000) 2.406 5.441 ( 0.000 -2.813 0.000) 2.813 6.286 ( 0.000 -5.683 0.000) 5.683 6.844 ( 0.000 -6.141 0.000) 6.141 7.429 ( 0.000 -9.149 0.000) 9.149 7.477 ( 0.000 8.437 0.000) 8.437 8.353 ( 0.000 1.057 0.000) 1.057 8.427 ( 0.000 4.387 0.000) 4.387 9.257 ( 0.000 -3.253 0.000) 3.253 24.853 ( 0.000 14.803 0.000) 14.803 25.333 ( 0.000 13.043 0.000) 13.043 27.451 ( 0.000 3.295 0.000) 3.295 27.549 ( 0.000 6.719 0.000) 6.719 29.623 ( 0.000 -2.240 0.000) 2.240 30.325 ( 0.000 -3.277 0.000) 3.277 34.398 ( 0.000 -15.352 0.000) 15.352 34.914 ( 0.000 -17.113 0.000) 17.113 94.186 ( 0.000 7.954 0.000) 7.954 95.615 ( 0.000 1.659 0.000) 1.659 97.098 ( 0.000 -3.118 0.000) 3.118 97.259 ( 0.000 -4.042 0.000) 4.042 ======================= Grid point 12 (8/252) ======================= q-point: ( 0.10 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.643 ( 15.378 15.492 7.665) 23.135 0.693 ( 7.695 26.883 3.961) 28.241 1.394 ( 32.385 35.560 13.073) 49.842 2.429 ( -1.142 7.338 -1.999) 7.691 2.695 ( -6.850 -0.191 -17.528) 18.820 2.983 ( 1.696 0.685 -2.961) 3.480 3.269 ( -0.912 0.511 0.465) 1.144 3.425 ( 8.574 0.722 15.026) 17.315 3.658 ( -2.055 5.822 2.385) 6.618 3.838 ( -2.946 4.474 0.110) 5.358 4.430 ( 0.526 -2.981 0.751) 3.119 4.590 ( -1.763 -1.723 -1.071) 2.688 4.675 ( -9.545 -0.173 -3.781) 10.268 4.897 ( 3.418 4.026 -4.662) 7.044 5.250 ( 1.103 8.313 -4.155) 9.358 5.301 ( -0.778 -1.465 4.370) 4.674 5.413 ( -2.704 -2.778 -0.056) 3.877 6.289 ( -1.578 -7.310 -5.903) 9.528 6.888 ( -0.473 -19.817 -1.123) 19.855 7.418 ( -5.714 -8.980 11.442) 15.627 7.571 ( 8.694 4.487 -2.060) 9.998 8.191 ( -7.197 3.062 -2.256) 8.141 8.342 ( -0.039 1.580 -2.150) 2.669 9.450 ( 6.254 5.505 1.564) 8.477 24.856 ( 0.311 14.805 0.180) 14.810 25.082 ( -11.977 26.567 -4.849) 29.543 27.450 ( -0.005 3.355 -0.184) 3.360 27.551 ( 0.147 6.669 -0.045) 6.671 29.629 ( 0.604 -2.267 0.180) 2.353 30.324 ( -0.150 -3.246 0.240) 3.259 34.399 ( -0.210 -15.366 0.719) 15.384 34.948 ( 0.614 -19.786 0.388) 19.799 94.186 ( -0.078 7.973 0.171) 7.976 94.759 ( -33.232 38.310 -12.717) 52.285 97.099 ( 0.639 -2.920 -1.888) 3.535 97.857 ( 20.730 -27.877 7.595) 35.560 ======================= Grid point 13 (9/252) ======================= q-point: ( 0.20 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.898 ( 10.657 21.215 4.973) 24.257 1.119 ( 25.596 0.643 10.792) 27.786 2.104 ( 33.710 26.074 14.648) 45.064 2.381 ( -1.383 6.302 -4.286) 7.746 2.517 ( 1.212 1.158 -16.498) 16.583 2.992 ( 2.996 2.110 -6.887) 7.802 3.247 ( -2.212 -1.386 3.112) 4.062 3.573 ( -3.331 3.942 2.099) 5.571 3.662 ( -0.319 2.010 9.924) 10.130 3.760 ( -5.747 5.360 3.159) 8.470 4.438 ( -0.654 -1.965 0.680) 2.179 4.539 ( -0.583 -2.507 -5.303) 5.894 4.587 ( -2.480 -6.399 3.434) 7.674 4.905 ( 0.840 7.630 -6.853) 10.290 5.244 ( 1.298 8.299 -4.520) 9.539 5.319 ( 0.149 -2.675 2.514) 3.674 5.365 ( -1.880 -2.878 0.739) 3.517 6.189 ( -1.788 -5.727 -7.518) 9.619 6.790 ( -7.298 -23.310 -3.339) 24.653 7.360 ( -9.967 -3.861 16.317) 19.506 7.701 ( 7.275 -2.709 -7.389) 10.717 8.188 ( 3.081 -4.018 0.317) 5.073 8.358 ( 4.309 3.690 0.218) 5.677 9.462 ( -2.972 15.478 -1.656) 15.847 24.867 ( 0.670 15.003 0.433) 15.024 24.934 ( -3.437 21.606 -1.759) 21.948 27.448 ( 0.003 3.510 -0.298) 3.522 27.554 ( 0.273 6.545 -0.053) 6.551 29.645 ( 1.016 -2.338 0.111) 2.552 30.322 ( -0.370 -3.160 0.339) 3.199 34.401 ( -0.297 -15.406 1.177) 15.454 34.926 ( -2.333 -18.840 -0.639) 18.995 94.186 ( -0.103 8.009 0.328) 8.017 94.375 ( -9.097 23.164 -3.341) 25.110 97.097 ( 1.125 -2.795 -3.031) 4.274 98.077 ( 4.694 -17.679 1.351) 18.342 ======================= Grid point 14 (10/252) ======================= q-point: ( 0.30 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.124 ( 10.261 17.585 3.939) 20.737 1.652 ( 24.382 -0.722 9.841) 26.303 2.317 ( -3.073 6.512 -1.868) 7.439 2.508 ( 10.731 0.273 -14.546) 18.078 2.799 ( 30.635 17.331 10.894) 36.845 2.992 ( 2.440 2.478 -6.716) 7.562 3.243 ( -0.969 -1.347 3.826) 4.171 3.430 ( -9.388 3.129 -4.344) 10.807 3.658 ( -11.089 0.157 9.346) 14.503 3.694 ( -2.763 6.450 5.232) 8.753 4.400 ( -2.781 -2.060 -1.773) 3.889 4.515 ( 2.268 -2.658 -6.866) 7.704 4.571 ( -4.340 -5.035 7.071) 9.705 4.841 ( -2.368 11.599 -4.753) 12.757 5.206 ( -1.169 4.621 -6.264) 7.871 5.335 ( 0.155 -2.894 1.206) 3.139 5.374 ( 1.486 -3.081 1.130) 3.603 6.180 ( 5.574 -7.028 -4.183) 9.897 6.606 ( -9.393 -24.185 -4.275) 26.295 7.320 ( -6.749 -2.574 16.162) 17.703 7.701 ( -0.732 -4.197 -8.814) 9.789 8.229 ( 3.254 -3.525 -3.766) 6.099 8.516 ( 9.398 3.848 5.295) 11.453 9.358 ( -6.268 17.545 -2.664) 18.821 24.878 ( -0.260 17.272 -0.116) 17.275 24.898 ( 0.137 15.353 -0.181) 15.355 27.446 ( 0.020 3.691 -0.293) 3.702 27.559 ( 0.309 6.408 -0.030) 6.415 29.665 ( 1.007 -2.431 0.041) 2.632 30.316 ( -0.525 -3.040 0.272) 3.097 34.404 ( -0.240 -15.462 1.197) 15.510 34.871 ( -2.881 -18.205 -0.843) 18.451 94.187 ( -0.074 8.021 0.383) 8.031 94.262 ( -3.043 14.531 -1.027) 14.882 97.098 ( 1.251 -2.777 -2.993) 4.270 98.126 ( 1.137 -12.815 0.039) 12.865 ======================= Grid point 15 (11/252) ======================= q-point: ( 0.40 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( 6.790 15.871 2.193) 17.402 2.114 ( 18.692 1.421 7.450) 20.172 2.248 ( -2.880 6.333 -1.258) 7.070 2.675 ( 16.700 -0.658 -10.673) 19.830 2.981 ( 0.801 0.474 -3.600) 3.718 3.168 ( -9.841 0.931 -4.354) 10.801 3.263 ( 1.943 0.866 0.729) 2.249 3.385 ( 17.314 10.333 7.487) 21.508 3.442 ( -16.482 0.473 8.053) 18.350 3.696 ( -0.906 5.799 3.472) 6.820 4.340 ( -0.861 -3.008 -4.097) 5.155 4.488 ( -3.424 -0.140 -3.923) 5.209 4.524 ( -3.422 -0.635 5.457) 6.473 4.785 ( -0.792 12.663 -2.209) 12.879 5.140 ( -1.441 2.067 -4.145) 4.851 5.344 ( 0.156 -3.174 0.389) 3.201 5.410 ( 1.349 -3.440 0.987) 3.825 6.289 ( 6.809 -9.798 -1.833) 12.071 6.422 ( -6.642 -22.461 -3.587) 23.695 7.342 ( -3.545 -3.645 16.574) 17.336 7.583 ( -3.079 -3.263 -12.123) 12.927 8.258 ( 2.186 -2.375 -2.490) 4.077 8.726 ( 8.946 3.728 4.804) 10.818 9.214 ( -6.978 17.465 -2.910) 19.031 24.867 ( -0.307 16.305 -0.324) 16.311 24.911 ( 0.644 14.405 0.305) 14.423 27.445 ( 0.022 3.828 -0.176) 3.832 27.564 ( 0.207 6.310 -0.008) 6.313 29.680 ( 0.613 -2.511 0.005) 2.585 30.308 ( -0.401 -2.931 0.133) 2.962 34.408 ( -0.120 -15.509 0.750) 15.528 34.820 ( -1.872 -17.972 -0.554) 18.078 94.189 ( -0.033 8.009 0.254) 8.013 94.224 ( -1.048 11.032 -0.320) 11.087 97.100 ( 0.832 -2.867 -1.826) 3.500 98.136 ( 0.235 -10.929 -0.143) 10.932 ======================= Grid point 16 (12/252) ======================= q-point: (-0.50 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.379 ( 0.000 15.437 0.000) 15.437 2.213 ( 0.000 6.128 0.000) 6.128 2.344 ( 0.000 3.559 0.000) 3.559 2.911 ( 0.000 -1.112 -0.000) 1.112 2.928 ( -0.000 -1.707 0.000) 1.707 2.987 ( 0.000 0.610 0.000) 0.610 3.249 ( 0.000 -1.062 0.000) 1.062 3.290 ( 0.000 3.051 0.000) 3.051 3.625 ( 0.000 6.575 0.000) 6.575 3.701 ( 0.000 5.162 -0.000) 5.162 4.326 ( 0.000 -3.788 -0.000) 3.788 4.405 ( -0.000 5.725 0.000) 5.725 4.517 ( 0.000 -0.780 0.000) 0.780 4.773 ( 0.000 12.513 0.000) 12.513 5.111 ( 0.000 1.047 0.000) 1.047 5.346 ( 0.000 -3.269 0.000) 3.269 5.428 ( 0.000 -3.732 -0.000) 3.732 6.329 ( 0.000 -25.118 0.000) 25.118 6.368 ( 0.000 -7.258 0.000) 7.258 7.400 ( 0.000 -9.023 -0.000) 9.023 7.475 ( 0.000 2.067 0.000) 2.067 8.270 ( 0.000 -2.079 0.000) 2.079 8.851 ( 0.000 1.836 0.000) 1.836 9.114 ( -0.000 19.166 -0.000) 19.166 24.863 ( 0.000 15.673 0.000) 15.673 24.918 ( 0.000 14.461 0.000) 14.461 27.445 ( 0.000 3.878 0.000) 3.878 27.566 ( 0.000 6.275 0.000) 6.275 29.686 ( 0.000 -2.543 0.000) 2.543 30.305 ( 0.000 -2.887 0.000) 2.887 34.410 ( 0.000 -15.527 0.000) 15.527 34.801 ( 0.000 -17.916 0.000) 17.916 94.189 ( 0.000 8.002 0.000) 8.002 94.214 ( 0.000 10.081 0.000) 10.081 97.101 ( 0.000 -2.927 0.000) 2.927 98.137 ( 0.000 -10.414 0.000) 10.414 ======================= Grid point 22 (13/252) ======================= q-point: ( 0.00 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.183 ( 0.000 29.260 0.000) 29.260 1.207 ( 0.000 32.952 0.000) 32.952 1.779 ( 0.000 42.664 0.000) 42.664 2.657 ( 0.000 13.414 0.000) 13.414 2.884 ( 0.000 -0.833 0.000) 0.833 2.953 ( 0.000 -0.748 0.000) 0.748 3.211 ( 0.000 1.879 0.000) 1.879 3.361 ( 0.000 2.731 0.000) 2.731 3.815 ( 0.000 8.872 0.000) 8.872 3.969 ( 0.000 7.759 0.000) 7.759 4.346 ( 0.000 -3.797 0.000) 3.797 4.571 ( 0.000 -1.945 0.000) 1.945 4.841 ( 0.000 -6.576 0.000) 6.576 5.007 ( 0.000 7.411 0.000) 7.411 5.191 ( 0.000 -4.377 0.000) 4.377 5.229 ( 0.000 -3.091 0.000) 3.091 5.364 ( 0.000 -4.902 0.000) 4.902 6.122 ( 0.000 -10.681 0.000) 10.681 6.759 ( 0.000 -2.220 0.000) 2.220 7.182 ( 0.000 -15.969 0.000) 15.969 7.633 ( 0.000 6.926 0.000) 6.926 8.394 ( 0.000 3.139 0.000) 3.139 8.523 ( 0.000 4.942 0.000) 4.942 9.173 ( 0.000 -5.129 0.000) 5.129 25.274 ( 0.000 28.369 0.000) 28.369 25.708 ( 0.000 25.493 0.000) 25.493 27.552 ( 0.000 7.085 0.000) 7.085 27.732 ( 0.000 11.922 0.000) 11.922 29.556 ( 0.000 -4.681 0.000) 4.681 30.231 ( 0.000 -6.300 0.000) 6.300 33.960 ( 0.000 -29.623 0.000) 29.623 34.428 ( 0.000 -32.770 0.000) 32.770 94.405 ( 0.000 14.220 0.000) 14.220 95.663 ( 0.000 3.287 0.000) 3.287 97.009 ( 0.000 -6.082 0.000) 6.082 97.146 ( 0.000 -7.479 0.000) 7.479 ======================= Grid point 23 (14/252) ======================= q-point: ( 0.10 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.102 ( -2.342 28.600 0.568) 28.701 1.236 ( 4.735 28.200 2.049) 28.668 2.127 ( 25.532 38.520 10.179) 47.321 2.619 ( -2.597 10.361 -6.722) 12.620 2.707 ( -5.082 3.296 -11.017) 12.572 3.001 ( 2.204 1.143 0.109) 2.485 3.287 ( -0.089 0.999 -3.105) 3.263 3.434 ( 6.483 0.451 13.712) 15.174 3.802 ( -1.995 8.207 0.290) 8.451 3.952 ( -2.473 7.441 1.130) 7.922 4.373 ( 1.691 -2.903 2.302) 4.073 4.549 ( -2.524 -2.455 -0.454) 3.550 4.605 ( -13.441 -5.204 -5.398) 15.391 5.027 ( 3.663 6.827 -4.332) 8.876 5.215 ( 0.428 -5.223 1.717) 5.515 5.332 ( -0.163 -3.467 0.438) 3.498 5.351 ( 3.685 -0.923 0.220) 3.805 6.109 ( -0.637 -10.843 -3.742) 11.489 6.651 ( -9.547 -6.245 -3.358) 11.892 7.176 ( -3.551 -15.105 6.446) 16.803 7.678 ( 3.600 4.760 -1.069) 6.063 8.251 ( -10.217 4.217 -3.940) 11.734 8.413 ( 0.122 4.643 -2.171) 5.127 9.458 ( 15.401 -3.112 5.705) 16.716 25.276 ( 0.232 28.347 0.313) 28.349 25.611 ( -7.387 29.614 -3.089) 30.677 27.552 ( 0.078 7.118 -0.154) 7.121 27.733 ( 0.100 11.903 -0.097) 11.904 29.562 ( 0.529 -4.728 0.171) 4.761 30.232 ( -0.069 -6.240 0.276) 6.247 33.960 ( -0.258 -29.653 0.727) 29.663 34.429 ( -0.302 -33.694 0.032) 33.695 94.405 ( -0.179 14.238 0.534) 14.249 95.277 ( -25.695 17.923 -9.818) 32.830 97.013 ( 0.727 -5.963 -1.572) 6.209 97.420 ( 17.232 -18.149 6.416) 25.835 ======================= Grid point 24 (15/252) ======================= q-point: ( 0.20 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.257 ( 15.225 13.611 7.508) 21.759 1.370 ( 7.768 25.962 2.888) 27.253 2.500 ( 0.837 3.815 -13.836) 14.377 2.598 ( -2.029 12.131 -0.180) 12.301 2.699 ( 26.096 30.071 6.241) 40.302 3.045 ( 4.790 3.668 -5.173) 7.947 3.232 ( -3.276 -0.076 1.190) 3.486 3.611 ( -0.034 0.097 8.901) 8.901 3.732 ( -4.628 4.332 -0.391) 6.351 3.895 ( -5.010 8.012 3.099) 9.945 4.399 ( -1.816 -4.525 -0.066) 4.876 4.434 ( -2.021 -4.344 2.029) 5.203 4.500 ( -2.018 -2.757 -1.068) 3.580 5.059 ( 3.413 6.483 -6.657) 9.899 5.241 ( 0.719 -5.009 2.230) 5.530 5.288 ( -1.916 -4.604 0.234) 4.993 5.392 ( 0.008 5.378 -1.965) 5.726 6.041 ( -2.420 -8.901 -5.503) 10.741 6.407 ( -12.836 -14.611 -5.358) 20.173 7.150 ( -6.707 -15.119 14.610) 22.069 7.700 ( 2.855 0.917 -9.585) 10.043 8.193 ( 2.456 4.187 0.298) 4.864 8.446 ( 4.904 4.981 0.536) 7.010 9.648 ( 3.206 3.601 1.169) 4.961 25.287 ( 0.606 28.237 0.637) 28.251 25.464 ( -5.845 31.941 -2.676) 32.582 27.553 ( 0.139 7.209 -0.244) 7.215 27.734 ( 0.208 11.863 -0.136) 11.866 29.576 ( 0.841 -4.857 0.219) 4.934 30.232 ( -0.228 -6.080 0.401) 6.097 33.961 ( -0.377 -29.726 1.188) 29.752 34.407 ( -1.973 -34.285 -0.520) 34.345 94.406 ( -0.293 14.269 0.901) 14.300 94.839 ( -15.574 22.561 -5.829) 28.027 97.014 ( 1.062 -5.803 -2.584) 6.440 97.688 ( 8.698 -20.792 2.957) 22.731 ======================= Grid point 25 (16/252) ======================= q-point: ( 0.30 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.541 ( 8.474 23.981 2.689) 25.575 1.677 ( 22.331 4.004 9.594) 24.633 2.481 ( 2.587 7.853 -7.294) 11.025 2.540 ( 2.800 5.567 -7.329) 9.620 3.016 ( 3.513 2.576 -7.565) 8.729 3.210 ( 4.251 5.233 3.857) 7.768 3.276 ( 16.547 19.904 7.982) 27.086 3.482 ( -10.271 1.749 -3.974) 11.151 3.661 ( -10.283 -0.062 6.106) 11.960 3.845 ( -2.440 8.301 3.742) 9.426 4.371 ( -4.483 -1.390 1.257) 4.859 4.416 ( 3.226 -6.456 -2.659) 7.691 4.501 ( -0.318 -1.985 4.197) 4.654 5.052 ( 0.650 8.302 -4.698) 9.561 5.252 ( -0.633 -5.313 1.263) 5.498 5.294 ( 1.612 -4.911 0.222) 5.174 5.331 ( -4.133 7.719 -4.219) 9.719 5.975 ( -2.775 -13.697 -2.152) 14.140 6.166 ( -6.873 -18.200 -5.905) 20.331 7.148 ( -5.913 -14.176 16.854) 22.803 7.651 ( 0.409 -0.435 -11.930) 11.945 8.248 ( 4.332 4.740 -4.140) 7.640 8.603 ( 8.769 4.773 5.973) 11.634 9.628 ( -4.119 8.927 -1.610) 9.962 25.306 ( 0.779 27.955 0.690) 27.974 25.367 ( -3.225 30.973 -1.643) 31.184 27.554 ( 0.155 7.327 -0.235) 7.333 27.738 ( 0.257 11.830 -0.111) 11.833 29.593 ( 0.815 -5.024 0.172) 5.093 30.229 ( -0.370 -5.870 0.343) 5.892 33.963 ( -0.322 -29.815 1.206) 29.841 34.358 ( -2.620 -34.256 -0.767) 34.364 94.407 ( -0.299 14.271 0.943) 14.305 94.610 ( -7.386 19.824 -2.667) 21.323 97.015 ( 1.038 -5.793 -2.626) 6.444 97.805 ( 3.495 -19.196 0.963) 19.535 ======================= Grid point 26 (17/252) ======================= q-point: ( 0.40 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.696 ( 6.216 23.052 1.687) 23.935 2.140 ( 20.096 1.387 8.299) 21.787 2.420 ( -3.359 11.076 -1.479) 11.668 2.669 ( 14.988 0.289 -9.339) 17.661 2.989 ( -1.571 0.389 -1.445) 2.170 3.189 ( -12.320 0.310 -5.216) 13.382 3.285 ( 2.408 1.164 -2.635) 3.755 3.438 ( -15.749 0.530 6.136) 16.910 3.668 ( 12.768 16.862 6.353) 22.084 3.842 ( -0.681 8.681 2.037) 8.943 4.296 ( -2.615 -1.507 -1.229) 3.259 4.478 ( 5.067 -1.588 -4.335) 6.855 4.519 ( -2.327 0.126 7.560) 7.911 5.033 ( -0.188 10.954 -1.591) 11.070 5.206 ( -4.357 5.170 -4.578) 8.165 5.253 ( -0.588 -5.953 0.927) 6.053 5.322 ( 0.975 -5.135 0.082) 5.227 5.852 ( -6.999 -26.327 -1.802) 27.301 6.139 ( 4.058 -11.617 -2.481) 12.554 7.159 ( -4.548 -14.546 12.630) 19.794 7.573 ( -0.058 2.330 -9.279) 9.568 8.286 ( 2.885 4.667 -3.833) 6.693 8.801 ( 7.506 4.087 5.445) 10.134 9.516 ( -5.610 11.784 -2.343) 13.260 25.310 ( -0.956 28.203 -0.666) 28.227 25.330 ( 0.091 29.230 0.330) 29.232 27.555 ( 0.104 7.426 -0.139) 7.428 27.742 ( 0.180 11.815 -0.057) 11.816 29.606 ( 0.490 -5.166 0.087) 5.190 30.224 ( -0.298 -5.691 0.183) 5.701 33.966 ( -0.171 -29.888 0.754) 29.898 34.311 ( -1.772 -34.176 -0.532) 34.226 94.408 ( -0.189 14.244 0.601) 14.258 94.508 ( -2.931 17.368 -1.023) 17.643 97.015 ( 0.624 -5.922 -1.642) 6.177 97.849 ( 1.239 -17.896 0.247) 17.940 ======================= Grid point 27 (18/252) ======================= q-point: (-0.50 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.764 ( 0.000 23.005 0.000) 23.005 2.378 ( 0.000 10.505 0.000) 10.505 2.402 ( 0.000 1.786 0.000) 1.786 2.890 ( 0.000 -1.008 -0.000) 1.008 2.900 ( -0.000 -1.080 0.000) 1.080 3.000 ( -0.000 0.693 0.000) 0.693 3.230 ( 0.000 -0.500 0.000) 0.500 3.347 ( 0.000 2.548 0.000) 2.548 3.816 ( 0.000 12.381 0.000) 12.381 3.836 ( 0.000 8.276 -0.000) 8.276 4.272 ( 0.000 -1.619 -0.000) 1.619 4.518 ( -0.000 0.743 0.000) 0.743 4.519 ( 0.000 4.130 -0.000) 4.130 5.025 ( 0.000 12.183 0.000) 12.183 5.143 ( 0.000 2.757 0.000) 2.757 5.252 ( 0.000 -6.462 0.000) 6.462 5.330 ( 0.000 -5.879 0.000) 5.879 5.774 ( 0.000 -27.930 0.000) 27.930 6.178 ( 0.000 -11.740 0.000) 11.740 7.160 ( 0.000 -15.464 -0.000) 15.464 7.538 ( 0.000 4.615 0.000) 4.615 8.299 ( 0.000 4.519 0.000) 4.519 8.901 ( 0.000 3.238 0.000) 3.238 9.443 ( 0.000 13.147 -0.000) 13.147 25.296 ( 0.000 28.342 0.000) 28.342 25.336 ( 0.000 28.513 0.000) 28.513 27.555 ( 0.000 7.464 0.000) 7.464 27.743 ( 0.000 11.811 0.000) 11.811 29.611 ( 0.000 -5.222 0.000) 5.222 30.222 ( 0.000 -5.619 0.000) 5.619 33.967 ( 0.000 -29.916 0.000) 29.916 34.292 ( 0.000 -34.150 0.000) 34.150 94.408 ( 0.000 14.227 0.000) 14.227 94.479 ( 0.000 16.528 0.000) 16.528 97.015 ( 0.000 -6.004 0.000) 6.004 97.861 ( 0.000 -17.453 0.000) 17.453 ======================= Grid point 33 (19/252) ======================= q-point: ( 0.00 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.729 ( 0.000 26.998 0.000) 26.998 1.854 ( 0.000 33.317 0.000) 33.317 2.553 ( 0.000 36.858 0.000) 36.858 2.867 ( 0.000 1.141 0.000) 1.141 2.937 ( 0.000 -0.837 0.000) 0.837 2.960 ( 0.000 15.269 0.000) 15.269 3.271 ( 0.000 4.447 0.000) 4.447 3.401 ( 0.000 1.476 0.000) 1.476 3.994 ( 0.000 9.258 0.000) 9.258 4.152 ( 0.000 10.671 0.000) 10.671 4.261 ( 0.000 -5.260 0.000) 5.260 4.545 ( 0.000 -1.213 0.000) 1.213 4.695 ( 0.000 -7.824 0.000) 7.824 5.075 ( 0.000 -7.232 0.000) 7.232 5.115 ( 0.000 3.346 0.000) 3.346 5.172 ( 0.000 -3.204 0.000) 3.204 5.262 ( 0.000 -5.139 0.000) 5.139 5.900 ( 0.000 -11.577 0.000) 11.577 6.741 ( 0.000 -0.681 0.000) 0.681 6.828 ( 0.000 -20.020 0.000) 20.020 7.736 ( 0.000 3.943 0.000) 3.943 8.471 ( 0.000 4.553 0.000) 4.553 8.603 ( 0.000 3.196 0.000) 3.196 9.075 ( 0.000 -4.564 0.000) 4.564 25.939 ( 0.000 39.962 0.000) 39.962 26.313 ( 0.000 36.762 0.000) 36.762 27.722 ( 0.000 10.359 0.000) 10.359 28.003 ( 0.000 15.785 0.000) 15.785 29.439 ( 0.000 -7.385 0.000) 7.385 30.083 ( 0.000 -8.974 0.000) 8.974 33.264 ( 0.000 -41.858 0.000) 41.858 33.662 ( 0.000 -45.704 0.000) 45.704 94.721 ( 0.000 17.961 0.000) 17.961 95.742 ( 0.000 4.865 0.000) 4.865 96.864 ( 0.000 -8.819 0.000) 8.819 96.976 ( 0.000 -9.869 0.000) 9.869 ======================= Grid point 34 (20/252) ======================= q-point: ( 0.10 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( -10.012 30.919 -2.374) 32.586 1.767 ( 3.626 26.458 1.198) 26.732 2.705 ( -4.063 3.382 -12.286) 13.375 2.848 ( 19.463 33.616 8.386) 39.739 2.932 ( -0.973 15.440 -2.619) 15.691 3.027 ( 2.953 1.994 4.524) 5.759 3.300 ( 1.306 0.629 -5.934) 6.108 3.452 ( 3.814 1.587 10.721) 11.489 3.951 ( -4.257 6.611 -2.549) 8.266 4.115 ( -4.445 8.103 2.524) 9.581 4.317 ( 4.001 -2.165 2.841) 5.363 4.460 ( -11.294 -6.453 -3.645) 13.508 4.550 ( -4.564 0.089 -1.548) 4.821 5.077 ( 0.592 -6.152 -1.323) 6.321 5.134 ( 1.984 1.057 -0.422) 2.287 5.228 ( -0.956 -6.113 -0.408) 6.200 5.322 ( 7.779 -2.101 1.820) 8.261 5.888 ( -0.334 -11.476 -2.354) 11.720 6.578 ( -13.729 -3.297 -2.749) 14.385 6.846 ( -2.711 -18.197 4.449) 18.928 7.746 ( 1.391 2.824 -2.868) 4.259 8.369 ( -8.107 7.808 -2.956) 11.637 8.498 ( 0.524 3.710 -2.469) 4.487 9.365 ( 17.224 -5.970 6.432) 19.331 25.941 ( 0.114 39.932 0.436) 39.934 26.264 ( -4.170 38.132 -1.873) 38.405 27.723 ( 0.125 10.377 -0.141) 10.378 28.003 ( 0.083 15.777 -0.107) 15.777 29.444 ( 0.387 -7.441 0.250) 7.455 30.085 ( 0.043 -8.894 0.362) 8.902 33.263 ( -0.326 -41.892 0.734) 41.900 33.652 ( -1.114 -46.116 -0.311) 46.131 94.721 ( -0.289 17.957 0.857) 17.979 95.545 ( -15.422 11.173 -5.808) 19.909 96.869 ( 0.722 -8.866 -1.206) 8.976 97.109 ( 10.040 -14.651 3.720) 18.147 ======================= Grid point 35 (21/252) ======================= q-point: ( 0.20 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( 2.697 21.617 2.923) 21.980 1.871 ( 6.338 25.243 1.950) 26.100 2.578 ( 0.126 5.117 -10.733) 11.891 2.865 ( -3.582 15.241 -2.315) 15.826 3.054 ( 4.346 3.697 -6.048) 8.315 3.219 ( -0.301 1.588 2.042) 2.604 3.383 ( 19.679 28.932 6.842) 35.653 3.596 ( 1.180 -1.507 8.842) 9.047 3.784 ( -10.023 0.099 -5.248) 11.314 4.042 ( -5.289 6.238 2.901) 8.678 4.280 ( -4.610 -4.655 -0.329) 6.559 4.411 ( 3.038 -0.233 4.239) 5.220 4.474 ( -4.007 0.813 -0.874) 4.181 5.082 ( 0.802 -5.855 -1.005) 5.994 5.171 ( 2.640 -0.635 -1.933) 3.333 5.193 ( -1.804 -5.050 -0.357) 5.374 5.433 ( 3.208 -0.784 0.081) 3.304 5.859 ( -0.378 -9.824 -3.559) 10.456 6.226 ( -20.375 -5.283 -6.698) 22.088 6.817 ( -5.158 -18.871 10.662) 22.280 7.728 ( 1.079 2.589 -7.903) 8.386 8.328 ( 2.689 9.137 -0.098) 9.525 8.538 ( 5.197 4.179 0.276) 6.674 9.631 ( 7.873 -4.541 2.741) 9.493 25.950 ( 0.311 39.767 0.754) 39.775 26.160 ( -5.079 39.955 -2.373) 40.346 27.724 ( 0.217 10.424 -0.215) 10.429 28.005 ( 0.207 15.781 -0.140) 15.782 29.456 ( 0.595 -7.594 0.368) 7.626 30.088 ( -0.045 -8.693 0.538) 8.710 33.262 ( -0.481 -41.972 1.203) 41.992 33.617 ( -2.311 -46.757 -0.700) 46.819 94.722 ( -0.490 17.937 1.407) 17.999 95.225 ( -13.897 17.516 -5.131) 22.940 96.872 ( 0.897 -8.846 -2.016) 9.117 97.300 ( 7.598 -19.100 2.621) 20.722 ======================= Grid point 36 (22/252) ======================= q-point: ( 0.30 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.816 ( 14.671 10.140 7.171) 19.222 2.014 ( 7.572 24.170 2.114) 25.416 2.571 ( 6.875 4.903 -9.102) 12.416 2.771 ( -4.874 14.602 -2.364) 15.574 3.052 ( 0.442 1.471 -6.796) 6.968 3.223 ( 1.440 0.021 1.326) 1.958 3.471 ( -12.976 -2.350 -4.647) 13.982 3.640 ( -7.538 -1.880 4.818) 9.141 3.778 ( 13.582 24.304 5.411) 28.362 3.991 ( -0.749 6.622 1.905) 6.931 4.268 ( -0.170 -5.622 4.893) 7.455 4.399 ( -1.716 2.084 -3.128) 4.132 4.482 ( 1.606 0.394 4.710) 4.992 5.092 ( 0.874 -6.188 -0.524) 6.272 5.162 ( -0.812 -2.161 -0.335) 2.333 5.201 ( 1.564 -3.796 -1.846) 4.501 5.448 ( -1.046 1.627 -1.049) 2.201 5.760 ( -15.769 -5.129 -4.943) 17.303 5.885 ( -2.061 -12.378 -4.695) 13.398 6.817 ( -4.141 -19.124 12.192) 23.055 7.689 ( 1.237 4.451 -8.464) 9.643 8.381 ( 3.909 8.298 -3.916) 9.973 8.694 ( 8.727 4.505 5.520) 11.266 9.699 ( -0.406 -1.092 -0.515) 1.274 25.961 ( 0.254 39.349 0.619) 39.355 26.063 ( -3.702 40.506 -1.715) 40.711 27.727 ( 0.234 10.488 -0.197) 10.493 28.009 ( 0.283 15.834 -0.103) 15.837 29.469 ( 0.558 -7.792 0.326) 7.819 30.090 ( -0.185 -8.457 0.481) 8.473 33.263 ( -0.421 -42.060 1.221) 42.080 33.564 ( -2.686 -47.130 -0.844) 47.214 94.723 ( -0.522 17.896 1.431) 17.961 94.993 ( -8.543 19.256 -3.060) 21.287 96.872 ( 0.735 -8.915 -2.112) 9.191 97.416 ( 3.991 -20.361 1.230) 20.785 ======================= Grid point 37 (23/252) ======================= q-point: ( 0.40 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.160 ( 6.152 23.890 2.584) 24.804 2.175 ( 17.320 2.602 6.548) 18.698 2.662 ( -3.585 13.290 -2.555) 14.000 2.695 ( 11.326 2.771 -7.002) 13.601 2.996 ( -4.158 0.319 1.102) 4.314 3.163 ( -11.783 -3.068 -4.359) 12.933 3.300 ( 2.094 0.397 -5.137) 5.561 3.461 ( -12.316 1.782 3.893) 13.039 3.938 ( 3.341 7.371 1.947) 8.324 4.052 ( 2.213 13.956 2.269) 14.312 4.257 ( -3.055 -3.857 4.331) 6.555 4.432 ( 6.405 -1.148 -4.496) 7.909 4.535 ( -0.049 1.528 5.230) 5.449 5.100 ( 0.145 -8.304 -0.293) 8.310 5.154 ( -0.045 0.984 -0.991) 1.397 5.209 ( 0.816 -4.286 0.174) 4.366 5.382 ( -5.026 7.774 -1.767) 9.424 5.459 ( -9.489 -11.306 -3.888) 15.264 5.906 ( 3.146 -12.020 -1.243) 12.487 6.821 ( -3.281 -19.527 7.813) 21.286 7.664 ( 1.370 7.130 -4.993) 8.812 8.411 ( 2.431 7.575 -3.747) 8.794 8.884 ( 6.979 4.462 5.111) 9.733 9.646 ( -3.419 1.772 -1.745) 4.227 25.959 ( -0.684 38.817 -0.321) 38.824 26.013 ( -1.024 40.430 -0.188) 40.443 27.730 ( 0.154 10.543 -0.112) 10.545 28.013 ( 0.210 15.913 -0.047) 15.914 29.479 ( 0.326 -7.959 0.181) 7.968 30.089 ( -0.183 -8.275 0.269) 8.281 33.264 ( -0.231 -42.124 0.763) 42.132 33.516 ( -1.782 -47.293 -0.568) 47.330 94.723 ( -0.345 17.846 0.898) 17.872 94.867 ( -3.875 19.143 -1.355) 19.578 96.870 ( 0.368 -9.046 -1.357) 9.155 97.472 ( 1.669 -20.467 0.457) 20.540 ======================= Grid point 38 (24/252) ======================= q-point: (-0.50 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.234 ( 0.000 24.862 0.000) 24.862 2.408 ( 0.000 -0.904 0.000) 0.904 2.604 ( 0.000 12.320 0.000) 12.320 2.873 ( 0.000 -0.561 -0.000) 0.561 2.885 ( -0.000 -0.596 0.000) 0.596 3.002 ( -0.000 -1.071 -0.000) 1.071 3.254 ( 0.000 3.502 0.000) 3.502 3.387 ( 0.000 1.678 0.000) 1.678 3.993 ( -0.000 6.847 -0.000) 6.847 4.041 ( 0.000 8.435 0.000) 8.435 4.267 ( 0.000 1.687 -0.000) 1.687 4.480 ( 0.000 -8.488 0.000) 8.488 4.546 ( 0.000 2.054 0.000) 2.054 5.098 ( 0.000 -9.223 0.000) 9.223 5.146 ( 0.000 1.647 -0.000) 1.647 5.246 ( -0.000 -1.766 -0.000) 1.766 5.288 ( 0.000 10.370 0.000) 10.370 5.373 ( 0.000 -12.019 -0.000) 12.019 5.936 ( 0.000 -12.638 0.000) 12.638 6.815 ( 0.000 -19.611 0.000) 19.611 7.662 ( 0.000 8.320 -0.000) 8.320 8.419 ( 0.000 7.300 0.000) 7.300 8.975 ( 0.000 4.290 0.000) 4.290 9.599 ( 0.000 2.921 -0.000) 2.921 25.948 ( 0.000 38.773 0.000) 38.773 26.007 ( 0.000 40.148 0.000) 40.148 27.731 ( 0.000 10.564 0.000) 10.564 28.015 ( 0.000 15.951 0.000) 15.951 29.483 ( 0.000 -8.024 -0.000) 8.024 30.088 ( 0.000 -8.207 0.000) 8.207 33.265 ( 0.000 -42.147 0.000) 42.147 33.497 ( 0.000 -47.340 0.000) 47.340 94.723 ( 0.000 17.820 0.000) 17.820 94.828 ( 0.000 18.953 0.000) 18.953 96.868 ( 0.000 -9.115 0.000) 9.115 97.488 ( 0.000 -20.422 0.000) 20.422 ======================= Grid point 44 (25/252) ======================= q-point: ( 0.00 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.226 ( 0.000 24.128 0.000) 24.128 2.474 ( 0.000 29.864 0.000) 29.864 2.874 ( 0.000 0.573 0.000) 0.573 2.927 ( 0.000 0.194 0.000) 0.194 3.202 ( 0.000 29.077 0.000) 29.077 3.266 ( 0.000 14.578 0.000) 14.578 3.380 ( 0.000 6.638 0.000) 6.638 3.431 ( 0.000 2.484 0.000) 2.484 4.147 ( 0.000 -5.860 0.000) 5.860 4.163 ( 0.000 7.886 0.000) 7.886 4.359 ( 0.000 9.838 0.000) 9.838 4.441 ( 0.000 -10.145 0.000) 10.145 4.616 ( 0.000 -0.132 0.000) 0.132 4.920 ( 0.000 -8.718 0.000) 8.718 5.094 ( 0.000 -4.472 0.000) 4.472 5.136 ( 0.000 -0.923 0.000) 0.923 5.201 ( 0.000 -0.299 0.000) 0.299 5.696 ( 0.000 -8.912 0.000) 8.912 6.428 ( 0.000 -20.735 0.000) 20.735 6.677 ( 0.000 -7.256 0.000) 7.256 7.817 ( 0.000 5.431 0.000) 5.431 8.543 ( 0.000 1.566 0.000) 1.566 8.657 ( 0.000 3.337 0.000) 3.337 9.005 ( 0.000 -2.671 0.000) 2.671 26.807 ( 0.000 49.264 0.000) 49.264 27.121 ( 0.000 46.318 0.000) 46.318 27.948 ( 0.000 12.887 0.000) 12.887 28.333 ( 0.000 18.050 0.000) 18.050 29.269 ( 0.000 -10.169 0.000) 10.169 29.885 ( 0.000 -11.406 0.000) 11.406 32.356 ( 0.000 -51.330 0.000) 51.330 32.680 ( 0.000 -55.001 0.000) 55.001 95.085 ( 0.000 19.329 0.000) 19.329 95.851 ( 0.000 6.385 0.000) 6.385 96.668 ( 0.000 -11.337 0.000) 11.337 96.772 ( 0.000 -11.044 0.000) 11.044 ======================= Grid point 45 (26/252) ======================= q-point: ( 0.10 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.254 ( 3.235 23.695 -0.889) 23.931 2.272 ( -14.535 28.702 -2.202) 32.248 2.777 ( -2.258 4.455 -8.101) 9.517 3.027 ( 3.013 -0.170 6.933) 7.561 3.237 ( -2.170 13.708 -2.111) 14.038 3.299 ( -2.296 4.436 -5.720) 7.594 3.443 ( 11.094 11.181 4.665) 16.427 3.544 ( 11.711 18.060 8.792) 23.251 4.014 ( -10.470 -1.392 -6.441) 12.371 4.152 ( -5.867 -4.285 4.883) 8.754 4.363 ( 0.815 1.603 0.889) 2.006 4.397 ( -1.920 6.653 -2.515) 7.367 4.573 ( -3.297 1.618 0.201) 3.679 4.920 ( -0.206 -9.119 0.611) 9.142 5.107 ( 0.180 -5.905 -0.322) 5.916 5.133 ( 0.925 -1.585 -1.896) 2.639 5.288 ( 6.711 -1.081 2.095) 7.113 5.685 ( -0.303 -8.846 -1.552) 8.986 6.404 ( -5.355 -16.799 3.835) 18.044 6.546 ( -11.137 -11.331 -3.802) 16.337 7.822 ( 1.282 5.809 -2.588) 6.488 8.537 ( -4.235 7.733 -1.724) 8.984 8.546 ( 1.130 2.286 -1.834) 3.141 9.240 ( 15.168 -6.659 5.195) 17.361 26.809 ( 0.002 49.236 0.510) 49.238 27.089 ( -2.833 46.821 -1.375) 46.927 27.949 ( 0.137 12.890 -0.115) 12.891 28.333 ( 0.053 18.022 -0.081) 18.023 29.273 ( 0.245 -10.214 0.331) 10.222 29.889 ( 0.165 -11.319 0.485) 11.331 32.355 ( -0.391 -51.356 0.747) 51.363 32.664 ( -1.604 -55.243 -0.551) 55.269 95.085 ( -0.368 19.295 0.957) 19.322 95.743 ( -9.143 9.649 -3.333) 13.704 96.671 ( 0.512 -11.470 -0.850) 11.512 96.837 ( 5.304 -13.536 1.979) 14.672 ======================= Grid point 46 (27/252) ======================= q-point: ( 0.20 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.053 ( -6.446 23.172 -0.788) 24.065 2.336 ( 5.140 22.527 1.608) 23.161 2.708 ( -0.193 8.281 -4.981) 9.666 3.087 ( 2.221 2.452 -5.496) 6.415 3.174 ( -3.214 12.024 -0.503) 12.456 3.226 ( -1.916 1.876 -1.843) 3.254 3.551 ( -0.953 -3.302 6.666) 7.500 3.709 ( -14.771 -7.045 -6.659) 17.668 3.945 ( 19.514 26.087 7.500) 33.430 4.094 ( -4.405 -1.649 4.466) 6.487 4.265 ( -5.191 4.297 -3.107) 7.421 4.453 ( 2.245 4.718 2.397) 5.748 4.517 ( -2.865 2.909 1.043) 4.214 4.920 ( -0.532 -9.856 1.223) 9.946 5.096 ( -0.552 -4.627 -0.478) 4.684 5.144 ( 1.614 -2.617 -2.394) 3.897 5.397 ( 3.216 -2.221 0.767) 3.983 5.675 ( 0.749 -8.480 -2.215) 8.796 6.126 ( -20.302 -6.680 -6.947) 22.474 6.436 ( -3.877 -19.910 7.440) 21.606 7.823 ( 1.956 7.495 -5.116) 9.284 8.522 ( 1.747 9.806 -1.480) 10.069 8.601 ( 6.417 2.736 1.211) 7.080 9.500 ( 9.344 -8.448 2.814) 12.908 26.814 ( -0.010 49.064 0.783) 49.071 27.011 ( -4.123 47.742 -1.990) 47.961 27.952 ( 0.238 12.902 -0.161) 12.906 28.335 ( 0.220 18.013 -0.067) 18.014 29.282 ( 0.356 -10.341 0.495) 10.359 29.896 ( 0.127 -11.122 0.718) 11.146 32.353 ( -0.570 -51.408 1.229) 51.426 32.617 ( -2.783 -55.752 -0.965) 55.830 95.085 ( -0.617 19.211 1.556) 19.284 95.533 ( -10.134 14.606 -3.616) 18.141 96.673 ( 0.569 -11.620 -1.421) 11.721 96.949 ( 4.883 -17.204 1.726) 17.967 ======================= Grid point 47 (28/252) ======================= q-point: ( 0.30 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.051 ( 4.998 13.600 3.319) 14.865 2.458 ( 6.711 21.173 2.029) 22.304 2.700 ( 3.154 8.412 -4.573) 10.081 3.036 ( -3.163 7.631 -4.795) 9.552 3.106 ( -3.178 8.737 -2.946) 9.752 3.209 ( -0.676 -1.919 -0.510) 2.098 3.375 ( -11.063 -6.979 -5.734) 14.282 3.582 ( -4.704 -3.619 5.300) 7.957 4.032 ( -4.599 2.651 1.541) 5.528 4.164 ( -1.074 1.826 0.016) 2.118 4.276 ( 5.803 14.111 4.882) 16.020 4.472 ( 1.302 5.489 -1.776) 5.915 4.519 ( 0.991 2.948 4.332) 5.332 4.917 ( -0.956 -10.537 1.829) 10.737 5.093 ( 0.633 -3.923 0.161) 3.977 5.149 ( 0.648 -2.934 -2.452) 3.878 5.401 ( -2.991 -3.808 -0.980) 4.941 5.673 ( 0.040 -8.991 -2.612) 9.363 5.747 ( -12.832 0.318 -5.102) 13.813 6.433 ( -2.993 -19.965 7.950) 21.697 7.828 ( 2.639 9.784 -5.018) 11.308 8.542 ( 2.352 7.381 -3.530) 8.513 8.779 ( 9.579 4.739 4.765) 11.701 9.611 ( 2.173 -7.293 0.069) 7.610 26.817 ( -0.325 48.615 0.457) 48.619 26.927 ( -3.389 48.391 -1.479) 48.532 27.955 ( 0.258 12.929 -0.130) 12.933 28.340 ( 0.367 18.118 0.005) 18.121 29.291 ( 0.309 -10.513 0.446) 10.527 29.902 ( -0.041 -10.938 0.642) 10.957 32.352 ( -0.491 -51.445 1.252) 51.463 32.556 ( -2.966 -56.216 -1.035) 56.303 95.085 ( -0.647 19.118 1.567) 19.193 95.350 ( -7.337 17.613 -2.543) 19.248 96.671 ( 0.367 -11.769 -1.517) 11.872 97.029 ( 2.962 -19.421 0.986) 19.670 ======================= Grid point 48 (29/252) ======================= q-point: ( 0.40 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.237 ( 10.395 3.997 4.684) 12.082 2.599 ( 6.980 20.355 2.157) 21.626 2.763 ( 7.786 4.800 -5.985) 10.931 2.924 ( -6.159 10.509 -1.763) 12.307 2.998 ( -7.680 0.955 -0.251) 7.743 3.079 ( -9.849 -4.401 -0.936) 10.828 3.310 ( 4.870 1.107 -4.664) 6.833 3.500 ( -6.982 2.047 2.830) 7.807 3.989 ( 0.724 -0.361 -1.153) 1.408 4.153 ( -3.171 -4.831 4.995) 7.639 4.284 ( -2.083 8.953 0.832) 9.230 4.474 ( -1.611 3.294 -5.908) 6.954 4.566 ( 0.306 1.186 4.013) 4.196 4.908 ( -1.350 -10.849 1.413) 11.024 5.121 ( 1.402 -4.828 0.673) 5.072 5.144 ( 0.944 -2.084 -1.091) 2.534 5.333 ( -0.437 0.883 -0.982) 1.391 5.557 ( -5.588 6.088 -1.961) 8.494 5.698 ( 1.524 -8.511 -0.981) 8.702 6.429 ( -2.313 -20.324 4.689) 20.986 7.848 ( 2.374 11.665 -2.679) 12.201 8.555 ( 1.452 6.654 -2.749) 7.344 8.974 ( 7.371 4.758 4.090) 9.680 9.603 ( -1.698 -5.518 -1.281) 5.914 26.803 ( -1.000 48.047 -0.402) 48.059 26.880 ( -1.134 48.708 -0.156) 48.721 27.959 ( 0.169 12.958 -0.065) 12.960 28.347 ( 0.296 18.291 0.037) 18.294 29.298 ( 0.169 -10.665 0.251) 10.669 29.904 ( -0.108 -10.834 0.361) 10.840 32.352 ( -0.265 -51.451 0.783) 51.458 32.504 ( -1.906 -56.507 -0.667) 56.543 95.084 ( -0.424 19.053 0.976) 19.083 95.236 ( -3.673 18.855 -1.246) 19.250 96.666 ( 0.123 -11.870 -0.992) 11.912 97.073 ( 1.350 -20.457 0.428) 20.506 ======================= Grid point 49 (30/252) ======================= q-point: (-0.50 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.383 ( 0.000 -1.182 0.000) 1.182 2.702 ( 0.000 22.552 0.000) 22.552 2.826 ( 0.000 6.798 -0.000) 6.798 2.874 ( 0.000 0.976 -0.000) 0.976 2.880 ( -0.000 2.538 0.000) 2.538 2.951 ( 0.000 -3.375 -0.000) 3.375 3.364 ( 0.000 7.335 0.000) 7.335 3.418 ( 0.000 1.636 -0.000) 1.636 4.022 ( 0.000 -4.602 0.000) 4.602 4.101 ( 0.000 -0.524 0.000) 0.524 4.329 ( -0.000 2.423 -0.000) 2.423 4.359 ( 0.000 0.157 0.000) 0.157 4.588 ( 0.000 1.922 0.000) 1.922 4.898 ( 0.000 -11.395 0.000) 11.395 5.141 ( 0.000 -7.074 0.000) 7.074 5.147 ( 0.000 -1.509 0.000) 1.509 5.368 ( -0.000 6.676 -0.000) 6.676 5.473 ( 0.000 8.426 0.000) 8.426 5.712 ( 0.000 -9.747 0.000) 9.747 6.422 ( 0.000 -20.389 0.000) 20.389 7.863 ( 0.000 12.332 -0.000) 12.332 8.558 ( 0.000 6.452 0.000) 6.452 9.064 ( 0.000 4.774 0.000) 4.774 9.573 ( 0.000 -4.831 -0.000) 4.831 26.790 ( 0.000 47.904 0.000) 47.904 26.871 ( 0.000 48.679 -0.000) 48.679 27.960 ( 0.000 12.971 0.000) 12.971 28.350 ( 0.000 18.378 0.000) 18.378 29.301 ( 0.000 -10.726 -0.000) 10.726 29.904 ( 0.000 -10.804 0.000) 10.804 32.353 ( 0.000 -51.448 0.000) 51.448 32.484 ( 0.000 -56.605 0.000) 56.605 95.083 ( 0.000 19.032 0.000) 19.032 95.199 ( 0.000 19.158 0.000) 19.158 96.664 ( 0.000 -11.904 0.000) 11.904 97.086 ( 0.000 -20.759 -0.000) 20.759 ======================= Grid point 55 (31/252) ======================= q-point: ( 0.00 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.661 ( 0.000 20.609 0.000) 20.609 2.870 ( 0.000 4.599 0.000) 4.599 2.884 ( 0.000 0.427 0.000) 0.427 3.068 ( 0.000 20.364 0.000) 20.364 3.401 ( 0.000 -0.515 0.000) 0.515 3.517 ( 0.000 7.149 0.000) 7.149 3.519 ( 0.000 6.705 0.000) 6.705 3.719 ( 0.000 21.393 0.000) 21.393 4.086 ( 0.000 1.587 0.000) 1.587 4.210 ( 0.000 -12.944 0.000) 12.944 4.283 ( 0.000 3.880 0.000) 3.880 4.484 ( 0.000 2.204 0.000) 2.204 4.614 ( 0.000 -0.852 0.000) 0.852 4.736 ( 0.000 -10.206 0.000) 10.206 5.032 ( 0.000 -1.596 0.000) 1.596 5.097 ( 0.000 -2.626 0.000) 2.626 5.287 ( 0.000 10.334 0.000) 10.334 5.574 ( 0.000 -3.176 0.000) 3.176 6.048 ( 0.000 -17.872 0.000) 17.872 6.435 ( 0.000 -17.435 0.000) 17.435 7.966 ( 0.000 9.781 0.000) 9.781 8.506 ( 0.000 -4.886 0.000) 4.886 8.747 ( 0.000 5.326 0.000) 5.326 8.963 ( 0.000 -1.983 0.000) 1.983 27.831 ( 0.000 55.877 0.000) 55.877 28.091 ( 0.000 52.414 0.000) 52.414 28.218 ( 0.000 15.716 0.000) 15.716 28.693 ( 0.000 18.985 0.000) 18.985 29.048 ( 0.000 -12.624 0.000) 12.624 29.641 ( 0.000 -13.782 0.000) 13.782 31.295 ( 0.000 -57.582 0.000) 57.582 31.558 ( 0.000 -60.196 0.000) 60.196 95.459 ( 0.000 18.998 0.000) 18.998 95.989 ( 0.000 7.851 0.000) 7.851 96.426 ( 0.000 -13.668 0.000) 13.668 96.555 ( 0.000 -11.123 0.000) 11.123 ======================= Grid point 56 (32/252) ======================= q-point: ( 0.10 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.680 ( 2.142 20.110 -0.072) 20.224 2.749 ( -11.101 16.517 -3.976) 20.294 2.901 ( -3.358 10.847 -2.126) 11.552 3.014 ( 2.693 0.045 5.750) 6.350 3.337 ( -5.067 2.420 -5.102) 7.587 3.456 ( -1.671 3.094 -0.908) 3.632 3.524 ( -1.751 4.358 1.028) 4.808 3.887 ( -14.451 -8.322 -5.287) 17.494 3.996 ( 13.748 17.439 6.485) 23.134 4.083 ( -1.306 1.851 1.441) 2.685 4.424 ( 4.770 4.232 1.757) 6.614 4.534 ( 1.797 2.986 0.501) 3.520 4.594 ( -1.145 0.554 -0.396) 1.332 4.733 ( -1.226 -9.750 1.420) 9.929 5.027 ( -0.276 -1.756 -0.317) 1.806 5.089 ( -0.053 -2.509 -1.274) 2.814 5.310 ( 2.553 4.891 0.405) 5.532 5.567 ( -0.344 -2.831 -0.662) 2.927 6.053 ( -0.993 -17.453 3.613) 17.851 6.284 ( -13.412 -16.842 -5.349) 22.184 7.981 ( 2.036 10.277 -1.534) 10.589 8.517 ( 2.200 -3.879 -1.295) 4.644 8.714 ( -0.705 8.640 -0.115) 8.670 9.114 ( 11.079 -6.251 3.197) 13.116 27.832 ( -0.048 55.904 0.525) 55.907 28.066 ( -2.226 53.192 -1.077) 53.250 28.218 ( 0.074 15.156 -0.200) 15.157 28.692 ( -0.082 18.798 -0.082) 18.799 29.051 ( 0.149 -12.611 0.435) 12.620 29.646 ( 0.293 -13.670 0.627) 13.687 31.294 ( -0.440 -57.600 0.773) 57.607 31.537 ( -1.918 -60.351 -0.736) 60.386 95.458 ( -0.390 18.952 0.789) 18.972 95.930 ( -5.206 9.850 -1.799) 11.285 96.426 ( 0.173 -13.781 -0.466) 13.790 96.583 ( 2.231 -12.715 0.895) 12.940 ======================= Grid point 57 (33/252) ======================= q-point: ( 0.20 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.481 ( -11.896 20.496 -3.332) 23.931 2.737 ( 3.662 18.591 0.890) 18.969 2.887 ( 0.626 9.694 0.622) 9.734 3.110 ( 2.892 -0.038 0.784) 2.997 3.208 ( -3.808 0.815 -3.993) 5.578 3.413 ( -3.174 3.437 -3.186) 5.660 3.462 ( -8.466 -3.595 0.686) 9.223 3.546 ( -11.645 -8.329 -1.538) 14.400 4.052 ( -2.217 0.276 2.963) 3.710 4.341 ( 10.499 13.487 3.605) 17.468 4.425 ( -3.222 10.582 -0.047) 11.062 4.546 ( 0.801 1.546 0.818) 1.924 4.581 ( 0.276 5.390 -1.722) 5.666 4.716 ( -2.017 -10.383 3.187) 11.047 5.024 ( 0.215 -2.413 -0.355) 2.448 5.085 ( 0.514 -3.067 -1.235) 3.346 5.365 ( 1.989 -0.341 0.357) 2.049 5.561 ( 0.260 -2.587 -0.818) 2.726 5.941 ( -15.772 -12.249 -6.089) 20.877 6.066 ( -2.087 -17.728 4.693) 18.457 8.012 ( 3.142 11.544 -3.052) 12.347 8.567 ( 3.820 -3.131 -1.740) 5.237 8.757 ( 5.068 10.774 1.641) 12.019 9.323 ( 8.685 -9.436 2.327) 13.034 27.835 ( -0.262 55.838 0.725) 55.843 28.002 ( -3.512 54.196 -1.713) 54.337 28.219 ( 0.198 14.615 -0.151) 14.617 28.692 ( 0.180 18.548 0.027) 18.549 29.058 ( 0.182 -12.626 0.623) 12.643 29.658 ( 0.252 -13.473 0.896) 13.505 31.291 ( -0.613 -57.618 1.283) 57.636 31.482 ( -3.188 -60.718 -1.226) 60.814 95.456 ( -0.636 18.839 1.282) 18.893 95.803 ( -6.529 13.586 -2.201) 15.233 96.425 ( 0.134 -13.958 -0.776) 13.980 96.631 ( 2.097 -15.665 0.842) 15.827 ======================= Grid point 58 (34/252) ======================= q-point: ( 0.30 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.325 ( -3.541 14.280 -0.365) 14.717 2.813 ( 3.209 14.406 0.262) 14.762 2.890 ( 0.350 10.905 -0.266) 10.914 3.072 ( -8.672 -3.063 -3.485) 9.835 3.120 ( -4.962 -4.430 -2.171) 6.997 3.266 ( 1.211 -1.876 -3.455) 4.113 3.333 ( -5.676 7.948 -1.621) 9.900 3.511 ( -0.612 -3.226 6.347) 7.146 4.038 ( -1.840 0.158 3.016) 3.537 4.224 ( -8.806 6.241 -3.933) 11.488 4.494 ( -2.130 6.667 1.810) 7.229 4.549 ( 0.131 -2.202 -1.103) 2.466 4.584 ( -0.664 3.544 -2.285) 4.269 4.719 ( -1.534 -8.030 5.062) 9.616 5.030 ( 0.685 -2.444 -0.270) 2.553 5.085 ( 0.363 -3.416 -1.128) 3.616 5.366 ( -0.226 1.363 -0.253) 1.405 5.557 ( -0.034 -2.505 -0.919) 2.669 5.718 ( -4.506 -3.522 -2.398) 6.202 6.064 ( -1.965 -17.557 4.468) 18.222 8.054 ( 3.803 13.001 -3.061) 13.888 8.614 ( 2.777 -0.831 -2.242) 3.664 8.904 ( 8.412 8.317 3.046) 12.215 9.443 ( 3.418 -9.460 0.539) 10.073 27.829 ( -0.816 55.499 0.241) 55.506 27.929 ( -3.018 54.727 -1.254) 54.825 28.222 ( 0.238 14.486 -0.040) 14.488 28.699 ( 0.530 18.664 0.204) 18.673 29.065 ( 0.109 -12.733 0.527) 12.744 29.666 ( -0.009 -13.403 0.765) 13.425 31.290 ( -0.491 -57.584 1.318) 57.601 31.413 ( -3.283 -61.103 -1.264) 61.204 95.453 ( -0.641 18.719 1.292) 18.774 95.680 ( -5.263 16.624 -1.717) 17.522 96.420 ( -0.007 -14.073 -0.840) 14.099 96.666 ( 1.229 -18.117 0.507) 18.166 ======================= Grid point 59 (35/252) ======================= q-point: ( 0.40 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.332 ( 2.742 5.890 1.504) 6.668 2.829 ( 0.918 3.548 -3.892) 5.346 2.848 ( -6.840 -7.884 -2.919) 10.838 2.968 ( 3.990 11.887 1.163) 12.592 3.010 ( -7.097 0.156 2.220) 7.438 3.215 ( -5.925 10.936 -1.643) 12.546 3.356 ( 7.488 3.646 -0.827) 8.369 3.537 ( -1.173 1.762 2.948) 3.629 3.997 ( -3.580 2.195 -1.818) 4.576 4.100 ( -3.039 -0.135 2.071) 3.680 4.395 ( -6.914 0.892 -2.360) 7.360 4.473 ( -4.357 -2.687 -3.903) 6.437 4.585 ( 0.898 0.830 1.626) 2.034 4.690 ( -3.355 -11.038 2.645) 11.836 5.038 ( 0.203 -3.057 -0.290) 3.078 5.090 ( 0.765 -3.256 -0.520) 3.384 5.426 ( 5.521 7.198 1.459) 9.188 5.558 ( 0.325 -2.546 0.191) 2.574 5.663 ( -1.933 1.843 -1.368) 3.000 6.056 ( -1.486 -17.567 2.384) 17.791 8.102 ( 3.027 14.027 -1.653) 14.445 8.637 ( 1.330 0.957 -1.602) 2.291 9.071 ( 6.928 5.424 2.672) 9.196 9.463 ( -0.612 -8.113 -0.706) 8.166 27.807 ( -1.256 55.172 -0.521) 55.188 27.886 ( -1.136 54.805 -0.104) 54.817 28.226 ( 0.160 14.491 0.013) 14.492 28.711 ( 0.493 19.077 0.210) 19.085 29.069 ( 0.030 -12.898 0.279) 12.901 29.668 ( -0.133 -13.474 0.414) 13.481 31.292 ( -0.246 -57.538 0.828) 57.544 31.355 ( -2.070 -61.345 -0.796) 61.385 95.451 ( -0.400 18.648 0.807) 18.670 95.596 ( -2.832 18.351 -0.901) 18.590 96.414 ( -0.079 -14.099 -0.560) 14.111 96.684 ( 0.528 -19.633 0.227) 19.641 ======================= Grid point 60 (36/252) ======================= q-point: (-0.50 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( 0.000 1.152 0.000) 1.152 2.749 ( 0.000 -8.701 0.000) 8.701 2.875 ( 0.000 0.929 -0.000) 0.929 2.896 ( -0.000 -0.595 0.000) 0.595 3.072 ( 0.000 9.864 0.000) 9.864 3.111 ( 0.000 16.379 0.000) 16.379 3.458 ( -0.000 2.861 0.000) 2.861 3.506 ( 0.000 6.452 0.000) 6.452 3.950 ( 0.000 -0.297 0.000) 0.297 4.086 ( 0.000 0.051 0.000) 0.051 4.309 ( 0.000 -4.396 0.000) 4.396 4.411 ( 0.000 2.353 -0.000) 2.353 4.605 ( 0.000 -0.449 -0.000) 0.449 4.665 ( 0.000 -11.955 0.000) 11.955 5.037 ( 0.000 -3.378 0.000) 3.378 5.097 ( 0.000 -3.207 0.000) 3.207 5.508 ( -0.000 6.783 -0.000) 6.783 5.560 ( 0.000 -2.112 -0.000) 2.112 5.627 ( 0.000 3.791 0.000) 3.791 6.050 ( 0.000 -17.441 0.000) 17.441 8.126 ( 0.000 14.348 -0.000) 14.348 8.643 ( 0.000 1.541 0.000) 1.541 9.154 ( 0.000 4.384 0.000) 4.384 9.445 ( 0.000 -7.464 -0.000) 7.464 27.792 ( 0.000 55.117 0.000) 55.117 27.877 ( 0.000 54.692 -0.000) 54.692 28.228 ( 0.000 14.504 0.000) 14.504 28.717 ( 0.000 19.310 0.000) 19.310 29.070 ( 0.000 -12.984 -0.000) 12.984 29.668 ( 0.000 -13.531 0.000) 13.531 31.292 ( 0.000 -57.557 -0.000) 57.557 31.332 ( 0.000 -61.383 0.000) 61.383 95.450 ( 0.000 18.632 0.000) 18.632 95.567 ( 0.000 18.886 0.000) 18.886 96.411 ( 0.000 -14.094 0.000) 14.094 96.690 ( 0.000 -20.147 -0.000) 20.147 ======================= Grid point 66 (37/252) ======================= q-point: ( 0.00 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.887 ( 0.000 0.723 0.000) 0.723 2.890 ( 0.000 0.142 0.000) 0.142 3.034 ( 0.000 16.327 0.000) 16.327 3.299 ( 0.000 -10.135 0.000) 10.135 3.437 ( 0.000 13.779 0.000) 13.779 3.562 ( 0.000 -1.291 0.000) 1.291 3.665 ( 0.000 9.515 0.000) 9.515 3.907 ( 0.000 -12.164 0.000) 12.164 4.094 ( 0.000 11.617 0.000) 11.617 4.234 ( 0.000 11.520 0.000) 11.520 4.278 ( 0.000 -5.274 0.000) 5.274 4.448 ( 0.000 -7.468 0.000) 7.468 4.565 ( 0.000 -3.869 0.000) 3.869 4.578 ( 0.000 -2.441 0.000) 2.441 5.024 ( 0.000 0.540 0.000) 0.540 5.049 ( 0.000 -2.029 0.000) 2.029 5.585 ( 0.000 4.384 0.000) 4.384 5.594 ( 0.000 19.040 0.000) 19.040 5.760 ( 0.000 -10.477 0.000) 10.477 6.037 ( 0.000 -22.462 0.000) 22.462 8.173 ( 0.000 10.946 0.000) 10.946 8.370 ( 0.000 -8.926 0.000) 8.926 8.845 ( 0.000 4.500 0.000) 4.500 8.917 ( 0.000 -2.952 0.000) 2.952 28.500 ( 0.000 14.989 0.000) 14.989 28.785 ( 0.000 -14.315 0.000) 14.315 28.919 ( 0.000 46.836 0.000) 46.836 29.066 ( 0.000 34.609 0.000) 34.609 29.216 ( 0.000 55.252 0.000) 55.252 29.350 ( 0.000 -16.329 0.000) 16.329 30.148 ( 0.000 -60.228 0.000) 60.228 30.374 ( 0.000 -61.284 0.000) 61.284 95.815 ( 0.000 17.665 0.000) 17.665 96.140 ( 0.000 -15.807 0.000) 15.807 96.155 ( 0.000 9.234 0.000) 9.234 96.346 ( 0.000 -10.409 0.000) 10.409 ======================= Grid point 67 (38/252) ======================= q-point: ( 0.10 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.892 ( 1.285 3.953 0.325) 4.169 2.950 ( 2.876 -1.887 4.777) 5.887 3.042 ( 1.043 15.609 -1.244) 15.693 3.273 ( -12.589 15.054 -2.303) 19.759 3.294 ( -2.481 -5.325 -0.914) 5.945 3.490 ( -5.847 2.145 -3.336) 7.065 3.544 ( -7.031 -2.446 -0.079) 7.445 3.651 ( -17.407 -13.017 -6.545) 22.700 4.205 ( -0.862 11.501 0.565) 11.547 4.327 ( 14.060 12.692 4.629) 19.498 4.439 ( 1.042 -10.948 0.372) 11.004 4.474 ( 8.633 -1.039 2.120) 8.950 4.587 ( 0.660 -1.181 1.297) 1.874 4.594 ( 2.227 -3.680 2.540) 4.995 5.024 ( -0.209 0.619 0.074) 0.657 5.046 ( -0.259 -1.775 -0.400) 1.838 5.525 ( -5.217 16.508 -2.966) 17.565 5.587 ( -0.152 5.001 0.659) 5.047 5.762 ( -0.317 -11.952 1.806) 12.092 5.912 ( -10.748 -20.481 -4.459) 23.556 8.196 ( 2.604 11.222 -0.945) 11.558 8.393 ( 2.769 -8.677 -0.821) 9.145 8.868 ( 2.830 7.233 0.836) 7.811 8.996 ( 6.657 -6.142 1.712) 9.218 28.501 ( 0.098 14.968 0.060) 14.968 28.783 ( -0.075 -12.654 -0.304) 12.657 28.936 ( 1.431 47.509 0.774) 47.537 29.053 ( -1.117 31.869 -0.358) 31.890 29.187 ( -2.544 53.746 -1.171) 53.819 29.362 ( 0.551 -14.292 1.391) 14.370 30.146 ( -0.519 -60.270 0.859) 60.278 30.352 ( -2.114 -61.360 -0.842) 61.402 95.814 ( -0.324 17.642 0.416) 17.650 96.127 ( -2.215 8.000 -1.069) 8.370 96.140 ( -0.351 -13.153 0.288) 13.160 96.346 ( -0.126 -11.738 0.081) 11.739 ======================= Grid point 68 (39/252) ======================= q-point: ( 0.20 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.829 ( -11.295 14.872 -2.395) 18.828 3.016 ( -1.098 -2.622 3.169) 4.256 3.027 ( 2.733 10.668 -4.977) 12.085 3.130 ( -2.538 7.645 5.306) 9.646 3.231 ( -3.327 -6.002 -5.317) 8.681 3.279 ( -12.602 -1.976 -3.172) 13.145 3.403 ( -4.047 -5.438 3.170) 7.483 3.444 ( -4.757 -4.649 -0.620) 6.681 4.171 ( -2.299 11.110 -0.075) 11.346 4.412 ( -1.228 -11.870 -2.496) 12.191 4.543 ( -0.906 6.306 -0.099) 6.371 4.566 ( 2.669 4.113 4.681) 6.779 4.615 ( 0.146 -0.505 3.523) 3.562 4.660 ( 2.624 -0.390 -2.191) 3.440 5.010 ( -0.950 0.663 -0.135) 1.167 5.036 ( -0.543 -1.929 -0.305) 2.027 5.435 ( -1.431 8.607 -1.371) 8.832 5.589 ( -0.284 5.183 0.539) 5.218 5.676 ( -8.569 -13.938 -3.787) 16.794 5.770 ( -0.711 -12.487 2.570) 12.769 8.246 ( 3.971 11.908 -2.128) 12.732 8.450 ( 4.305 -8.705 -1.720) 9.863 8.958 ( 5.693 9.873 1.758) 11.532 9.142 ( 7.126 -9.250 1.991) 11.846 28.504 ( 0.188 14.933 0.114) 14.935 28.781 ( 0.201 -10.637 -0.381) 10.646 28.967 ( 0.504 54.748 0.667) 54.755 29.034 ( -0.111 23.120 -0.016) 23.120 29.118 ( -3.800 52.579 -1.350) 52.734 29.381 ( 0.161 -13.439 1.589) 13.533 30.143 ( -0.662 -60.308 1.427) 60.328 30.291 ( -3.458 -61.535 -1.373) 61.648 95.810 ( -0.529 17.568 0.681) 17.589 96.065 ( -3.381 13.162 -1.092) 13.634 96.136 ( -0.280 -15.352 0.018) 15.354 96.340 ( -0.590 -14.485 -0.029) 14.497 ======================= Grid point 69 (40/252) ======================= q-point: ( 0.30 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( -9.490 13.836 -2.911) 17.029 2.856 ( -12.310 -12.480 -4.142) 18.012 3.002 ( -4.598 6.146 -2.351) 8.028 3.071 ( -3.359 -0.034 -0.285) 3.371 3.162 ( -1.060 8.069 0.222) 8.142 3.273 ( 4.606 -0.123 1.848) 4.965 3.369 ( -0.009 0.452 2.335) 2.378 3.456 ( 2.855 -4.419 4.959) 7.230 4.130 ( -2.196 9.745 0.314) 9.994 4.356 ( -3.917 -7.363 -4.023) 9.260 4.394 ( -9.570 4.003 -2.918) 10.776 4.551 ( -7.795 -3.941 -1.074) 8.801 4.616 ( -2.577 -1.521 1.800) 3.492 4.620 ( -2.742 0.177 -0.371) 2.773 5.005 ( 0.327 -0.042 -0.104) 0.346 5.028 ( 0.099 -2.238 -0.224) 2.251 5.462 ( 4.279 7.445 0.918) 8.636 5.577 ( -0.241 2.128 -0.292) 2.161 5.624 ( 1.546 -3.446 0.715) 3.844 5.770 ( -1.004 -12.425 2.116) 12.644 8.308 ( 4.494 12.617 -2.264) 13.583 8.518 ( 4.353 -8.484 -1.869) 9.717 9.080 ( 5.850 9.332 1.904) 11.177 9.260 ( 4.319 -9.320 1.228) 10.346 28.509 ( 0.227 14.938 0.130) 14.940 28.785 ( 0.564 -9.904 -0.367) 9.927 28.949 ( -1.949 49.749 -0.087) 49.787 29.034 ( -3.278 57.877 -1.044) 57.979 29.068 ( 1.841 22.788 0.785) 22.875 29.388 ( -0.486 -14.160 1.200) 14.219 30.142 ( -0.552 -60.342 1.352) 60.360 30.217 ( -3.391 -61.580 -1.279) 61.687 95.805 ( -0.522 17.462 0.696) 17.483 95.999 ( -2.999 16.235 -0.854) 16.531 96.130 ( -0.330 -15.600 -0.099) 15.604 96.326 ( -0.813 -17.088 -0.124) 17.108 ======================= Grid point 70 (41/252) ======================= q-point: ( 0.40 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.468 ( -3.476 8.187 -1.065) 8.958 2.648 ( -7.177 -10.162 -2.623) 12.714 2.908 ( -2.717 3.406 -2.376) 4.963 2.965 ( -6.271 -2.416 0.525) 6.741 3.197 ( 2.616 8.682 0.699) 9.095 3.304 ( -0.702 -1.758 -0.075) 1.894 3.466 ( 5.939 6.617 2.796) 9.320 3.551 ( 2.974 -1.464 3.349) 4.712 4.085 ( -3.833 7.390 -0.729) 8.356 4.179 ( -5.766 7.826 -1.850) 9.896 4.272 ( -6.804 -9.590 -2.951) 12.123 4.379 ( -4.535 -10.043 -2.478) 11.295 4.568 ( -3.253 0.106 0.880) 3.372 4.588 ( -1.955 -0.906 1.347) 2.541 5.010 ( 0.147 0.080 -0.077) 0.184 5.034 ( 0.522 -2.275 -0.031) 2.334 5.554 ( 3.441 4.800 -0.475) 5.925 5.577 ( 0.576 4.131 1.142) 4.324 5.665 ( 1.712 -0.905 0.570) 2.019 5.770 ( -0.288 -11.409 1.347) 11.491 8.369 ( 3.286 12.886 -1.301) 13.362 8.573 ( 2.679 -7.469 -1.163) 8.020 9.184 ( 4.116 6.203 1.356) 7.567 9.312 ( 1.041 -7.152 0.262) 7.232 28.513 ( 0.160 14.988 0.085) 14.989 28.795 ( 0.716 -11.411 -0.274) 11.437 28.913 ( -1.725 49.056 -0.062) 49.086 28.973 ( -2.256 54.857 -0.591) 54.906 29.111 ( 1.752 29.280 0.615) 29.339 29.383 ( -0.659 -15.640 0.614) 15.666 30.133 ( -1.239 -61.734 -0.049) 61.746 30.168 ( -1.115 -60.131 0.094) 60.141 95.801 ( -0.313 17.376 0.440) 17.385 95.951 ( -1.708 18.281 -0.442) 18.366 96.124 ( -0.243 -15.743 -0.111) 15.745 96.312 ( -0.563 -18.858 -0.102) 18.867 ======================= Grid point 71 (42/252) ======================= q-point: (-0.50 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 234 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.438 ( 0.000 5.010 0.000) 5.010 2.572 ( 0.000 -8.570 0.000) 8.570 2.888 ( 0.000 0.415 -0.000) 0.415 2.892 ( -0.000 -0.069 0.000) 0.069 3.232 ( 0.000 6.215 0.000) 6.215 3.288 ( 0.000 1.618 0.000) 1.618 3.545 ( 0.000 5.112 -0.000) 5.112 3.586 ( 0.000 1.281 0.000) 1.281 4.021 ( 0.000 6.818 0.000) 6.818 4.140 ( 0.000 4.723 0.000) 4.723 4.184 ( 0.000 -6.090 0.000) 6.090 4.338 ( 0.000 -10.549 -0.000) 10.549 4.537 ( 0.000 0.175 -0.000) 0.175 4.573 ( 0.000 -2.406 0.000) 2.406 5.010 ( 0.000 0.378 0.000) 0.378 5.040 ( 0.000 -2.406 0.000) 2.406 5.565 ( 0.000 3.215 0.000) 3.215 5.604 ( 0.000 2.190 -0.000) 2.190 5.686 ( 0.000 1.719 0.000) 1.719 5.773 ( 0.000 -10.122 0.000) 10.122 8.396 ( 0.000 12.852 -0.000) 12.852 8.594 ( 0.000 -6.772 -0.000) 6.772 9.232 ( 0.000 3.855 0.000) 3.855 9.317 ( -0.000 -5.336 -0.000) 5.336 28.515 ( 0.000 15.021 0.000) 15.021 28.802 ( 0.000 -14.481 0.000) 14.481 28.895 ( 0.000 52.633 0.000) 52.633 28.950 ( 0.000 53.318 -0.000) 53.318 29.131 ( 0.000 31.181 0.000) 31.181 29.378 ( 0.000 -16.626 0.000) 16.626 30.116 ( 0.000 -62.462 0.000) 62.462 30.162 ( 0.000 -59.362 0.000) 59.362 95.800 ( 0.000 17.346 0.000) 17.346 95.933 ( 0.000 19.003 0.000) 19.003 96.121 ( 0.000 -15.796 0.000) 15.796 96.306 ( 0.000 -19.487 -0.000) 19.487 ======================= Grid point 143 (43/252) ======================= q-point: ( 0.00 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.449 ( 24.011 0.000 23.698) 33.736 0.594 ( -0.259 0.000 30.432) 30.433 0.968 ( -12.613 0.000 49.347) 50.934 2.579 ( -8.735 0.000 20.005) 21.829 2.639 ( -12.692 0.000 -19.631) 23.377 2.885 ( -0.716 0.000 -11.937) 11.958 3.322 ( 0.358 0.000 4.283) 4.298 3.412 ( 9.810 0.000 13.225) 16.466 3.622 ( 4.453 0.000 2.113) 4.928 3.813 ( -0.029 0.000 -0.413) 0.414 4.500 ( -0.699 0.000 2.827) 2.912 4.521 ( 0.257 0.000 -7.620) 7.624 4.646 ( -0.592 0.000 1.671) 1.773 4.919 ( -6.831 0.000 -5.964) 9.068 4.926 ( 0.543 0.000 -5.791) 5.817 5.294 ( 5.472 0.000 2.280) 5.928 5.465 ( 0.071 0.000 -0.410) 0.416 6.241 ( -0.319 0.000 -17.993) 17.996 7.365 ( 1.262 0.000 -0.688) 1.438 7.365 ( 8.272 0.000 -3.246) 8.886 7.753 ( -5.296 0.000 15.779) 16.644 8.316 ( -9.098 0.000 -0.211) 9.100 8.398 ( -3.151 0.000 2.256) 3.875 9.136 ( 4.883 0.000 -3.741) 6.151 24.684 ( -0.147 0.000 0.059) 0.158 24.706 ( 0.273 0.000 -0.181) 0.327 27.422 ( -0.279 0.000 0.129) 0.308 27.476 ( 0.212 0.000 -0.475) 0.520 30.033 ( -15.756 0.000 1.601) 15.837 30.339 ( 1.056 0.000 -1.832) 2.114 34.576 ( -0.338 0.000 2.819) 2.839 35.069 ( 4.282 0.000 -2.707) 5.066 94.102 ( 0.138 0.000 0.078) 0.158 94.108 ( -0.035 0.000 0.014) 0.038 97.141 ( -2.817 0.000 1.324) 3.113 97.410 ( 34.917 0.000 -1.677) 34.957 ======================= Grid point 144 (44/252) ======================= q-point: ( 0.10 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.950 ( 0.735 0.000 34.570) 34.577 0.965 ( 16.015 0.000 24.414) 29.198 1.374 ( 28.627 0.000 29.472) 41.087 2.302 ( -6.912 0.000 -21.557) 22.638 2.554 ( -9.487 0.000 20.189) 22.307 2.803 ( 1.838 0.000 -13.132) 13.260 3.344 ( -1.209 0.000 4.707) 4.860 3.563 ( 0.312 0.000 0.682) 0.750 3.745 ( 0.890 0.000 5.022) 5.101 3.829 ( 2.617 0.000 10.981) 11.288 4.496 ( 4.060 0.000 -11.123) 11.841 4.507 ( -1.088 0.000 2.809) 3.012 4.566 ( -6.160 0.000 -4.858) 7.845 4.834 ( 1.893 0.000 -2.895) 3.459 4.936 ( 4.932 0.000 -6.791) 8.393 5.389 ( 1.388 0.000 2.079) 2.500 5.440 ( -2.009 0.000 -0.164) 2.016 6.103 ( -0.143 0.000 -17.978) 17.978 7.303 ( -8.788 0.000 0.218) 8.791 7.382 ( -0.983 0.000 -4.049) 4.166 7.865 ( 1.497 0.000 18.278) 18.340 8.221 ( 0.771 0.000 4.249) 4.318 8.340 ( -3.914 0.000 -0.052) 3.914 9.170 ( 1.773 0.000 -7.166) 7.382 24.684 ( 0.151 0.000 -0.027) 0.154 24.716 ( 0.833 0.000 -0.051) 0.834 27.417 ( -0.320 0.000 0.017) 0.321 27.479 ( 0.425 0.000 -0.421) 0.598 29.802 ( -10.077 0.000 8.766) 13.356 30.344 ( 0.722 0.000 -1.408) 1.583 34.588 ( -0.692 0.000 3.258) 3.331 35.098 ( 1.073 0.000 -4.873) 4.990 94.106 ( 0.152 0.000 0.173) 0.230 94.108 ( 0.022 0.000 -0.046) 0.051 97.103 ( -1.561 0.000 -0.439) 1.622 97.948 ( 23.694 0.000 -18.219) 29.888 ======================= Grid point 145 (45/252) ======================= q-point: ( 0.20 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.152 ( -3.336 0.000 34.560) 34.720 1.444 ( 19.233 0.000 18.729) 26.846 2.129 ( 32.090 0.000 15.869) 35.800 2.130 ( 4.788 0.000 -20.081) 20.644 2.536 ( -7.340 0.000 23.407) 24.531 2.770 ( 4.731 0.000 -13.316) 14.131 3.346 ( -2.044 0.000 4.195) 4.667 3.490 ( -6.520 0.000 -3.088) 7.214 3.735 ( -2.516 0.000 3.502) 4.312 3.948 ( -3.470 0.000 13.730) 14.162 4.402 ( -4.329 0.000 -9.921) 10.824 4.494 ( 4.616 0.000 -13.271) 14.051 4.524 ( -0.270 0.000 1.866) 1.885 4.851 ( -1.741 0.000 4.344) 4.680 4.984 ( 5.446 0.000 -8.265) 9.898 5.401 ( -0.906 0.000 2.391) 2.557 5.418 ( -0.249 0.000 1.471) 1.492 6.021 ( 4.681 0.000 -14.807) 15.530 7.082 ( -13.740 0.000 -1.967) 13.880 7.346 ( 0.671 0.000 -3.567) 3.630 7.967 ( -5.865 0.000 17.172) 18.146 8.282 ( -0.682 0.000 -1.262) 1.434 8.347 ( 8.542 0.000 2.905) 9.022 9.119 ( -1.518 0.000 -6.606) 6.778 24.689 ( 0.410 0.000 -0.045) 0.412 24.734 ( 1.158 0.000 -0.026) 1.159 27.412 ( -0.257 0.000 0.043) 0.261 27.485 ( 0.553 0.000 -0.366) 0.663 29.743 ( -3.494 0.000 6.301) 7.205 30.343 ( 0.206 0.000 -1.197) 1.215 34.595 ( -1.045 0.000 3.303) 3.464 35.058 ( -1.321 0.000 -4.428) 4.621 94.108 ( 0.065 0.000 -0.097) 0.116 94.110 ( 0.104 0.000 0.165) 0.196 97.085 ( 0.131 0.000 -0.837) 0.847 98.114 ( 9.132 0.000 -12.188) 15.230 ======================= Grid point 146 (46/252) ======================= q-point: ( 0.30 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.320 ( -3.098 0.000 29.371) 29.534 1.903 ( 17.925 0.000 14.685) 23.173 2.200 ( 16.233 0.000 -15.436) 22.400 2.412 ( -6.844 0.000 16.281) 17.661 2.776 ( 7.458 0.000 -11.175) 13.436 2.931 ( 25.756 0.000 17.164) 30.951 3.307 ( -10.227 0.000 -4.312) 11.099 3.331 ( -2.418 0.000 3.277) 4.073 3.709 ( -3.000 0.000 2.331) 3.799 3.866 ( -14.324 0.000 10.702) 17.880 4.265 ( -2.236 0.000 -12.259) 12.462 4.479 ( 4.588 0.000 -13.274) 14.045 4.530 ( -0.538 0.000 1.727) 1.809 4.813 ( -7.751 0.000 9.214) 12.040 5.009 ( 3.710 0.000 -7.504) 8.371 5.414 ( 0.032 0.000 4.219) 4.219 5.450 ( 1.337 0.000 2.944) 3.233 6.073 ( 11.138 0.000 -12.980) 17.104 6.811 ( -12.562 0.000 -4.918) 13.490 7.361 ( 3.320 0.000 -3.439) 4.780 7.882 ( -13.123 0.000 12.156) 17.888 8.308 ( 1.825 0.000 2.812) 3.352 8.536 ( 9.780 0.000 2.175) 10.019 9.030 ( -3.459 0.000 -5.923) 6.859 24.698 ( 0.497 0.000 -0.014) 0.497 24.755 ( 1.100 0.000 -0.134) 1.108 27.409 ( -0.137 0.000 0.185) 0.230 27.493 ( 0.534 0.000 -0.337) 0.631 29.740 ( -1.548 0.000 4.905) 5.144 30.335 ( -0.129 0.000 -1.275) 1.282 34.596 ( -1.313 0.000 2.932) 3.213 35.001 ( -1.501 0.000 -3.884) 4.164 94.108 ( 0.076 0.000 -0.143) 0.162 94.112 ( 0.033 0.000 0.061) 0.069 97.097 ( 1.329 0.000 0.364) 1.378 98.159 ( 4.542 0.000 -8.424) 9.571 ======================= Grid point 147 (47/252) ======================= q-point: ( 0.40 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( -5.280 0.000 24.735) 25.292 2.261 ( 10.146 0.000 9.563) 13.942 2.383 ( -9.096 0.000 19.667) 21.669 2.478 ( 23.250 0.000 -9.124) 24.976 2.835 ( 7.545 0.000 -9.415) 12.066 3.086 ( -9.710 0.000 -3.494) 10.320 3.298 ( -2.080 0.000 1.823) 2.766 3.451 ( 16.714 0.000 9.314) 19.134 3.594 ( -16.141 0.000 6.004) 17.222 3.680 ( -6.000 0.000 0.929) 6.072 4.145 ( -0.566 0.000 -13.477) 13.489 4.494 ( 5.742 0.000 -8.633) 10.368 4.521 ( -2.177 0.000 1.958) 2.928 4.727 ( -8.248 0.000 11.407) 14.076 5.028 ( 3.559 0.000 -5.235) 6.330 5.452 ( -1.143 0.000 7.983) 8.064 5.483 ( -0.180 0.000 2.359) 2.366 6.206 ( 12.732 0.000 -13.346) 18.444 6.602 ( -5.173 0.000 -5.368) 7.455 7.372 ( -0.332 0.000 -7.020) 7.028 7.741 ( -9.614 0.000 13.473) 16.551 8.357 ( 0.377 0.000 4.693) 4.708 8.720 ( 9.011 0.000 1.119) 9.080 8.911 ( -5.150 0.000 -5.460) 7.506 24.706 ( 0.346 0.000 0.037) 0.348 24.769 ( 0.647 0.000 -0.348) 0.734 27.410 ( -0.044 0.000 0.389) 0.391 27.499 ( 0.362 0.000 -0.354) 0.506 29.749 ( -1.236 0.000 4.407) 4.577 30.323 ( 0.012 0.000 -1.499) 1.499 34.589 ( -1.452 0.000 2.257) 2.684 34.958 ( -0.271 0.000 -3.243) 3.254 94.109 ( 0.066 0.000 -0.190) 0.201 94.112 ( -0.025 0.000 -0.086) 0.090 97.133 ( 1.333 0.000 2.485) 2.820 98.173 ( 3.030 0.000 -6.738) 7.388 ======================= Grid point 148 (48/252) ======================= q-point: (-0.50 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.460 ( -10.761 0.000 22.249) 24.714 2.316 ( -9.493 0.000 1.606) 9.628 2.375 ( -7.109 0.000 20.311) 21.519 2.853 ( 19.146 0.000 -5.134) 19.822 2.914 ( 6.806 0.000 -5.799) 8.941 2.991 ( 2.129 0.000 3.430) 4.037 3.261 ( -2.493 0.000 0.042) 2.493 3.354 ( -12.227 0.000 7.633) 14.414 3.538 ( -12.315 0.000 -1.773) 12.442 3.589 ( -2.552 0.000 -6.197) 6.702 4.140 ( 10.884 0.000 -10.817) 15.346 4.489 ( -2.716 0.000 3.559) 4.477 4.559 ( 5.585 0.000 -3.428) 6.553 4.709 ( -3.175 0.000 12.736) 13.125 5.073 ( 4.658 0.000 -2.707) 5.387 5.462 ( -4.187 0.000 7.869) 8.914 5.470 ( -2.173 0.000 0.295) 2.193 6.319 ( 8.823 0.000 -11.773) 14.712 6.583 ( 5.784 0.000 -1.092) 5.887 7.221 ( -7.238 0.000 -11.508) 13.595 7.763 ( -0.626 0.000 14.772) 14.785 8.385 ( -1.065 0.000 5.151) 5.260 8.754 ( -6.558 0.000 -5.850) 8.789 8.887 ( 7.546 0.000 0.396) 7.556 24.710 ( 0.027 0.000 0.105) 0.109 24.772 ( -0.022 0.000 -0.577) 0.578 27.413 ( -0.009 0.000 0.588) 0.588 27.501 ( 0.107 0.000 -0.407) 0.421 29.754 ( -1.589 0.000 4.430) 4.706 30.316 ( 0.506 0.000 -1.734) 1.806 34.576 ( -1.393 0.000 1.519) 2.061 34.950 ( 1.641 0.000 -2.617) 3.089 94.108 ( 0.048 0.000 -0.222) 0.227 94.110 ( -0.062 0.000 -0.217) 0.225 97.173 ( 0.294 0.000 4.548) 4.558 98.178 ( 2.594 0.000 -6.483) 6.983 ======================= Grid point 149 (49/252) ======================= q-point: (-0.40 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.363 ( -16.921 0.000 22.838) 28.424 2.015 ( -21.288 0.000 -1.365) 21.332 2.398 ( -5.631 0.000 16.590) 17.520 2.882 ( -9.154 0.000 8.585) 12.550 2.982 ( 0.400 0.000 -2.518) 2.550 3.099 ( -22.736 0.000 -4.865) 23.251 3.232 ( -3.833 0.000 -0.745) 3.905 3.264 ( 16.334 0.000 1.602) 16.412 3.337 ( 5.646 0.000 -0.019) 5.646 3.511 ( 0.116 0.000 -8.562) 8.562 4.292 ( 11.746 0.000 -9.007) 14.802 4.481 ( -0.801 0.000 2.770) 2.883 4.629 ( 3.495 0.000 -1.142) 3.676 4.770 ( -0.987 0.000 13.695) 13.731 5.156 ( 5.212 0.000 -0.277) 5.219 5.421 ( -2.349 0.000 -1.447) 2.759 5.422 ( -4.297 0.000 4.301) 6.080 6.342 ( 0.444 0.000 -5.750) 5.767 6.765 ( 11.631 0.000 4.353) 12.419 7.027 ( -1.493 0.000 -17.304) 17.368 7.867 ( 0.092 0.000 13.783) 13.784 8.394 ( -1.831 0.000 5.277) 5.586 8.574 ( -8.294 0.000 -5.929) 10.195 9.019 ( 6.943 0.000 -0.712) 6.980 24.708 ( -0.298 0.000 0.192) 0.354 24.761 ( -0.612 0.000 -0.715) 0.941 27.417 ( -0.016 0.000 0.725) 0.725 27.497 ( -0.115 0.000 -0.464) 0.478 29.753 ( -2.086 0.000 4.993) 5.411 30.317 ( 0.966 0.000 -1.975) 2.198 34.562 ( -1.093 0.000 1.025) 1.498 34.979 ( 3.374 0.000 -2.269) 4.066 94.107 ( -0.076 0.000 -0.292) 0.302 94.107 ( 0.040 0.000 -0.221) 0.224 97.203 ( -1.102 0.000 5.884) 5.986 98.174 ( 2.434 0.000 -7.881) 8.248 ======================= Grid point 150 (50/252) ======================= q-point: (-0.30 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.186 ( -20.984 0.000 26.056) 33.455 1.575 ( -25.903 0.000 -0.101) 25.904 2.233 ( -25.332 0.000 -9.619) 27.097 2.619 ( -17.115 0.000 19.499) 25.945 2.797 ( -7.088 0.000 13.354) 15.119 3.049 ( 0.068 0.000 1.039) 1.042 3.199 ( 1.148 0.000 -3.124) 3.328 3.420 ( 3.894 0.000 -4.635) 6.054 3.474 ( 4.109 0.000 -8.720) 9.640 3.530 ( 9.853 0.000 0.013) 9.853 4.428 ( 8.330 0.000 -4.350) 9.398 4.492 ( 0.898 0.000 0.356) 0.966 4.660 ( 0.715 0.000 -1.244) 1.434 4.841 ( -0.629 0.000 8.978) 9.000 5.227 ( 1.692 0.000 -0.183) 1.702 5.374 ( -1.375 0.000 -2.055) 2.473 5.383 ( -2.544 0.000 3.200) 4.088 6.298 ( -1.217 0.000 0.598) 1.356 6.943 ( 6.711 0.000 -20.802) 21.857 7.021 ( 11.334 0.000 6.826) 13.231 7.934 ( -3.244 0.000 12.175) 12.599 8.380 ( -8.453 0.000 -5.307) 9.981 8.399 ( -1.559 0.000 5.382) 5.603 9.127 ( 5.963 0.000 -2.090) 6.319 24.703 ( -0.490 0.000 0.264) 0.556 24.742 ( -0.882 0.000 -0.705) 1.129 27.422 ( -0.049 0.000 0.745) 0.747 27.491 ( -0.216 0.000 -0.503) 0.547 29.753 ( -2.207 0.000 6.679) 7.035 30.322 ( 1.164 0.000 -2.216) 2.503 34.553 ( -0.640 0.000 0.989) 1.178 35.033 ( 4.171 0.000 -2.526) 4.876 94.103 ( -0.060 0.000 -0.291) 0.297 94.107 ( 0.045 0.000 -0.184) 0.190 97.215 ( -2.286 0.000 6.178) 6.588 98.146 ( 1.810 0.000 -12.279) 12.411 ======================= Grid point 151 (51/252) ======================= q-point: (-0.20 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.982 ( -22.658 0.000 28.129) 36.119 1.095 ( -28.167 0.000 4.726) 28.560 1.523 ( -39.481 0.000 -7.348) 40.159 2.586 ( -8.152 0.000 22.522) 23.952 2.834 ( 0.400 0.000 14.078) 14.083 3.020 ( -2.067 0.000 -2.415) 3.179 3.227 ( 2.605 0.000 -0.167) 2.610 3.379 ( -4.626 0.000 -11.182) 12.101 3.470 ( 4.771 0.000 -6.501) 8.064 3.691 ( 6.693 0.000 1.290) 6.816 4.486 ( -0.280 0.000 2.365) 2.381 4.568 ( 6.687 0.000 -0.752) 6.729 4.639 ( -1.454 0.000 -2.300) 2.721 4.858 ( -0.171 0.000 -1.567) 1.576 5.165 ( -6.653 0.000 -3.886) 7.705 5.377 ( 3.073 0.000 -0.652) 3.141 5.379 ( -1.699 0.000 5.539) 5.794 6.330 ( 3.393 0.000 -1.057) 3.554 6.979 ( 11.832 0.000 -15.596) 19.576 7.246 ( 7.799 0.000 5.971) 9.822 7.913 ( -7.788 0.000 10.835) 13.343 8.216 ( -5.818 0.000 -1.661) 6.051 8.413 ( -1.118 0.000 5.097) 5.218 9.200 ( 4.269 0.000 -4.530) 6.225 24.695 ( -0.509 0.000 0.267) 0.575 24.722 ( -0.757 0.000 -0.568) 0.947 27.425 ( -0.119 0.000 0.615) 0.626 27.484 ( -0.171 0.000 -0.517) 0.545 29.784 ( -0.561 0.000 11.311) 11.325 30.327 ( 1.178 0.000 -2.340) 2.620 34.553 ( -0.256 0.000 1.420) 1.443 35.084 ( 3.441 0.000 -3.870) 5.179 94.101 ( -0.008 0.000 -0.210) 0.210 94.106 ( 0.054 0.000 -0.120) 0.131 97.207 ( -3.033 0.000 5.345) 6.146 98.034 ( -2.167 0.000 -23.681) 23.780 ======================= Grid point 152 (52/252) ======================= q-point: (-0.10 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.588 ( -34.416 0.000 -3.236) 34.568 0.669 ( -24.618 0.000 17.346) 30.116 0.982 ( -25.501 0.000 40.753) 48.074 2.591 ( -8.266 0.000 20.801) 22.383 2.924 ( -2.815 0.000 -3.090) 4.180 2.960 ( -0.622 0.000 -6.905) 6.933 3.212 ( -1.627 0.000 2.410) 2.908 3.276 ( 1.630 0.000 2.761) 3.206 3.536 ( 5.811 0.000 -3.555) 6.812 3.787 ( 3.262 0.000 0.175) 3.266 4.494 ( -0.636 0.000 2.607) 2.683 4.583 ( -1.998 0.000 -4.205) 4.655 4.651 ( -0.087 0.000 2.452) 2.453 4.871 ( 6.819 0.000 -3.150) 7.511 5.009 ( -5.205 0.000 -5.575) 7.627 5.358 ( -5.699 0.000 2.125) 6.083 5.438 ( 3.020 0.000 -0.247) 3.030 6.339 ( 1.782 0.000 -11.794) 11.928 7.158 ( 14.766 0.000 -4.892) 15.555 7.355 ( 1.522 0.000 -0.400) 1.574 7.820 ( -10.190 0.000 11.259) 15.186 8.222 ( 6.108 0.000 8.855) 10.757 8.421 ( -1.799 0.000 3.985) 4.372 9.193 ( -1.052 0.000 -8.641) 8.705 24.689 ( -0.383 0.000 0.182) 0.424 24.709 ( -0.318 0.000 -0.370) 0.488 27.425 ( -0.231 0.000 0.352) 0.421 27.478 ( -0.009 0.000 -0.508) 0.508 29.949 ( 9.075 0.000 17.062) 19.325 30.332 ( 1.155 0.000 -2.210) 2.493 34.562 ( -0.146 0.000 2.124) 2.129 35.083 ( -0.226 0.000 -5.903) 5.908 94.100 ( 0.070 0.000 -0.071) 0.099 94.107 ( 0.073 0.000 0.000) 0.073 97.181 ( -3.265 0.000 3.551) 4.824 97.613 ( -23.283 0.000 -36.704) 43.466 ======================= Grid point 153 (53/252) ======================= q-point: ( 0.00 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.640 ( -5.099 20.262 11.942) 24.066 0.806 ( 11.215 21.431 19.601) 31.133 1.379 ( -4.655 32.772 35.880) 48.817 2.590 ( -10.514 0.469 -5.447) 11.850 2.674 ( -8.647 4.515 4.715) 10.834 2.892 ( -1.469 1.664 -10.661) 10.890 3.294 ( 2.485 -1.729 5.410) 6.200 3.452 ( 7.593 2.757 12.923) 15.240 3.669 ( 3.429 4.934 0.444) 6.025 3.849 ( 0.728 3.595 -0.789) 3.752 4.417 ( 0.689 -3.876 -1.767) 4.316 4.627 ( -1.484 -1.492 1.878) 2.821 4.729 ( -2.212 11.087 -7.237) 13.423 4.877 ( -8.409 -2.956 -6.536) 11.053 5.157 ( 0.742 12.175 -7.196) 14.162 5.281 ( 5.602 -1.309 2.059) 6.110 5.438 ( -0.089 -2.662 -0.265) 2.677 6.170 ( 0.394 -6.837 -15.204) 16.675 6.992 ( -3.073 -19.467 9.237) 21.766 7.334 ( 5.344 -5.395 -3.142) 8.219 7.727 ( -1.054 -1.079 15.429) 15.502 8.369 ( -6.409 4.217 -1.335) 7.787 8.396 ( -8.268 0.957 1.465) 8.451 9.188 ( 12.354 0.543 -5.538) 13.550 24.850 ( 0.283 14.953 -0.235) 14.958 25.076 ( 0.069 26.527 -13.128) 29.598 27.454 ( -0.292 3.437 0.295) 3.462 27.543 ( 0.227 6.524 -0.695) 6.565 29.830 ( -8.158 -11.709 11.319) 18.215 30.307 ( 1.039 -3.266 -1.826) 3.884 34.425 ( -0.294 -15.444 2.726) 15.686 34.896 ( 2.255 -17.391 -2.236) 17.679 94.187 ( 0.148 8.317 0.168) 8.320 94.868 ( -5.051 40.146 -37.994) 55.505 97.111 ( -2.542 -3.172 1.237) 4.249 97.323 ( 21.860 -7.063 1.349) 23.013 ======================= Grid point 154 (54/252) ======================= q-point: ( 0.10 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.877 ( 14.096 1.693 21.222) 25.533 1.119 ( 3.828 15.555 27.011) 31.404 1.768 ( 21.671 30.667 24.489) 44.831 2.302 ( -6.305 0.563 -19.858) 20.843 2.620 ( -9.020 6.424 17.811) 20.973 2.816 ( 2.136 1.422 -13.151) 13.399 3.324 ( -1.357 -1.388 4.151) 4.583 3.623 ( 0.299 4.865 1.055) 4.986 3.770 ( 3.512 1.253 10.404) 11.052 3.855 ( 0.313 3.591 4.196) 5.532 4.418 ( 1.704 -2.426 -4.509) 5.396 4.540 ( -7.750 -1.638 -5.305) 9.534 4.645 ( -0.938 0.860 1.554) 2.008 4.747 ( 1.914 3.394 -7.302) 8.276 5.145 ( 2.370 12.009 -5.734) 13.517 5.370 ( 0.806 -1.885 1.769) 2.708 5.415 ( -1.849 -2.570 0.363) 3.187 6.057 ( 0.207 -4.658 -16.922) 17.552 6.929 ( -8.514 -22.259 3.437) 24.078 7.478 ( 9.048 -3.228 -3.731) 10.306 7.742 ( -9.099 -5.813 15.794) 19.132 8.220 ( -2.126 -0.372 4.399) 4.900 8.323 ( -2.608 1.717 -0.032) 3.122 9.361 ( 7.674 10.640 -8.364) 15.559 24.858 ( 0.662 15.099 0.067) 15.114 24.960 ( -3.316 23.731 -5.362) 24.554 27.450 ( -0.264 3.539 0.216) 3.555 27.543 ( 0.398 6.411 -0.681) 6.459 29.748 ( -6.603 -4.754 8.387) 11.685 30.312 ( 0.751 -3.253 -1.447) 3.639 34.437 ( -0.670 -15.448 3.172) 15.784 34.912 ( 0.919 -18.517 -3.633) 18.893 94.191 ( 0.037 8.622 0.423) 8.632 94.482 ( -10.807 29.514 -11.940) 33.622 97.076 ( -1.395 -2.820 -0.461) 3.180 97.773 ( 21.975 -15.204 -9.741) 28.442 ======================= Grid point 155 (55/252) ======================= q-point: ( 0.20 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.242 ( 3.978 6.976 25.542) 26.775 1.437 ( 15.701 3.912 21.058) 26.557 2.139 ( 4.830 1.859 -17.954) 18.685 2.361 ( 21.586 18.917 11.042) 30.753 2.613 ( -3.013 8.453 22.627) 24.342 2.790 ( 5.475 2.333 -12.881) 14.189 3.322 ( -1.915 -1.786 4.242) 4.985 3.534 ( -7.234 3.745 -3.907) 9.034 3.797 ( -2.527 5.736 3.413) 7.137 3.939 ( -3.401 -0.826 13.098) 13.557 4.378 ( -3.018 -2.601 -10.171) 10.923 4.418 ( 0.996 -1.834 -5.555) 5.934 4.671 ( 0.824 3.091 3.546) 4.775 4.759 ( 3.101 0.808 -4.725) 5.709 5.138 ( 0.215 10.563 -5.032) 11.703 5.369 ( -0.341 -3.205 1.108) 3.408 5.398 ( -1.370 -2.159 2.987) 3.932 5.980 ( 4.321 -4.124 -14.008) 15.228 6.758 ( -11.181 -23.748 -0.188) 26.249 7.470 ( -2.587 5.762 -5.746) 8.539 7.780 ( -2.090 -16.774 15.543) 22.963 8.185 ( -2.887 -3.305 -0.166) 4.391 8.410 ( 8.550 4.682 4.363) 10.681 9.359 ( -0.450 16.274 -8.027) 18.151 24.873 ( 0.759 15.857 0.202) 15.877 24.896 ( -1.192 18.583 -1.826) 18.710 27.448 ( -0.195 3.715 0.239) 3.728 27.547 ( 0.538 6.265 -0.618) 6.319 29.715 ( -2.905 -2.830 6.017) 7.256 30.312 ( 0.282 -3.192 -1.274) 3.449 34.444 ( -1.041 -15.483 3.223) 15.849 34.879 ( -1.201 -18.188 -3.950) 18.651 94.194 ( -0.099 8.778 0.545) 8.796 94.305 ( -4.327 17.959 -3.377) 18.779 97.059 ( 0.161 -2.645 -0.853) 2.784 97.978 ( 9.848 -12.946 -9.151) 18.663 ======================= Grid point 156 (56/252) ======================= q-point: ( 0.30 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.435 ( -0.856 11.233 24.739) 27.183 1.897 ( 19.082 0.078 14.951) 24.242 2.210 ( 15.267 1.267 -14.236) 20.913 2.472 ( -7.807 5.923 15.074) 17.979 2.788 ( 7.354 1.232 -11.381) 13.606 3.072 ( 21.899 13.667 14.115) 29.421 3.311 ( -3.980 -0.493 2.001) 4.482 3.347 ( -7.251 2.442 -2.591) 8.078 3.765 ( -3.116 5.265 1.751) 6.364 3.855 ( -14.245 -1.158 10.160) 17.535 4.254 ( -1.985 -0.842 -11.536) 11.735 4.403 ( 1.889 -2.231 -6.801) 7.402 4.708 ( 1.122 8.531 1.791) 8.789 4.772 ( -1.552 -0.328 2.831) 3.245 5.082 ( -1.523 6.651 -5.262) 8.617 5.387 ( 0.328 -2.894 3.284) 4.390 5.415 ( 0.540 -3.342 3.691) 5.009 6.028 ( 10.383 -4.544 -11.904) 16.436 6.537 ( -11.306 -23.912 -2.886) 26.607 7.414 ( 0.883 3.426 -5.475) 6.519 7.749 ( -11.317 -12.788 12.043) 20.896 8.199 ( 3.578 -5.145 1.279) 6.396 8.609 ( 9.339 5.765 4.192) 11.748 9.259 ( -4.228 17.032 -7.111) 18.935 24.867 ( -0.391 17.020 -0.747) 17.041 24.898 ( 0.964 14.729 0.105) 14.761 27.447 ( -0.108 3.883 0.356) 3.900 27.553 ( 0.557 6.156 -0.551) 6.205 29.716 ( -1.469 -2.530 4.800) 5.621 30.305 ( -0.034 -3.090 -1.366) 3.379 34.444 ( -1.314 -15.538 2.854) 15.852 34.826 ( -1.467 -17.906 -3.649) 18.333 94.195 ( -0.218 8.705 0.404) 8.717 94.240 ( -1.709 12.453 -1.223) 12.629 97.071 ( 1.253 -2.732 0.274) 3.018 98.048 ( 4.949 -10.966 -7.161) 14.001 ======================= Grid point 157 (57/252) ======================= q-point: ( 0.40 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.559 ( -3.769 11.959 21.541) 24.925 2.280 ( 11.700 1.606 8.716) 14.678 2.428 ( -7.249 4.426 17.304) 19.276 2.480 ( 20.685 0.527 -7.475) 22.001 2.852 ( 7.799 1.731 -8.715) 11.822 3.081 ( -10.438 -0.238 -4.013) 11.185 3.296 ( -2.257 -0.224 2.031) 3.045 3.536 ( 11.399 7.417 7.896) 15.725 3.609 ( -15.716 1.588 8.352) 17.868 3.717 ( -3.026 4.483 -1.498) 5.612 4.154 ( 0.808 0.648 -12.264) 12.308 4.393 ( 1.456 -2.370 -4.928) 5.658 4.731 ( -7.228 1.673 10.387) 12.764 4.741 ( 1.926 12.597 -0.464) 12.751 5.046 ( 2.057 1.972 -5.005) 5.759 5.422 ( -0.992 -3.108 7.499) 8.178 5.443 ( -0.370 -3.985 2.459) 4.697 6.152 ( 11.725 -5.361 -12.383) 17.876 6.349 ( -5.509 -23.704 -3.806) 24.632 7.365 ( -3.158 -1.884 -9.391) 10.086 7.649 ( -6.206 -7.185 13.659) 16.634 8.282 ( 2.296 -3.406 5.112) 6.558 8.784 ( 6.848 4.295 1.027) 8.148 9.127 ( -4.309 17.312 -5.728) 18.737 24.861 ( 0.071 15.706 -0.310) 15.710 24.913 ( 0.509 14.712 -0.134) 14.722 27.448 ( -0.064 3.981 0.526) 4.016 27.559 ( 0.422 6.115 -0.523) 6.152 29.724 ( -1.249 -2.565 4.330) 5.185 30.294 ( 0.085 -2.998 -1.587) 3.393 34.437 ( -1.442 -15.587 2.175) 15.804 34.784 ( -0.296 -17.790 -3.079) 18.057 94.192 ( -0.243 8.443 0.129) 8.448 94.215 ( -0.524 10.240 -0.566) 10.269 97.104 ( 1.266 -2.975 2.305) 3.970 98.073 ( 3.069 -10.044 -6.049) 12.120 ======================= Grid point 158 (58/252) ======================= q-point: (-0.50 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.585 ( -9.492 12.290 19.276) 24.753 2.345 ( -9.950 2.246 0.375) 10.208 2.421 ( -6.470 4.788 19.168) 20.789 2.803 ( 14.755 -3.202 -7.471) 16.846 2.956 ( 3.204 1.550 -1.318) 3.795 2.994 ( 9.672 1.673 2.465) 10.120 3.236 ( -4.235 -2.195 0.154) 4.773 3.390 ( -9.921 2.996 7.383) 12.724 3.606 ( -10.517 7.067 -1.631) 12.775 3.648 ( -1.442 5.837 -5.193) 7.944 4.164 ( 9.312 1.739 -10.530) 14.164 4.390 ( 1.048 -3.515 -1.348) 3.908 4.688 ( -4.623 3.517 9.122) 10.814 4.781 ( 1.449 10.426 3.146) 10.986 5.087 ( 5.129 1.389 -2.125) 5.723 5.422 ( -3.538 -3.745 4.272) 6.692 5.443 ( -2.340 -2.996 4.052) 5.556 6.248 ( 7.146 -7.757 -11.009) 15.246 6.323 ( 4.811 -23.413 -0.800) 23.916 7.182 ( -6.522 -4.647 -11.984) 14.414 7.717 ( 1.033 -3.323 14.098) 14.521 8.343 ( -0.508 -0.801 7.171) 7.233 8.792 ( -4.907 2.115 -5.748) 7.848 9.103 ( 5.352 17.655 -1.426) 18.504 24.864 ( 0.330 15.632 0.054) 15.636 24.913 ( -0.177 14.524 -0.505) 14.534 27.451 ( -0.084 3.983 0.693) 4.044 27.561 ( 0.201 6.147 -0.535) 6.173 29.729 ( -1.592 -2.649 4.323) 5.314 30.287 ( 0.530 -2.972 -1.815) 3.522 34.424 ( -1.363 -15.610 1.434) 15.734 34.776 ( 1.570 -17.770 -2.472) 18.010 94.188 ( -0.239 8.106 -0.107) 8.110 94.210 ( 0.400 9.989 -0.322) 10.003 97.143 ( 0.326 -3.165 4.299) 5.348 98.079 ( 2.241 -9.930 -5.982) 11.807 ======================= Grid point 159 (59/252) ======================= q-point: (-0.40 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.488 ( -15.490 12.194 18.896) 27.307 2.013 ( -22.719 -0.047 -2.622) 22.870 2.455 ( -4.482 5.736 17.076) 18.563 2.856 ( -7.512 -2.271 6.700) 10.319 2.986 ( 4.501 -0.266 -1.416) 4.726 3.182 ( -9.764 6.044 -3.356) 11.963 3.238 ( -9.261 3.416 -3.247) 10.391 3.323 ( 9.831 5.691 0.759) 11.385 3.361 ( 3.400 2.565 2.652) 5.017 3.595 ( 0.438 7.800 -6.706) 10.296 4.277 ( 9.401 -1.626 -8.310) 12.652 4.415 ( 1.977 -4.067 -0.451) 4.544 4.672 ( -3.393 0.096 5.847) 6.761 4.845 ( 2.184 9.071 5.754) 10.962 5.190 ( 5.967 3.254 1.110) 6.887 5.383 ( -2.649 -3.211 1.668) 4.484 5.406 ( -3.648 -2.359 1.827) 4.713 6.252 ( -0.172 -9.523 -5.331) 10.915 6.477 ( 10.085 -23.528 2.801) 25.751 7.019 ( 0.450 -3.502 -15.969) 16.355 7.841 ( 1.031 -2.267 14.117) 14.334 8.361 ( -3.279 -0.046 7.515) 8.200 8.606 ( -8.757 2.377 -7.342) 11.672 9.226 ( 8.051 16.295 -1.866) 18.271 24.872 ( 0.425 16.573 0.170) 16.579 24.902 ( -0.493 14.396 -0.604) 14.417 27.455 ( -0.143 3.890 0.802) 3.975 27.559 ( 0.009 6.237 -0.561) 6.262 29.727 ( -2.067 -2.726 4.796) 5.891 30.288 ( 0.949 -3.023 -2.040) 3.768 34.410 ( -1.042 -15.596 0.935) 15.659 34.805 ( 3.227 -17.841 -2.118) 18.254 94.183 ( -0.127 7.857 -0.307) 7.864 94.226 ( 1.592 11.542 -0.055) 11.652 97.172 ( -0.995 -3.230 5.571) 6.516 98.068 ( 1.514 -10.596 -7.304) 12.958 ======================= Grid point 160 (60/252) ======================= q-point: (-0.30 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.300 ( -19.635 10.102 17.937) 28.448 1.545 ( -26.474 0.364 0.112) 26.476 2.412 ( -14.399 14.419 0.349) 20.380 2.726 ( -20.278 10.678 12.571) 26.139 2.785 ( -8.382 0.292 11.580) 14.298 3.064 ( 1.458 1.304 -0.079) 1.958 3.166 ( 0.762 -1.790 -4.249) 4.673 3.460 ( 4.672 2.700 -3.420) 6.389 3.547 ( 4.639 6.155 -1.578) 7.867 3.586 ( 7.694 6.161 -3.831) 10.575 4.384 ( 7.224 -3.858 -4.275) 9.238 4.442 ( 2.075 -4.407 -1.960) 5.251 4.644 ( -3.170 -2.841 3.674) 5.623 4.927 ( 2.389 8.849 3.760) 9.907 5.283 ( 2.333 4.883 1.340) 5.575 5.352 ( -1.539 -2.152 -1.622) 3.103 5.358 ( -2.408 -2.560 3.423) 4.906 6.214 ( -0.169 -8.352 -0.112) 8.354 6.678 ( 9.441 -21.268 0.614) 23.278 6.996 ( 8.539 -5.365 -12.946) 16.410 7.923 ( -3.333 -1.037 12.553) 13.029 8.299 ( -7.762 -3.446 0.565) 8.511 8.440 ( -4.490 3.682 0.228) 5.811 9.345 ( 6.902 15.712 -4.207) 17.669 24.871 ( -0.513 15.469 -0.645) 15.491 24.904 ( 1.193 17.651 0.243) 17.693 27.457 ( -0.213 3.726 0.800) 3.817 27.554 ( -0.070 6.364 -0.583) 6.391 29.725 ( -2.274 -2.925 6.174) 7.200 30.292 ( 1.130 -3.110 -2.250) 4.002 34.401 ( -0.576 -15.556 0.894) 15.593 34.856 ( 3.840 -18.065 -2.306) 18.612 94.180 ( 0.073 7.766 -0.343) 7.774 94.275 ( 4.157 15.875 0.202) 16.411 97.183 ( -2.171 -3.263 5.807) 7.006 98.020 ( -0.269 -12.265 -11.021) 16.491 ======================= Grid point 161 (61/252) ======================= q-point: (-0.20 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.960 ( -26.098 -1.231 3.842) 26.408 1.163 ( -21.130 14.677 16.830) 30.743 1.904 ( -31.439 29.752 -2.170) 43.339 2.647 ( -7.809 6.281 21.314) 23.553 2.815 ( 0.631 -1.775 12.449) 12.591 3.016 ( -2.819 -0.264 -4.000) 4.901 3.223 ( 4.786 0.238 -0.477) 4.816 3.406 ( -5.573 2.531 -8.839) 10.751 3.562 ( 3.298 8.166 -4.526) 9.902 3.744 ( 7.023 4.611 0.530) 8.418 4.433 ( -0.134 -4.128 0.172) 4.134 4.521 ( 8.443 -4.722 -1.345) 9.767 4.623 ( -0.994 -2.306 2.470) 3.522 4.946 ( -1.353 8.479 -2.904) 9.064 5.258 ( -3.496 6.951 -2.442) 8.155 5.342 ( 0.777 -3.027 1.578) 3.501 5.373 ( 0.661 -0.752 3.568) 3.706 6.253 ( 3.570 -7.566 -2.020) 8.607 6.821 ( 8.826 -15.263 -4.146) 18.112 7.135 ( 10.829 -9.624 -1.611) 14.576 7.856 ( -11.725 -2.020 7.380) 14.001 8.187 ( -2.095 -1.334 1.226) 2.769 8.415 ( -2.155 2.347 5.796) 6.614 9.393 ( 2.452 11.793 -8.636) 14.821 24.857 ( -0.378 14.816 -0.627) 14.834 24.948 ( 4.074 22.302 -0.459) 22.675 27.458 ( -0.278 3.548 0.672) 3.621 27.549 ( -0.033 6.487 -0.610) 6.516 29.741 ( -1.631 -4.009 9.476) 10.417 30.296 ( 1.145 -3.188 -2.338) 4.116 34.402 ( -0.191 -15.507 1.320) 15.564 34.900 ( 2.747 -18.459 -3.202) 18.935 94.181 ( 0.212 7.818 -0.240) 7.825 94.408 ( 11.872 25.533 -0.487) 28.163 97.175 ( -2.914 -3.313 4.976) 6.651 97.868 ( -6.479 -14.932 -18.859) 24.912 ======================= Grid point 162 (62/252) ======================= q-point: (-0.10 0.08 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.613 ( -10.785 14.553 9.581) 20.491 0.891 ( -20.726 19.934 9.308) 30.226 1.434 ( -24.354 33.893 22.571) 47.448 2.653 ( -7.761 6.281 19.269) 21.702 2.865 ( -2.441 -3.394 -8.355) 9.343 2.988 ( 0.115 1.065 1.343) 1.718 3.198 ( -2.739 -0.591 -3.385) 4.394 3.325 ( 1.466 4.049 5.519) 7.001 3.605 ( 4.489 6.665 -3.328) 8.698 3.829 ( 2.560 3.686 -0.732) 4.547 4.423 ( -0.522 -4.596 -0.297) 4.635 4.622 ( 0.218 -1.280 2.342) 2.678 4.742 ( 11.791 2.944 1.896) 12.300 4.863 ( -1.277 4.743 -5.720) 7.540 5.188 ( -0.589 10.757 -5.473) 12.084 5.334 ( -5.298 -2.341 1.696) 6.036 5.415 ( 2.344 -2.236 0.168) 3.244 6.253 ( 0.945 -8.145 -10.479) 13.306 6.946 ( 4.054 -15.969 2.672) 16.691 7.291 ( 5.596 -7.393 -2.262) 9.544 7.697 ( -9.167 -1.922 11.468) 14.807 8.289 ( 10.612 4.265 5.312) 12.611 8.417 ( -2.404 1.351 6.153) 6.743 9.273 ( -7.170 2.261 -13.628) 15.564 24.850 ( -0.001 14.828 -0.435) 14.835 25.050 ( 8.851 26.343 -6.431) 28.524 27.457 ( -0.316 3.436 0.464) 3.482 27.545 ( 0.074 6.551 -0.658) 6.584 29.808 ( -0.602 -9.308 13.938) 16.771 30.301 ( 1.131 -3.241 -2.185) 4.069 34.411 ( -0.091 -15.467 2.023) 15.599 34.901 ( 0.182 -17.948 -3.669) 18.320 94.184 ( 0.223 8.013 -0.066) 8.016 94.748 ( 29.805 38.945 -13.694) 50.917 97.149 ( -3.133 -3.301 3.278) 5.608 97.466 ( -20.432 -11.474 -21.372) 31.716 ======================= Grid point 163 (63/252) ======================= q-point: ( 0.00 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.142 ( -9.381 28.990 -0.784) 30.480 1.300 ( 9.256 28.016 10.300) 31.251 2.064 ( 0.257 36.115 24.508) 43.646 2.595 ( -7.921 0.487 -17.004) 18.764 2.817 ( -6.410 9.596 11.362) 16.194 2.957 ( -3.868 4.920 -6.237) 8.835 3.260 ( 4.567 -1.791 5.558) 7.414 3.495 ( 4.404 1.577 11.309) 12.238 3.801 ( 1.613 8.066 -1.254) 8.321 3.955 ( 2.059 7.410 -1.457) 7.827 4.359 ( 1.493 -2.143 0.229) 2.622 4.595 ( -1.646 -1.652 2.498) 3.418 4.770 ( -9.477 -5.961 -6.575) 12.983 4.940 ( -0.636 8.228 -4.677) 9.486 5.238 ( 4.389 -1.805 2.532) 5.379 5.257 ( -0.322 -1.860 1.921) 2.693 5.368 ( -0.673 -4.389 0.414) 4.459 6.002 ( 1.330 -9.936 -12.236) 15.818 6.771 ( -3.850 -5.114 1.860) 6.665 7.146 ( 5.424 -13.786 -2.902) 15.096 7.737 ( -0.957 1.810 9.002) 9.232 8.435 ( -6.573 3.228 4.016) 8.351 8.457 ( -10.352 4.088 -5.606) 12.462 9.146 ( 16.586 -3.972 -2.950) 17.308 25.274 ( 0.308 28.541 0.109) 28.542 25.606 ( -0.009 29.705 -8.354) 30.857 27.558 ( -0.402 7.297 0.649) 7.337 27.720 ( 0.349 11.657 -1.159) 11.719 29.653 ( -3.672 -7.636 8.322) 11.876 30.214 ( 1.046 -6.275 -1.812) 6.615 33.984 ( -0.180 -29.790 2.466) 29.893 34.407 ( 0.989 -32.728 -2.129) 32.812 94.414 ( 0.230 14.680 1.049) 14.719 95.367 ( -3.858 15.916 -24.108) 29.144 97.019 ( -2.024 -6.226 1.034) 6.628 97.169 ( 10.144 -8.788 1.181) 13.473 ======================= Grid point 164 (64/252) ======================= q-point: ( 0.10 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.108 ( 5.138 20.270 6.208) 21.814 1.501 ( 2.263 22.631 19.097) 29.698 2.342 ( -4.892 3.868 -17.451) 18.532 2.409 ( 17.434 33.589 17.156) 41.551 2.782 ( -5.297 9.725 11.628) 16.057 2.869 ( 0.163 4.729 -8.981) 10.151 3.302 ( -1.599 -0.973 3.228) 3.731 3.695 ( 3.706 1.246 8.777) 9.608 3.800 ( -0.446 3.187 3.354) 4.648 3.975 ( -0.167 8.240 1.354) 8.352 4.386 ( 1.067 -1.508 -3.383) 3.854 4.491 ( -8.658 -3.353 -5.892) 10.996 4.576 ( -3.220 -3.688 3.382) 5.950 4.919 ( 1.919 9.171 -4.685) 10.475 5.261 ( 0.335 -1.942 1.046) 2.231 5.340 ( -1.976 -3.344 0.179) 3.888 5.354 ( 2.942 -0.309 0.671) 3.034 5.931 ( 1.072 -8.028 -13.910) 16.096 6.611 ( -12.996 -9.861 -0.364) 16.317 7.271 ( 7.699 -15.185 2.112) 17.156 7.708 ( -9.736 0.029 4.309) 10.647 8.242 ( -3.941 3.148 2.892) 5.814 8.387 ( -0.654 3.991 -0.624) 4.092 9.460 ( 14.921 0.207 -4.705) 15.647 25.284 ( 0.545 28.626 0.512) 28.636 25.504 ( -4.119 31.734 -6.558) 32.665 27.556 ( -0.288 7.343 0.594) 7.372 27.720 ( 0.489 11.613 -1.179) 11.683 29.641 ( -3.223 -6.169 6.795) 9.727 30.220 ( 0.847 -6.207 -1.511) 6.444 33.996 ( -0.609 -29.803 2.936) 29.954 34.403 ( 0.081 -33.606 -2.705) 33.715 94.425 ( -0.113 15.049 1.630) 15.137 95.003 ( -14.610 22.521 -15.632) 31.065 96.993 ( -0.998 -5.770 -0.467) 5.874 97.454 ( 16.254 -16.522 -2.000) 23.264 ======================= Grid point 165 (65/252) ======================= q-point: ( 0.20 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.381 ( 15.642 9.632 11.035) 21.429 1.680 ( 2.501 18.494 21.622) 28.562 2.209 ( 3.578 5.714 -15.369) 16.782 2.667 ( -1.154 11.260 4.695) 12.254 2.803 ( 1.195 5.678 -3.598) 6.827 3.005 ( 19.125 24.875 11.622) 33.460 3.292 ( -1.760 -1.231 4.065) 4.598 3.605 ( -8.978 2.897 -5.444) 10.892 3.885 ( -1.793 -0.303 10.503) 10.659 3.957 ( -4.244 5.527 4.001) 8.035 4.314 ( -0.959 -3.313 -6.976) 7.782 4.418 ( -0.634 1.318 -4.397) 4.634 4.580 ( 0.247 -5.799 6.587) 8.779 4.934 ( 2.908 9.548 -4.619) 10.998 5.274 ( 0.808 -3.831 0.047) 3.915 5.320 ( -0.799 -1.380 1.955) 2.522 5.351 ( -2.827 3.368 -0.510) 4.427 5.871 ( 3.325 -6.780 -11.960) 14.144 6.335 ( -15.761 -17.769 -1.711) 23.813 7.404 ( 2.124 -19.507 6.463) 20.659 7.552 ( -6.014 2.048 -0.879) 6.414 8.201 ( -2.845 4.209 0.614) 5.117 8.498 ( 9.747 4.184 4.293) 11.442 9.581 ( 3.815 5.873 -7.353) 10.154 25.300 ( 0.723 28.478 0.721) 28.496 25.397 ( -3.381 31.603 -3.692) 31.997 27.556 ( -0.178 7.448 0.629) 7.476 27.722 ( 0.636 11.567 -1.116) 11.638 29.636 ( -2.012 -5.292 5.407) 7.829 30.222 ( 0.474 -6.074 -1.424) 6.256 34.002 ( -1.025 -29.862 3.003) 30.030 34.370 ( -1.314 -33.955 -3.200) 34.130 94.432 ( -0.548 15.221 1.829) 15.340 94.706 ( -9.203 21.480 -7.140) 24.435 96.981 ( 0.221 -5.518 -0.850) 5.588 97.665 ( 9.701 -18.128 -4.398) 21.025 ======================= Grid point 166 (66/252) ======================= q-point: ( 0.30 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.708 ( 7.663 14.862 14.274) 21.985 1.947 ( 13.434 6.750 16.706) 22.475 2.261 ( 12.627 4.314 -12.340) 18.175 2.627 ( -8.049 9.677 12.081) 17.446 2.825 ( 6.845 2.669 -10.483) 12.801 3.285 ( -0.381 -0.264 4.034) 4.061 3.344 ( -8.850 4.126 -5.156) 11.042 3.477 ( 13.995 17.283 8.054) 23.652 3.825 ( -13.200 -1.619 9.345) 16.254 3.888 ( -2.963 6.620 0.382) 7.263 4.247 ( -0.891 0.564 -9.446) 9.505 4.388 ( 0.900 0.023 -3.271) 3.393 4.656 ( 1.343 -4.990 9.221) 10.570 4.955 ( 2.941 9.583 -3.914) 10.761 5.248 ( -5.457 9.436 -3.202) 11.361 5.303 ( 0.919 -5.165 1.198) 5.381 5.333 ( -1.161 -4.820 5.247) 7.219 5.903 ( 7.242 -8.367 -7.848) 13.567 6.044 ( -12.940 -23.659 -4.244) 27.298 7.389 ( -5.493 -16.359 -2.746) 17.474 7.511 ( -1.262 0.195 7.837) 7.941 8.200 ( 3.064 4.458 -0.385) 5.423 8.713 ( 9.099 4.579 5.100) 11.392 9.532 ( -2.365 9.645 -7.842) 12.653 25.312 ( -0.188 28.093 -0.411) 28.096 25.337 ( -1.009 30.385 -0.922) 30.416 27.558 ( -0.115 7.567 0.732) 7.603 27.727 ( 0.688 11.546 -1.016) 11.612 29.642 ( -1.356 -5.135 4.552) 6.995 30.217 ( 0.195 -5.905 -1.565) 6.112 34.001 ( -1.311 -29.948 2.637) 30.092 34.319 ( -1.524 -33.952 -3.127) 34.129 94.430 ( -0.876 15.111 1.486) 15.209 94.551 ( -4.507 18.505 -3.204) 19.313 96.990 ( 1.044 -5.662 0.080) 5.758 97.765 ( 5.290 -17.433 -4.609) 18.791 ======================= Grid point 167 (67/252) ======================= q-point: ( 0.40 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.869 ( -0.419 19.115 15.137) 24.386 2.308 ( 12.979 1.259 7.257) 14.923 2.484 ( 18.202 1.383 -6.364) 19.332 2.572 ( -7.128 8.700 14.145) 18.072 2.902 ( 8.267 3.476 -6.286) 10.952 3.079 ( -12.247 -0.281 -5.347) 13.366 3.284 ( -2.992 -1.095 1.783) 3.651 3.576 ( -13.421 -0.939 7.357) 15.334 3.786 ( 5.012 13.135 5.208) 14.993 3.848 ( -0.800 8.785 -1.372) 8.927 4.171 ( 1.313 1.335 -9.950) 10.125 4.391 ( 1.739 1.197 -4.025) 4.545 4.734 ( -1.823 -0.893 11.930) 12.102 4.989 ( 3.112 9.465 -2.309) 10.227 5.126 ( -4.079 7.518 -3.265) 9.155 5.330 ( 0.408 -6.130 3.258) 6.954 5.345 ( -2.165 -5.642 5.549) 8.204 5.821 ( -7.013 -27.118 -1.920) 28.076 6.010 ( 9.277 -8.954 -10.181) 16.428 7.216 ( -8.394 -14.293 -7.247) 18.091 7.579 ( 1.285 1.338 9.976) 10.148 8.287 ( 4.249 3.694 4.051) 6.936 8.864 ( 4.121 3.853 0.903) 5.713 9.428 ( -2.135 11.967 -6.304) 13.694 25.294 ( -0.336 28.420 -0.825) 28.434 25.336 ( 0.072 28.787 0.169) 28.788 27.562 ( -0.139 7.647 0.867) 7.697 27.732 ( 0.590 11.554 -0.937) 11.607 29.648 ( -1.299 -5.247 4.135) 6.806 30.209 ( 0.251 -5.779 -1.804) 6.059 33.992 ( -1.411 -30.025 1.951) 30.121 34.280 ( -0.403 -33.908 -2.650) 34.014 94.422 ( -0.926 14.773 0.814) 14.824 94.483 ( -1.444 16.670 -1.462) 16.796 97.017 ( 1.078 -6.054 1.861) 6.425 97.806 ( 2.979 -16.802 -4.466) 17.639 ======================= Grid point 168 (68/252) ======================= q-point: (-0.50 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( -7.230 19.447 13.018) 24.493 2.379 ( -10.449 1.086 -1.385) 10.597 2.556 ( -4.898 8.759 16.698) 19.481 2.750 ( 12.735 -2.087 -9.038) 15.755 2.957 ( 0.551 -0.309 3.073) 3.137 3.065 ( 11.439 3.973 3.342) 12.562 3.188 ( -3.163 -2.052 -1.699) 4.135 3.442 ( -7.146 1.877 7.344) 10.417 3.796 ( -2.904 9.952 -3.792) 11.039 3.806 ( -4.031 11.757 -1.181) 12.485 4.177 ( 5.423 -0.518 -8.331) 9.954 4.383 ( 0.926 2.058 -5.042) 5.524 4.724 ( -7.957 0.647 10.574) 13.249 5.018 ( 1.127 11.637 -0.262) 11.694 5.124 ( 6.014 2.594 -0.764) 6.594 5.326 ( -2.667 -5.894 2.822) 7.058 5.357 ( -1.799 -5.579 5.819) 8.260 5.780 ( 3.065 -26.965 0.922) 27.155 6.082 ( 5.824 -10.555 -9.328) 15.243 7.018 ( -5.544 -12.385 -11.457) 17.759 7.686 ( 1.874 0.815 11.829) 12.004 8.384 ( 0.962 4.459 8.398) 9.557 8.840 ( -4.574 3.027 -6.040) 8.158 9.414 ( 4.391 12.518 -3.244) 13.657 25.296 ( 0.873 28.368 0.013) 28.382 25.331 ( -0.457 28.527 -0.405) 28.534 27.565 ( -0.241 7.655 0.994) 7.723 27.734 ( 0.394 11.575 -0.900) 11.616 29.651 ( -1.595 -5.384 4.055) 6.926 30.203 ( 0.580 -5.765 -2.034) 6.140 33.978 ( -1.279 -30.061 1.200) 30.112 34.272 ( 1.402 -33.886 -2.063) 33.977 94.410 ( -0.733 14.355 0.137) 14.374 94.473 ( 1.148 16.427 -0.531) 16.475 97.050 ( 0.384 -6.388 3.651) 7.368 97.814 ( 1.469 -16.729 -4.744) 17.451 ======================= Grid point 169 (69/252) ======================= q-point: (-0.40 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.786 ( -14.131 16.463 8.100) 23.159 2.038 ( -21.582 4.146 -0.099) 21.977 2.610 ( -2.412 9.997 16.626) 19.549 2.810 ( -5.476 -2.005 3.626) 6.867 2.977 ( 4.850 -0.536 -0.435) 4.899 3.203 ( 4.421 -0.486 -4.741) 6.500 3.354 ( 7.105 3.514 3.420) 8.633 3.426 ( 6.550 4.078 5.384) 9.408 3.561 ( -16.004 17.814 -3.920) 24.266 3.779 ( 0.317 10.611 -4.107) 11.382 4.228 ( 5.970 -3.323 -6.863) 9.684 4.362 ( 0.928 -1.183 -5.212) 5.425 4.635 ( -7.606 -3.146 7.188) 10.928 5.051 ( 2.412 9.752 0.619) 10.065 5.266 ( 6.269 2.900 2.896) 7.490 5.306 ( -0.649 -3.901 2.626) 4.747 5.338 ( -3.217 -3.322 2.684) 5.347 5.906 ( 6.639 -23.481 4.114) 24.746 6.109 ( 4.471 -13.315 -4.537) 14.760 6.874 ( 0.444 -11.130 -15.573) 19.147 7.805 ( 1.137 -0.809 13.527) 13.598 8.418 ( -4.639 5.184 9.055) 11.419 8.663 ( -7.480 3.613 -8.352) 11.780 9.505 ( 7.090 10.736 -3.686) 13.384 25.311 ( -0.603 27.647 -0.579) 27.660 25.330 ( 1.999 30.014 0.315) 30.082 27.567 ( -0.371 7.594 1.073) 7.679 27.733 ( 0.218 11.598 -0.893) 11.635 29.648 ( -1.990 -5.472 4.334) 7.258 30.201 ( 0.901 -5.868 -2.230) 6.342 33.965 ( -0.906 -30.044 0.688) 30.065 34.300 ( 2.958 -33.892 -1.683) 34.063 94.399 ( -0.337 14.056 -0.327) 14.064 94.520 ( 4.301 17.765 0.199) 18.280 97.078 ( -0.731 -6.528 4.755) 8.109 97.790 ( -0.156 -17.251 -5.865) 18.221 ======================= Grid point 170 (70/252) ======================= q-point: (-0.30 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( -20.778 7.562 -4.064) 22.482 1.730 ( -17.188 17.780 12.795) 27.844 2.675 ( -3.262 12.690 13.479) 18.798 2.737 ( -5.311 -1.579 9.414) 10.923 3.083 ( 1.397 2.182 -0.916) 2.748 3.127 ( -20.086 23.754 -2.989) 31.251 3.156 ( -1.185 0.593 -4.229) 4.432 3.521 ( 3.886 3.440 1.559) 5.419 3.643 ( 8.889 3.745 2.779) 10.038 3.758 ( 2.179 10.019 -4.796) 11.319 4.289 ( 5.743 -5.908 -5.322) 9.809 4.355 ( 1.887 -3.328 -4.017) 5.547 4.571 ( -4.079 -4.107 5.509) 7.991 5.109 ( 2.876 7.651 0.712) 8.205 5.277 ( -3.162 -5.014 0.757) 5.976 5.295 ( -1.319 -3.521 2.942) 4.775 5.398 ( 2.774 5.702 2.122) 6.687 6.004 ( 3.666 -11.968 0.139) 12.517 6.264 ( 11.357 -19.087 5.018) 22.770 6.826 ( 6.678 -11.704 -15.505) 20.542 7.896 ( -2.136 -1.404 12.955) 13.205 8.311 ( -9.490 4.253 -0.283) 10.404 8.528 ( -4.029 4.971 0.801) 6.448 9.580 ( 4.154 7.381 -6.658) 10.773 25.290 ( -0.767 28.005 -0.835) 28.028 25.389 ( 4.028 31.155 0.497) 31.419 27.566 ( -0.475 7.491 1.064) 7.581 27.730 ( 0.145 11.624 -0.911) 11.661 29.642 ( -2.259 -5.608 5.158) 7.947 30.203 ( 1.038 -6.030 -2.370) 6.561 33.957 ( -0.406 -29.983 0.631) 29.993 34.348 ( 3.424 -33.910 -1.736) 34.127 94.394 ( 0.076 13.944 -0.412) 13.950 94.644 ( 9.567 20.529 0.694) 22.660 97.088 ( -1.858 -6.571 4.867) 8.386 97.715 ( -3.120 -18.065 -8.256) 20.106 ======================= Grid point 171 (71/252) ======================= q-point: (-0.20 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.115 ( -12.107 16.427 -2.415) 20.549 1.536 ( -14.897 22.245 13.041) 29.780 2.519 ( -22.186 31.594 -0.745) 38.613 2.768 ( 0.600 -0.558 10.683) 10.714 2.841 ( -8.198 11.962 15.845) 21.480 3.015 ( -3.761 0.094 -5.936) 7.028 3.240 ( 6.370 1.449 -1.802) 6.777 3.470 ( -7.594 3.664 -2.222) 8.720 3.739 ( 2.904 9.036 -1.495) 9.608 3.848 ( 6.984 6.136 -1.402) 9.402 4.354 ( 0.501 -3.557 -3.097) 4.743 4.407 ( 10.472 -6.368 0.322) 12.260 4.569 ( -0.115 -2.961 4.311) 5.231 5.111 ( -2.836 6.899 -2.634) 7.911 5.257 ( -0.557 -5.122 3.202) 6.066 5.300 ( 0.342 -2.866 2.349) 3.721 5.412 ( -1.773 3.395 0.007) 3.830 6.066 ( 3.420 -10.841 -3.576) 11.917 6.512 ( 11.274 -13.622 3.874) 18.102 6.917 ( 11.942 -12.900 -7.188) 18.992 7.865 ( -9.108 1.563 6.540) 11.322 8.202 ( 0.113 3.430 1.837) 3.893 8.491 ( -3.039 4.706 5.263) 7.686 9.523 ( -4.437 1.750 -11.388) 12.347 25.275 ( -0.305 28.184 -0.596) 28.192 25.483 ( 6.370 31.943 -0.796) 32.581 27.564 ( -0.522 7.385 0.953) 7.464 27.726 ( 0.169 11.652 -0.969) 11.693 29.641 ( -2.316 -6.141 6.733) 9.403 30.205 ( 1.053 -6.177 -2.368) 6.699 33.959 ( -0.014 -29.902 1.045) 29.920 34.390 ( 2.467 -33.727 -2.155) 33.886 94.396 ( 0.341 14.023 -0.140) 14.028 94.897 ( 18.630 22.778 -0.493) 29.430 97.079 ( -2.582 -6.585 4.072) 8.161 97.540 ( -9.083 -17.614 -11.544) 22.935 ======================= Grid point 172 (72/252) ======================= q-point: (-0.10 0.15 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.071 ( 6.646 28.691 3.526) 29.661 1.353 ( -13.074 26.313 5.178) 29.835 2.127 ( -20.695 36.272 12.760) 43.667 2.796 ( -3.831 1.863 -3.697) 5.641 2.843 ( -4.771 7.548 8.833) 12.560 2.995 ( 2.781 -0.445 7.738) 8.235 3.208 ( -4.421 2.025 -8.619) 9.896 3.402 ( 0.207 3.394 7.347) 8.095 3.771 ( 2.809 9.820 -2.872) 10.610 3.925 ( 2.984 6.179 -1.792) 7.092 4.344 ( 0.320 -3.223 -0.737) 3.322 4.583 ( 1.150 -2.508 3.137) 4.178 4.689 ( 13.993 -5.060 2.946) 15.169 5.016 ( -3.726 7.454 -4.417) 9.432 5.251 ( -2.727 -3.946 3.401) 5.880 5.312 ( -5.461 0.151 -1.338) 5.624 5.355 ( 0.433 -3.799 0.771) 3.900 6.057 ( 1.067 -11.275 -9.192) 14.586 6.710 ( 7.580 -7.973 2.400) 11.259 7.078 ( 7.084 -13.826 -3.001) 15.823 7.742 ( -6.483 4.269 5.388) 9.449 8.368 ( 13.351 4.062 6.374) 15.342 8.476 ( -2.900 4.134 5.122) 7.193 9.250 ( -13.776 -3.606 -14.385) 20.241 25.271 ( 0.096 28.363 -0.254) 28.364 25.590 ( 6.451 30.326 -4.738) 31.365 27.561 ( -0.494 7.315 0.787) 7.374 27.723 ( 0.245 11.670 -1.068) 11.721 29.651 ( -2.665 -7.389 8.427) 11.520 30.208 ( 1.067 -6.266 -2.160) 6.713 33.970 ( 0.066 -29.828 1.749) 29.880 34.405 ( 1.103 -32.945 -2.307) 33.044 94.404 ( 0.392 14.288 0.389) 14.299 95.279 ( 23.634 18.254 -10.004) 31.494 97.053 ( -2.790 -6.487 2.655) 7.544 97.243 ( -12.525 -11.371 -9.340) 19.324 ======================= Grid point 173 (73/252) ======================= q-point: ( 0.00 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( -5.559 27.880 -3.096) 28.596 1.870 ( 2.977 30.568 4.309) 31.013 2.611 ( -4.263 3.438 -14.203) 15.222 2.749 ( 3.543 31.770 15.640) 35.588 3.006 ( -5.307 7.988 -1.755) 9.749 3.091 ( -3.848 9.485 8.625) 13.385 3.232 ( 3.520 -0.377 2.118) 4.125 3.518 ( 2.803 1.046 9.108) 9.587 3.958 ( -0.626 7.618 -2.879) 8.168 4.127 ( 4.306 9.662 -1.832) 10.736 4.323 ( -0.044 -1.619 4.181) 4.484 4.562 ( -2.018 -3.234 1.265) 4.017 4.641 ( -6.948 -5.251 -4.590) 9.845 5.045 ( 0.190 1.646 -2.165) 2.726 5.169 ( -1.825 -5.191 3.900) 6.745 5.198 ( 3.002 -3.092 2.273) 4.872 5.276 ( -0.383 -4.559 1.770) 4.906 5.803 ( 1.411 -10.187 -9.531) 14.021 6.721 ( -2.383 -1.868 -1.717) 3.481 6.822 ( 4.571 -19.008 -0.842) 19.568 7.780 ( -2.703 2.507 4.358) 5.708 8.503 ( -3.524 2.994 2.081) 5.071 8.533 ( -11.870 4.350 -5.442) 13.764 9.059 ( 17.027 -4.557 -1.876) 17.726 25.942 ( 0.351 40.064 0.388) 40.067 26.262 ( -0.126 38.230 -4.802) 38.531 27.733 ( -0.579 10.635 1.134) 10.711 27.986 ( 0.539 15.525 -1.687) 15.626 29.502 ( -2.213 -8.356 5.997) 10.521 30.066 ( 1.090 -8.932 -1.764) 9.170 33.284 ( -0.021 -42.065 2.091) 42.117 33.644 ( 0.407 -45.562 -1.886) 45.603 94.738 ( 0.295 18.250 1.815) 18.342 95.602 ( -2.246 9.801 -12.917) 16.369 96.872 ( -1.569 -8.953 0.770) 9.122 96.983 ( 5.037 -10.374 0.375) 11.538 ======================= Grid point 174 (74/252) ======================= q-point: ( 0.10 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.580 ( -2.121 26.752 -2.861) 26.988 1.960 ( 0.230 24.113 13.532) 27.651 2.453 ( -1.997 7.463 -13.033) 15.151 2.872 ( -1.585 8.463 -8.884) 12.372 3.041 ( -5.629 12.461 6.379) 15.088 3.107 ( 17.281 28.857 14.265) 36.536 3.281 ( -0.568 -1.276 2.630) 2.978 3.686 ( 5.026 -1.093 12.353) 13.381 3.876 ( -6.336 3.137 -4.409) 8.333 4.151 ( -2.421 9.269 1.086) 9.641 4.346 ( -2.783 -2.213 -4.514) 5.746 4.409 ( -2.522 -4.831 2.084) 5.834 4.548 ( -3.854 0.915 0.822) 4.045 5.047 ( 1.262 3.425 -1.251) 3.859 5.165 ( -0.875 -6.313 2.661) 6.907 5.234 ( -1.955 -6.274 1.654) 6.776 5.351 ( 5.883 -1.212 0.967) 6.084 5.759 ( 1.641 -9.309 -10.406) 14.059 6.498 ( -16.649 -3.995 -4.815) 17.786 6.932 ( 3.843 -19.521 3.463) 20.194 7.721 ( -6.367 1.882 0.617) 6.668 8.345 ( -2.679 7.325 0.243) 7.803 8.462 ( 0.100 3.597 -1.023) 3.741 9.402 ( 17.219 -5.472 -2.313) 18.215 25.953 ( 0.372 40.103 0.848) 40.114 26.193 ( -3.154 39.505 -4.987) 39.943 27.732 ( -0.414 10.666 1.088) 10.730 27.985 ( 0.676 15.527 -1.711) 15.636 29.505 ( -1.949 -8.021 5.547) 9.945 30.074 ( 0.995 -8.801 -1.514) 8.986 33.296 ( -0.521 -42.078 2.595) 42.161 33.626 ( -0.802 -46.115 -2.334) 46.181 94.754 ( -0.265 18.435 2.636) 18.625 95.364 ( -11.323 15.568 -11.647) 22.500 96.853 ( -0.628 -8.618 -0.388) 8.650 97.146 ( 10.279 -15.309 0.081) 18.440 ======================= Grid point 175 (75/252) ======================= q-point: ( 0.20 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( 9.234 17.280 3.945) 19.986 2.075 ( 1.070 21.246 15.750) 26.468 2.367 ( 1.918 10.602 -10.661) 15.158 2.814 ( 3.587 4.569 -11.361) 12.760 2.966 ( -7.053 11.928 6.994) 15.522 3.271 ( -1.854 -0.888 3.164) 3.773 3.544 ( 19.087 27.735 8.783) 34.795 3.621 ( -11.971 -1.846 -7.550) 14.273 3.840 ( -2.139 -2.984 11.430) 12.006 4.071 ( -5.165 4.958 -0.293) 7.166 4.281 ( -0.192 0.041 0.070) 0.209 4.460 ( -2.629 2.658 -2.845) 4.698 4.488 ( 1.652 -2.984 5.225) 6.240 5.068 ( 1.370 3.896 -0.602) 4.174 5.171 ( 0.383 -5.704 0.848) 5.779 5.213 ( -2.264 -6.871 4.036) 8.284 5.425 ( 2.291 0.772 -0.852) 2.564 5.727 ( 3.086 -7.916 -9.791) 12.963 6.096 ( -22.010 -7.700 -6.141) 24.113 6.997 ( -0.734 -22.038 6.644) 23.030 7.620 ( -2.765 5.282 -2.151) 6.338 8.325 ( -1.057 8.155 0.082) 8.224 8.571 ( 10.181 3.385 2.665) 11.055 9.599 ( 7.590 -3.354 -5.670) 10.050 25.966 ( 0.228 39.864 0.943) 39.875 26.098 ( -3.489 40.449 -3.710) 40.768 27.733 ( -0.274 10.725 1.128) 10.788 27.987 ( 0.847 15.551 -1.640) 15.661 29.510 ( -1.561 -7.818 4.873) 9.344 30.079 ( 0.705 -8.617 -1.525) 8.779 33.301 ( -0.989 -42.137 2.691) 42.234 33.584 ( -1.813 -46.654 -2.666) 46.765 94.763 ( -0.950 18.478 2.869) 18.724 95.100 ( -9.602 18.894 -7.254) 22.401 96.845 ( 0.207 -8.456 -0.737) 8.491 97.307 ( 7.664 -18.462 -1.664) 20.059 ======================= Grid point 176 (76/252) ======================= q-point: ( 0.30 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.933 ( 16.145 9.281 7.524) 20.085 2.212 ( 2.107 18.833 14.507) 23.865 2.383 ( 8.078 8.253 -9.889) 15.204 2.820 ( -1.251 8.646 1.182) 8.816 2.910 ( 0.390 7.604 -0.628) 7.640 3.260 ( -2.415 -2.064 2.365) 3.961 3.342 ( -11.408 -2.687 -7.388) 13.855 3.751 ( -9.538 -0.141 5.015) 10.777 3.899 ( 7.246 14.488 6.085) 17.304 4.006 ( 0.631 7.361 0.061) 7.388 4.291 ( 0.706 4.090 -4.825) 6.364 4.378 ( -3.092 -1.319 2.225) 4.031 4.584 ( 3.391 -1.598 6.227) 7.268 5.084 ( 1.091 3.601 -0.998) 3.892 5.195 ( 0.965 -5.442 1.440) 5.712 5.204 ( -2.216 -7.114 4.984) 8.965 5.423 ( -1.649 4.222 -1.580) 4.800 5.665 ( -18.687 -10.708 -4.399) 21.982 5.753 ( 5.846 -9.178 -8.802) 13.997 6.982 ( -5.164 -22.829 3.268) 23.632 7.606 ( 1.494 7.537 1.236) 7.783 8.333 ( 2.490 8.488 -0.744) 8.877 8.787 ( 9.661 3.250 3.857) 10.898 9.620 ( 0.700 -0.180 -7.244) 7.280 25.968 ( -0.632 39.257 -0.077) 39.262 26.029 ( -1.707 40.633 -1.439) 40.694 27.737 ( -0.221 10.785 1.221) 10.856 27.992 ( 0.923 15.611 -1.535) 15.713 29.516 ( -1.352 -7.870 4.286) 9.063 30.078 ( 0.437 -8.446 -1.755) 8.637 33.298 ( -1.287 -42.216 2.333) 42.300 33.530 ( -1.812 -46.933 -2.573) 47.039 94.760 ( -1.445 18.368 2.360) 18.575 94.923 ( -5.674 19.338 -3.972) 20.541 96.851 ( 0.727 -8.658 -0.056) 8.689 97.402 ( 4.659 -19.451 -2.479) 20.154 ======================= Grid point 177 (77/252) ======================= q-point: ( 0.40 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.248 ( 8.613 15.227 8.563) 19.477 2.352 ( 5.166 7.413 7.432) 11.699 2.524 ( 13.949 2.973 -8.149) 16.426 2.766 ( -7.571 10.970 11.445) 17.569 2.984 ( 5.882 4.107 -1.997) 7.447 3.061 ( -9.515 -1.176 -4.758) 10.703 3.255 ( -3.620 -1.672 0.290) 3.998 3.560 ( -11.626 -0.344 5.509) 12.870 3.948 ( 1.324 3.867 -0.902) 4.186 4.089 ( 0.477 12.908 1.114) 12.964 4.220 ( -0.636 4.314 -7.317) 8.518 4.397 ( 2.007 -1.649 0.352) 2.622 4.678 ( -0.111 -4.242 9.131) 10.068 5.087 ( 0.149 1.354 -1.584) 2.089 5.199 ( -2.481 -6.006 6.115) 8.923 5.228 ( 1.781 -2.466 1.517) 3.399 5.342 ( -5.880 8.754 -2.424) 10.820 5.404 ( -5.188 -14.413 -1.707) 15.413 5.822 ( 6.548 -9.994 -6.936) 13.815 6.864 ( -6.759 -20.766 -3.658) 22.143 7.673 ( 2.400 7.786 5.907) 10.063 8.401 ( 3.893 7.396 2.791) 8.812 8.934 ( 4.058 3.532 -0.004) 5.380 9.565 ( -0.218 2.221 -6.244) 6.631 25.949 ( -0.565 38.976 -0.622) 38.985 26.010 ( -0.413 40.225 -0.107) 40.227 27.742 ( -0.286 10.813 1.328) 10.898 27.998 ( 0.817 15.662 -1.462) 15.752 29.520 ( -1.386 -8.040 3.901) 9.043 30.072 ( 0.416 -8.351 -2.060) 8.611 33.288 ( -1.356 -42.287 1.637) 42.340 33.490 ( -0.619 -47.029 -2.088) 47.080 94.745 ( -1.516 18.146 1.377) 18.261 94.834 ( -1.971 19.000 -1.978) 19.204 96.870 ( 0.790 -9.105 1.362) 9.240 97.447 ( 2.514 -19.666 -2.846) 20.029 ======================= Grid point 178 (78/252) ======================= q-point: (-0.50 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.295 ( -8.221 18.101 3.387) 20.167 2.399 ( -6.770 3.563 2.292) 7.986 2.712 ( 9.923 1.701 -4.442) 11.004 2.760 ( -0.024 8.537 9.149) 12.514 2.952 ( 1.079 -0.418 3.311) 3.508 3.073 ( -3.844 -3.015 4.008) 6.319 3.226 ( 9.281 5.810 -1.315) 11.028 3.461 ( -5.293 0.380 6.219) 8.175 3.976 ( 0.884 7.855 -1.740) 8.094 4.031 ( -2.814 8.539 -1.036) 9.050 4.165 ( -0.451 0.718 -7.969) 8.014 4.425 ( 1.580 1.275 -4.026) 4.509 4.676 ( -7.159 -5.542 8.908) 12.701 5.105 ( 3.295 -2.610 0.492) 4.232 5.189 ( -2.577 -2.743 3.873) 5.401 5.237 ( -3.127 -0.771 -0.011) 3.221 5.310 ( 4.381 5.105 2.516) 7.182 5.393 ( 2.971 -11.098 1.771) 11.625 5.868 ( 3.517 -11.059 -6.633) 13.366 6.717 ( -3.817 -18.008 -9.344) 20.644 7.756 ( 0.879 6.444 8.847) 10.981 8.493 ( 1.596 6.315 7.334) 9.809 8.911 ( -3.914 4.270 -6.287) 8.549 9.562 ( 3.855 2.777 -3.936) 6.169 25.949 ( 0.717 38.868 0.153) 38.875 26.002 ( -0.150 40.107 -0.455) 40.110 27.745 ( -0.437 10.800 1.426) 10.902 28.001 ( 0.589 15.652 -1.434) 15.729 29.520 ( -1.589 -8.180 3.743) 9.135 30.065 ( 0.622 -8.371 -2.328) 8.711 33.273 ( -1.165 -42.325 0.867) 42.350 33.483 ( 1.214 -47.009 -1.471) 47.048 94.727 ( -1.145 17.906 0.351) 17.946 94.821 ( 1.574 18.915 -0.674) 18.992 96.896 ( 0.396 -9.523 2.836) 9.944 97.455 ( 0.760 -19.734 -3.321) 20.026 ======================= Grid point 179 (79/252) ======================= q-point: (-0.40 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.009 ( -17.800 7.088 -6.536) 20.243 2.269 ( -11.517 18.477 9.554) 23.777 2.789 ( -4.076 0.718 2.169) 4.673 2.833 ( -0.695 12.027 13.864) 18.367 2.964 ( 6.490 -0.801 -1.169) 6.643 3.180 ( 8.127 -2.237 -2.339) 8.748 3.394 ( 2.794 0.885 2.296) 3.723 3.483 ( 7.239 1.611 7.493) 10.542 3.882 ( -6.960 11.902 -3.494) 14.224 4.008 ( -1.899 13.714 -2.294) 14.033 4.152 ( 4.129 -4.172 -5.173) 7.824 4.379 ( -1.379 3.131 -7.443) 8.192 4.573 ( -8.189 -2.445 5.687) 10.265 5.154 ( -0.038 0.568 -0.581) 0.813 5.170 ( -2.580 -8.559 5.984) 10.757 5.229 ( 1.240 -3.787 1.546) 4.274 5.417 ( 4.271 3.879 1.865) 6.064 5.548 ( 12.284 -9.455 5.781) 16.544 5.870 ( 1.897 -11.555 -4.540) 12.559 6.606 ( 0.522 -15.944 -13.370) 20.814 7.831 ( -0.429 3.848 11.224) 11.873 8.536 ( -3.857 6.467 8.709) 11.512 8.746 ( -6.749 4.912 -8.771) 12.108 9.620 ( 4.754 1.276 -4.599) 6.736 25.960 ( -0.150 38.994 -0.236) 38.995 26.016 ( 2.449 40.368 0.116) 40.443 27.746 ( -0.605 10.757 1.494) 10.877 27.999 ( 0.392 15.581 -1.428) 15.651 29.515 ( -1.850 -8.229 3.846) 9.270 30.062 ( 0.838 -8.498 -2.515) 8.902 33.259 ( -0.729 -42.321 0.332) 42.329 33.511 ( 2.790 -46.892 -1.035) 46.986 94.711 ( -0.507 17.756 -0.329) 17.766 94.883 ( 5.557 19.184 0.298) 19.975 96.920 ( -0.423 -9.741 3.715) 10.434 97.427 ( -1.114 -19.701 -4.179) 20.170 ======================= Grid point 180 (80/252) ======================= q-point: (-0.30 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( -12.675 13.819 -5.777) 19.621 2.121 ( -12.133 21.108 10.425) 26.485 2.722 ( -3.791 0.608 6.286) 7.366 2.932 ( -0.033 13.719 13.408) 19.183 3.095 ( 5.997 0.241 -3.563) 6.980 3.176 ( -1.367 1.159 -3.145) 3.620 3.521 ( 0.827 4.592 2.190) 5.154 3.627 ( 1.424 5.460 1.793) 5.921 3.710 ( -5.174 13.016 -0.469) 14.015 3.944 ( -0.382 9.000 -2.521) 9.354 4.192 ( 3.908 -2.898 -2.598) 5.515 4.336 ( 2.343 1.568 -7.446) 7.962 4.501 ( -3.292 -2.588 4.769) 6.347 5.144 ( -1.665 -6.063 2.429) 6.741 5.173 ( 0.283 -3.719 2.062) 4.262 5.243 ( -1.374 -1.636 2.134) 3.019 5.463 ( -0.055 -0.455 0.496) 0.675 5.819 ( 6.610 -6.341 -0.183) 9.162 5.966 ( 15.129 -11.426 5.302) 19.686 6.559 ( 5.260 -15.457 -13.658) 21.287 7.890 ( -2.293 1.387 11.650) 11.955 8.439 ( -8.798 8.458 -0.750) 12.227 8.619 ( -3.759 4.210 0.731) 5.691 9.631 ( 0.154 -1.623 -7.558) 7.732 25.947 ( -0.497 39.455 -0.743) 39.465 26.086 ( 4.594 40.416 0.475) 40.679 27.744 ( -0.726 10.704 1.494) 10.832 27.996 ( 0.330 15.508 -1.434) 15.577 29.508 ( -2.052 -8.228 4.283) 9.501 30.060 ( 0.923 -8.685 -2.581) 9.107 33.253 ( -0.180 -42.273 0.254) 42.274 33.562 ( 3.341 -46.647 -0.983) 46.777 94.705 ( 0.095 17.722 -0.456) 17.728 95.032 ( 10.576 19.106 0.815) 21.853 96.930 ( -1.406 -9.761 3.724) 10.541 97.350 ( -3.782 -19.091 -5.492) 20.222 ======================= Grid point 181 (81/252) ======================= q-point: (-0.20 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.528 ( 1.137 24.603 -2.741) 24.781 1.985 ( -10.443 23.411 9.697) 27.408 2.759 ( 2.381 0.598 6.962) 7.382 2.999 ( -3.084 16.682 9.758) 19.570 3.012 ( -4.452 0.063 -7.556) 8.770 3.208 ( -12.133 17.835 1.398) 21.616 3.300 ( -1.700 11.245 -3.111) 11.791 3.528 ( -9.700 2.294 2.694) 10.325 3.859 ( 9.085 2.349 2.094) 9.614 3.984 ( 5.030 7.042 -2.666) 9.055 4.301 ( 8.974 -3.539 1.405) 9.748 4.317 ( 0.724 0.453 -4.458) 4.539 4.521 ( 1.387 -1.559 4.033) 4.541 5.124 ( -2.152 -6.538 1.661) 7.080 5.201 ( -0.023 -0.616 0.543) 0.822 5.225 ( -1.306 -3.712 4.051) 5.647 5.423 ( -4.472 -1.883 -0.779) 4.914 5.855 ( 1.576 -10.753 -4.239) 11.665 6.328 ( 16.606 -6.376 2.603) 17.977 6.635 ( 11.238 -15.875 -6.304) 20.447 7.890 ( -5.712 1.360 7.996) 9.920 8.324 ( -0.631 8.656 -0.277) 8.683 8.577 ( -3.408 3.881 4.512) 6.858 9.490 ( -8.830 -4.479 -11.501) 15.176 25.937 ( -0.101 39.733 -0.563) 39.737 26.178 ( 5.323 39.870 -0.555) 40.228 27.740 ( -0.765 10.661 1.405) 10.780 27.992 ( 0.380 15.486 -1.481) 15.562 29.502 ( -2.143 -8.292 5.049) 9.942 30.059 ( 0.942 -8.862 -2.463) 9.246 33.257 ( 0.232 -42.192 0.653) 42.197 33.611 ( 2.700 -46.197 -1.260) 46.293 94.708 ( 0.478 17.810 -0.032) 17.817 95.276 ( 15.686 16.814 -0.237) 22.996 96.921 ( -2.067 -9.631 3.032) 10.306 97.207 ( -7.337 -16.682 -6.619) 19.389 ======================= Grid point 182 (82/252) ======================= q-point: (-0.10 0.23 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( 10.057 29.486 0.269) 31.155 1.881 ( -6.522 27.795 4.393) 28.886 2.788 ( -3.687 2.025 -10.651) 11.452 2.807 ( -16.052 31.000 5.202) 35.295 2.973 ( 4.145 -1.405 8.152) 9.253 3.079 ( -4.938 13.593 10.981) 18.158 3.277 ( -4.039 4.837 -7.444) 9.753 3.447 ( -1.031 1.375 7.770) 7.958 3.958 ( 2.560 8.767 -1.796) 9.308 4.058 ( 4.918 6.821 -2.958) 8.914 4.303 ( -0.003 -0.675 1.160) 1.342 4.518 ( 7.149 -4.885 3.027) 9.173 4.600 ( 6.732 -2.676 2.689) 7.727 5.086 ( -2.194 -2.297 -1.368) 3.459 5.175 ( -2.732 -1.800 3.188) 4.568 5.251 ( -1.621 -5.594 2.608) 6.381 5.289 ( -6.764 -2.917 -1.262) 7.474 5.838 ( 1.349 -10.982 -7.449) 13.339 6.583 ( 12.621 -8.155 -2.091) 15.172 6.795 ( 5.423 -13.321 -0.587) 14.395 7.819 ( -5.443 3.449 4.283) 7.737 8.457 ( 11.126 5.291 5.458) 13.474 8.553 ( -1.995 3.294 3.469) 5.182 9.163 ( -15.264 -4.820 -13.659) 21.042 25.936 ( 0.236 39.917 -0.124) 39.918 26.254 ( 3.774 38.534 -2.770) 38.817 27.736 ( -0.710 10.636 1.260) 10.734 27.989 ( 0.458 15.509 -1.582) 15.596 29.501 ( -2.202 -8.431 5.808) 10.472 30.060 ( 1.015 -8.958 -2.149) 9.268 33.269 ( 0.289 -42.109 1.357) 42.132 33.639 ( 1.505 -45.638 -1.584) 45.690 94.721 ( 0.554 18.007 0.805) 18.034 95.549 ( 14.083 11.177 -5.591) 18.829 96.899 ( -2.242 -9.351 1.982) 9.818 97.021 ( -6.817 -11.660 -4.657) 14.287 ======================= Grid point 183 (83/252) ======================= q-point: ( 0.00 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( -1.625 24.280 -2.156) 24.429 2.453 ( -2.704 28.002 -0.836) 28.145 2.683 ( -0.874 5.721 -10.757) 12.215 3.073 ( 1.477 -0.803 6.047) 6.277 3.244 ( -1.881 7.211 -5.093) 9.026 3.323 ( 2.634 21.592 9.509) 23.740 3.344 ( -2.499 12.976 5.334) 14.251 3.552 ( 3.463 3.971 7.986) 9.568 4.070 ( -3.762 3.045 -3.144) 5.772 4.257 ( 5.689 2.796 3.749) 7.365 4.363 ( -3.282 6.136 1.476) 7.113 4.409 ( -2.461 -9.323 -3.139) 10.141 4.631 ( -1.447 1.731 1.356) 2.633 4.975 ( -1.029 -7.518 4.857) 9.009 5.108 ( -1.233 -2.544 0.359) 2.849 5.115 ( -0.794 -3.561 -0.230) 3.656 5.223 ( 2.422 -0.891 1.884) 3.196 5.622 ( 1.114 -8.042 -7.338) 10.943 6.426 ( 5.961 -20.910 -0.281) 21.745 6.642 ( -4.580 -8.050 -3.513) 9.906 7.850 ( -3.384 5.384 3.386) 7.204 8.536 ( -3.484 0.364 -1.926) 3.997 8.631 ( -6.459 5.440 -1.358) 8.553 8.979 ( 13.550 -3.645 -2.624) 14.275 26.812 ( 0.407 49.270 0.488) 49.274 27.088 ( -0.227 46.894 -3.214) 47.004 27.965 ( -0.781 13.194 1.716) 13.328 28.312 ( 0.734 17.848 -2.149) 17.992 29.321 ( -1.668 -10.492 5.048) 11.762 29.869 ( 1.173 -11.361 -1.690) 11.545 32.373 ( 0.157 -51.528 1.685) 51.556 32.665 ( 0.008 -54.850 -1.577) 54.873 95.106 ( 0.280 19.355 2.104) 19.471 95.778 ( -1.259 8.754 -7.098) 11.340 96.674 ( -1.177 -11.364 0.612) 11.441 96.772 ( 2.648 -11.294 -0.103) 11.601 ======================= Grid point 184 (84/252) ======================= q-point: ( 0.10 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( -5.344 26.101 -6.631) 27.456 2.412 ( -2.288 21.681 8.218) 23.299 2.627 ( 1.326 10.776 -6.255) 12.530 3.005 ( -4.655 6.700 -8.840) 12.030 3.240 ( 0.321 -2.116 2.729) 3.469 3.289 ( -5.230 11.855 4.307) 13.654 3.588 ( 10.341 8.115 9.392) 16.156 3.736 ( 10.481 15.849 9.691) 21.330 3.879 ( -12.580 -2.596 -6.427) 14.364 4.266 ( -5.176 -4.853 5.964) 9.269 4.320 ( -5.819 6.277 -2.997) 9.069 4.398 ( 6.115 5.272 1.033) 8.139 4.586 ( -3.659 2.268 0.439) 4.327 4.995 ( -1.198 -8.108 6.468) 10.441 5.092 ( 0.569 -1.217 -1.661) 2.136 5.115 ( -0.867 -5.454 1.073) 5.626 5.321 ( 5.666 -1.534 1.288) 6.010 5.590 ( 1.638 -7.461 -7.952) 11.027 6.381 ( -16.185 -9.336 -6.484) 19.778 6.530 ( 1.250 -21.420 2.368) 21.587 7.804 ( -3.287 6.963 0.958) 7.759 8.494 ( 3.503 4.794 -2.432) 6.416 8.532 ( -3.377 6.098 0.121) 6.972 9.270 ( 16.071 -7.712 -1.925) 17.929 26.823 ( 0.231 49.267 0.965) 49.277 27.036 ( -2.485 47.482 -3.789) 47.698 27.964 ( -0.600 13.227 1.686) 13.347 28.311 ( 0.862 17.852 -2.156) 18.002 29.327 ( -1.550 -10.406 4.940) 11.623 29.880 ( 1.166 -11.195 -1.449) 11.349 32.384 ( -0.410 -51.526 2.228) 51.575 32.638 ( -1.512 -55.240 -2.075) 55.300 95.123 ( -0.384 19.262 2.943) 19.489 95.632 ( -7.605 12.638 -7.521) 16.557 96.661 ( -0.474 -11.132 -0.171) 11.143 96.859 ( 5.848 -14.344 0.203) 15.492 ======================= Grid point 185 (85/252) ======================= q-point: ( 0.20 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.016 ( 0.600 19.900 -0.922) 19.930 2.474 ( 1.293 19.310 10.236) 21.894 2.615 ( 0.217 14.634 -4.601) 15.342 2.899 ( 2.639 5.003 -10.643) 12.053 3.213 ( -6.562 12.157 4.536) 14.540 3.249 ( -1.413 -1.573 2.479) 3.258 3.526 ( -14.654 -7.324 -8.271) 18.352 3.746 ( -1.295 -4.304 8.799) 9.880 4.061 ( 12.799 20.897 4.614) 24.935 4.167 ( -8.064 5.779 -1.434) 10.024 4.272 ( 0.925 -0.276 7.495) 7.557 4.489 ( 0.131 3.333 1.928) 3.852 4.521 ( -0.256 2.922 -1.536) 3.311 5.016 ( -1.923 -9.072 7.451) 11.896 5.098 ( -0.260 -3.811 0.578) 3.864 5.108 ( 0.595 -1.197 -0.258) 1.361 5.402 ( 2.182 -2.326 -0.220) 3.197 5.578 ( 2.891 -6.880 -7.657) 10.692 5.970 ( -20.184 -6.958 -8.761) 23.077 6.558 ( -1.532 -22.858 4.642) 23.374 7.768 ( -0.427 9.907 -0.171) 9.918 8.493 ( -0.418 7.769 -1.083) 7.855 8.634 ( 10.489 3.839 1.585) 11.281 9.480 ( 9.260 -8.161 -4.547) 13.153 26.830 ( -0.257 48.998 0.920) 49.008 26.958 ( -3.038 48.206 -3.155) 48.404 27.967 ( -0.455 13.264 1.727) 13.384 28.314 ( 1.085 17.893 -2.067) 18.045 29.333 ( -1.463 -10.428 4.544) 11.468 29.889 ( 0.902 -11.017 -1.550) 11.162 32.388 ( -0.919 -51.548 2.362) 51.610 32.585 ( -2.433 -55.746 -2.306) 55.846 95.131 ( -1.143 19.134 3.148) 19.425 95.440 ( -7.711 16.419 -5.620) 18.990 96.655 ( 0.022 -11.106 -0.442) 11.115 96.959 ( 4.942 -17.386 -0.648) 18.087 ======================= Grid point 186 (86/252) ======================= q-point: ( 0.30 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.118 ( 8.571 10.135 4.499) 14.015 2.568 ( 1.881 11.321 -3.533) 12.008 2.594 ( 3.094 18.396 4.785) 19.258 2.952 ( 6.483 6.657 -3.446) 9.911 3.116 ( -7.343 9.705 3.661) 12.708 3.187 ( -8.443 -4.286 -1.975) 9.672 3.275 ( -4.728 -3.126 -2.352) 6.136 3.703 ( -8.473 -3.256 5.834) 10.790 4.020 ( -5.393 3.231 -2.243) 6.675 4.207 ( 2.641 3.087 3.272) 5.216 4.382 ( -0.301 7.520 5.937) 9.586 4.412 ( -2.441 5.784 -4.220) 7.564 4.587 ( 3.123 0.860 3.104) 4.486 5.031 ( -3.250 -8.956 8.528) 12.787 5.107 ( 1.139 -3.462 1.097) 3.806 5.116 ( 0.380 -1.564 -0.206) 1.623 5.365 ( -5.226 -4.797 -2.749) 7.608 5.587 ( 2.889 -6.273 -5.626) 8.907 5.641 ( -7.305 1.567 -6.082) 9.633 6.531 ( -4.058 -23.261 1.777) 23.680 7.794 ( 2.492 11.617 1.862) 12.026 8.501 ( 1.906 7.925 -0.731) 8.183 8.847 ( 10.428 3.214 2.065) 11.105 9.548 ( 2.968 -6.490 -6.237) 9.478 26.820 ( -1.250 48.370 -0.211) 48.387 26.898 ( -1.634 48.738 -1.199) 48.780 27.972 ( -0.418 13.280 1.788) 13.406 28.321 ( 1.200 18.013 -1.982) 18.161 29.337 ( -1.442 -10.566 4.073) 11.415 29.890 ( 0.602 -10.911 -1.889) 11.090 32.384 ( -1.223 -51.570 2.017) 51.624 32.525 ( -2.245 -56.123 -2.104) 56.208 95.125 ( -1.661 19.048 2.601) 19.296 95.289 ( -5.203 18.411 -3.549) 19.458 96.656 ( 0.310 -11.353 -0.001) 11.357 97.026 ( 3.237 -19.188 -1.276) 19.501 ======================= Grid point 187 (87/252) ======================= q-point: ( 0.40 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.331 ( 8.522 1.565 5.245) 10.128 2.601 ( 8.322 5.238 -9.433) 13.626 2.704 ( 2.383 19.725 6.558) 20.923 2.945 ( -6.431 -3.922 -1.393) 7.660 2.991 ( -7.048 8.680 5.476) 12.450 3.101 ( -2.602 2.470 3.102) 4.743 3.249 ( 3.043 2.697 -1.711) 4.412 3.567 ( -8.622 1.002 3.658) 9.420 3.961 ( 0.548 -1.129 -1.450) 1.918 4.259 ( -7.283 -0.822 3.004) 7.920 4.289 ( 2.584 4.586 0.213) 5.268 4.368 ( -4.113 2.354 -3.260) 5.752 4.632 ( -0.848 -0.500 3.110) 3.262 4.989 ( -5.598 -9.872 6.042) 12.857 5.129 ( 1.627 -2.271 0.655) 2.870 5.156 ( 0.212 -5.810 2.193) 6.214 5.309 ( 3.088 4.324 -1.421) 5.500 5.506 ( -4.076 7.061 -3.363) 8.819 5.642 ( 4.285 -8.084 -4.464) 10.181 6.444 ( -4.406 -21.945 -3.251) 22.617 7.868 ( 2.474 11.943 4.661) 13.057 8.547 ( 2.571 6.899 1.871) 7.597 9.003 ( 5.457 3.654 -1.063) 6.653 9.532 ( 0.966 -4.931 -5.719) 7.613 26.795 ( -0.795 48.029 -0.454) 48.038 26.876 ( -0.630 48.734 -0.232) 48.739 27.976 ( -0.504 13.254 1.841) 13.391 28.328 ( 1.051 18.113 -1.980) 18.252 29.338 ( -1.480 -10.734 3.695) 11.448 29.885 ( 0.516 -10.893 -2.285) 11.142 32.373 ( -1.275 -51.591 1.305) 51.624 32.482 ( -0.896 -56.299 -1.521) 56.326 95.109 ( -1.717 19.033 1.562) 19.174 95.205 ( -1.945 19.130 -1.923) 19.325 96.666 ( 0.416 -11.792 0.997) 11.841 97.060 ( 1.728 -20.059 -1.688) 20.204 ======================= Grid point 188 (88/252) ======================= q-point: (-0.50 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.370 ( -7.582 0.050 -1.289) 7.691 2.724 ( 0.559 14.030 -0.191) 14.043 2.731 ( 7.936 5.794 -4.779) 10.927 2.923 ( 3.275 -2.519 2.491) 4.824 2.964 ( -0.547 10.455 10.462) 14.801 3.007 ( -7.670 -2.518 3.585) 8.834 3.357 ( 7.643 6.954 -0.279) 10.337 3.470 ( -5.557 0.909 4.412) 7.154 4.001 ( 3.586 -3.459 -1.345) 5.161 4.121 ( -6.902 1.813 1.521) 7.297 4.255 ( -1.454 6.294 -3.919) 7.555 4.418 ( 6.414 -1.155 1.053) 6.602 4.608 ( -3.629 -0.643 2.862) 4.666 4.956 ( -2.603 -10.865 5.831) 12.602 5.139 ( -1.273 -3.336 0.051) 3.571 5.168 ( 0.412 -4.545 2.165) 5.052 5.349 ( -1.381 5.092 -1.923) 5.615 5.469 ( 4.256 7.361 -0.376) 8.512 5.672 ( 2.214 -8.507 -3.877) 9.608 6.347 ( -1.773 -19.545 -7.529) 21.020 7.930 ( -0.113 11.248 6.658) 13.072 8.610 ( 1.237 5.275 5.174) 7.492 9.003 ( -2.709 5.061 -6.004) 8.307 9.536 ( 3.355 -4.713 -3.888) 6.970 26.793 ( 0.637 47.971 0.319) 47.976 26.866 ( -0.033 48.660 -0.519) 48.662 27.979 ( -0.666 13.200 1.896) 13.352 28.330 ( 0.730 18.071 -2.035) 18.199 29.335 ( -1.569 -10.836 3.484) 11.490 29.878 ( 0.650 -10.934 -2.611) 11.260 32.358 ( -1.053 -51.625 0.503) 51.638 32.475 ( 1.062 -56.272 -0.814) 56.288 95.088 ( -1.268 19.075 0.468) 19.123 95.192 ( 1.521 19.179 -0.685) 19.252 96.684 ( 0.296 -12.254 2.068) 12.431 97.065 ( 0.351 -20.249 -2.135) 20.365 ======================= Grid point 189 (89/252) ======================= q-point: (-0.40 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.147 ( -11.334 7.765 -4.213) 14.371 2.637 ( -8.698 18.104 5.616) 20.855 2.820 ( -3.120 2.729 0.056) 4.145 2.948 ( 7.766 -0.426 -1.604) 7.941 3.072 ( 5.599 5.521 5.297) 9.481 3.110 ( 8.160 0.718 6.082) 10.203 3.393 ( -3.088 -0.715 1.233) 3.401 3.495 ( 3.860 -0.034 4.379) 5.838 4.003 ( -1.911 2.229 0.342) 2.956 4.100 ( 3.459 -0.550 -0.397) 3.525 4.261 ( 2.370 10.930 -1.375) 11.268 4.453 ( -0.422 2.930 -7.605) 8.160 4.573 ( -4.000 2.524 3.886) 6.121 4.967 ( -1.858 -11.957 7.382) 14.174 5.118 ( -1.505 -2.963 0.286) 3.336 5.173 ( 0.108 -2.439 1.875) 3.078 5.345 ( 3.203 -3.030 0.406) 4.428 5.583 ( 7.736 2.371 0.727) 8.124 5.679 ( 1.528 -6.587 -2.655) 7.264 6.278 ( 1.074 -17.434 -10.499) 20.379 7.960 ( -2.257 9.415 8.477) 12.868 8.649 ( -1.837 4.632 6.780) 8.413 8.853 ( -7.181 6.180 -8.074) 12.448 9.571 ( 2.753 -5.691 -4.663) 7.856 26.808 ( 0.327 48.253 0.056) 48.254 26.881 ( 2.343 48.564 -0.065) 48.621 27.978 ( -0.831 13.150 1.958) 13.321 28.326 ( 0.489 17.895 -2.061) 18.020 29.330 ( -1.688 -10.836 3.482) 11.506 29.873 ( 0.798 -11.019 -2.812) 11.400 32.344 ( -0.573 -51.665 -0.067) 51.668 32.507 ( 2.760 -56.065 -0.298) 56.133 95.072 ( -0.543 19.143 -0.259) 19.153 95.251 ( 5.168 18.653 0.235) 19.357 96.703 ( -0.177 -12.558 2.697) 12.846 97.042 ( -1.068 -19.754 -2.718) 19.969 ======================= Grid point 190 (90/252) ======================= q-point: (-0.30 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.981 ( -2.701 17.537 -3.261) 18.041 2.517 ( -9.004 19.219 7.078) 22.372 2.767 ( -1.947 4.118 2.626) 5.258 3.095 ( 6.211 -0.023 -4.432) 7.630 3.165 ( 1.172 3.507 1.650) 4.049 3.223 ( 1.155 9.260 6.265) 11.240 3.476 ( 9.440 -6.322 5.109) 12.458 3.567 ( 2.273 -5.584 3.884) 7.172 3.990 ( 0.327 5.608 -1.902) 5.931 4.178 ( -3.497 12.113 -1.477) 12.694 4.202 ( -1.256 7.809 -0.872) 7.957 4.405 ( 1.953 4.741 -7.053) 8.720 4.503 ( -3.070 3.737 2.261) 5.338 4.974 ( -2.599 -10.538 6.323) 12.561 5.104 ( -0.267 -3.137 1.421) 3.455 5.194 ( -0.458 -3.549 2.042) 4.120 5.406 ( 1.362 -3.781 -0.377) 4.037 5.674 ( 0.684 -8.891 -2.372) 9.228 5.842 ( 18.058 -3.497 4.665) 18.976 6.244 ( 3.979 -16.614 -11.074) 20.360 7.969 ( -3.678 6.965 9.149) 12.073 8.619 ( -6.299 9.305 1.216) 11.302 8.684 ( -4.800 2.586 -1.934) 5.785 9.540 ( -2.302 -7.199 -7.248) 10.472 26.805 ( -0.126 48.754 -0.650) 48.759 26.946 ( 4.283 48.234 0.453) 48.425 27.976 ( -0.944 13.132 1.988) 13.315 28.320 ( 0.476 17.735 -2.027) 17.857 29.323 ( -1.787 -10.766 3.734) 11.535 29.868 ( 0.829 -11.153 -2.836) 11.538 32.338 ( 0.032 -51.676 -0.170) 51.676 32.564 ( 3.457 -55.704 -0.192) 55.811 95.066 ( 0.131 19.227 -0.391) 19.231 95.382 ( 8.794 17.078 0.650) 19.220 96.712 ( -0.883 -12.577 2.665) 12.887 96.987 ( -2.776 -18.337 -3.385) 18.852 ======================= Grid point 191 (91/252) ======================= q-point: (-0.20 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.022 ( 8.654 25.528 -2.057) 27.033 2.423 ( -6.775 21.290 7.944) 23.712 2.798 ( 2.562 3.429 3.726) 5.675 3.003 ( -4.825 -0.624 -9.819) 10.958 3.263 ( 3.218 6.758 5.132) 9.075 3.311 ( 3.392 7.256 4.995) 9.440 3.505 ( -4.758 -0.843 2.613) 5.494 3.796 ( -12.438 17.187 -5.760) 21.983 3.821 ( 10.288 0.214 4.104) 11.079 4.071 ( 0.910 2.319 1.725) 3.030 4.309 ( 5.112 4.359 0.696) 6.754 4.386 ( 0.938 5.962 -4.046) 7.266 4.525 ( 2.381 2.289 2.643) 4.230 4.969 ( -2.219 -9.272 5.077) 10.801 5.121 ( 0.305 -4.438 2.248) 4.984 5.181 ( -1.927 -3.066 1.501) 3.920 5.373 ( -4.283 -2.557 -1.537) 5.220 5.658 ( 0.508 -9.166 -4.010) 10.018 6.188 ( 12.281 -10.319 -3.629) 16.446 6.328 ( 14.486 -14.761 -0.398) 20.685 7.948 ( -5.115 5.318 7.407) 10.456 8.510 ( -1.773 9.849 -2.416) 10.295 8.632 ( -3.700 1.683 4.211) 5.853 9.371 ( -9.572 -7.349 -10.159) 15.774 26.801 ( 0.134 49.047 -0.579) 49.051 27.028 ( 4.253 47.682 -0.280) 47.872 27.972 ( -0.978 13.146 1.939) 13.324 28.316 ( 0.606 17.714 -2.002) 17.837 29.318 ( -1.815 -10.680 4.223) 11.627 29.863 ( 0.843 -11.311 -2.614) 11.640 32.343 ( 0.481 -51.638 0.219) 51.640 32.622 ( 2.957 -55.244 -0.490) 55.325 95.071 ( 0.556 19.312 0.085) 19.320 95.568 ( 11.043 13.787 -0.115) 17.664 96.708 ( -1.405 -12.306 2.146) 12.570 96.894 ( -4.501 -15.593 -3.729) 16.653 ======================= Grid point 192 (92/252) ======================= q-point: (-0.10 0.31 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.184 ( 6.815 25.719 -1.603) 26.655 2.415 ( 1.939 26.754 5.135) 27.311 2.800 ( -2.588 1.203 -11.507) 11.856 2.952 ( 4.073 -0.443 6.102) 7.350 3.313 ( -1.332 10.712 3.364) 11.307 3.367 ( -4.228 13.080 2.287) 13.935 3.404 ( -8.887 13.143 -1.794) 15.967 3.490 ( -5.581 8.332 5.811) 11.591 4.075 ( 6.977 2.116 -0.866) 7.342 4.132 ( 4.383 0.351 3.724) 5.762 4.332 ( 2.159 1.842 -1.662) 3.289 4.441 ( 1.867 0.544 1.543) 2.482 4.594 ( 3.050 1.337 2.360) 4.082 4.967 ( -1.638 -8.136 4.459) 9.421 5.126 ( -1.581 -5.133 1.398) 5.550 5.161 ( -1.661 -2.476 1.479) 3.328 5.247 ( -6.193 -0.844 -1.868) 6.523 5.644 ( 1.483 -8.656 -5.712) 10.476 6.310 ( 8.338 -17.933 -5.294) 20.473 6.603 ( 9.593 -9.479 1.696) 13.592 7.895 ( -4.926 5.260 4.745) 8.628 8.569 ( 7.989 4.977 1.489) 9.530 8.593 ( -3.409 1.741 3.018) 4.874 9.075 ( -12.816 -4.179 -11.354) 17.624 26.803 ( 0.375 49.188 -0.112) 49.190 27.084 ( 2.521 47.017 -1.772) 47.118 27.968 ( -0.921 13.170 1.823) 13.328 28.314 ( 0.698 17.794 -2.059) 17.926 29.317 ( -1.766 -10.595 4.760) 11.749 29.863 ( 0.986 -11.407 -2.167) 11.653 32.357 ( 0.526 -51.573 0.927) 51.584 32.659 ( 1.630 -54.865 -1.008) 54.898 95.086 ( 0.617 19.368 1.015) 19.405 95.745 ( 8.312 9.546 -3.134) 13.040 96.693 ( -1.558 -11.856 1.447) 12.045 96.791 ( -3.444 -12.031 -2.567) 12.775 ======================= Grid point 193 (93/252) ======================= q-point: ( 0.00 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.636 ( 0.445 18.823 -2.707) 19.022 2.750 ( -0.538 7.957 -6.207) 10.106 2.981 ( 2.435 9.027 3.562) 10.005 3.061 ( -2.491 11.292 0.591) 11.578 3.366 ( -4.329 4.254 -4.213) 7.388 3.469 ( -0.916 1.725 -1.371) 2.386 3.559 ( -0.167 4.904 2.740) 5.620 3.835 ( 7.660 19.061 9.446) 22.610 4.091 ( -10.526 -2.153 -2.826) 11.109 4.202 ( -2.708 -5.642 4.086) 7.474 4.326 ( 6.536 2.906 3.017) 7.763 4.486 ( 2.212 3.753 0.422) 4.377 4.646 ( -1.477 -1.843 3.139) 3.928 4.812 ( -1.218 -8.387 6.562) 10.719 5.043 ( -0.947 -1.981 1.177) 2.491 5.085 ( -1.165 -1.888 -0.881) 2.387 5.277 ( 0.544 8.407 -0.978) 8.481 5.512 ( 1.669 -2.773 -6.356) 7.132 6.033 ( 4.906 -18.935 -1.431) 19.612 6.390 ( -4.629 -17.624 -4.555) 18.783 7.999 ( -2.654 9.685 3.375) 10.594 8.506 ( -2.142 -3.784 -0.183) 4.353 8.734 ( -1.781 4.993 -1.349) 5.470 8.921 ( 8.121 -2.403 -4.120) 9.418 27.834 ( 0.478 55.761 0.393) 55.765 28.065 ( -0.193 53.170 -2.559) 53.232 28.239 ( -1.023 15.151 2.196) 15.343 28.668 ( 0.850 18.786 -2.512) 18.972 29.097 ( -1.476 -12.389 4.849) 13.386 29.626 ( 1.275 -13.661 -1.566) 13.810 31.309 ( 0.317 -57.705 1.353) 57.722 31.545 ( -0.298 -60.081 -1.307) 60.096 95.477 ( 0.149 18.822 1.915) 18.919 95.949 ( -0.594 9.105 -3.926) 9.934 96.433 ( -0.798 -13.540 0.703) 13.582 96.551 ( 1.351 -11.360 -0.487) 11.450 ======================= Grid point 194 (94/252) ======================= q-point: ( 0.10 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.571 ( -5.953 22.367 -7.327) 24.278 2.725 ( 2.179 10.449 -1.632) 10.798 2.920 ( -3.886 19.017 4.647) 19.958 3.097 ( -0.192 -0.048 1.355) 1.369 3.232 ( -4.436 3.938 -3.873) 7.084 3.437 ( -2.514 0.833 -2.089) 3.373 3.587 ( -0.522 -1.621 5.330) 5.596 3.763 ( -16.660 -6.989 -5.613) 18.919 4.143 ( 12.585 16.796 6.861) 22.081 4.194 ( -1.033 0.952 9.808) 9.908 4.442 ( 2.309 5.524 -0.379) 5.999 4.528 ( 1.246 5.813 -0.257) 5.950 4.610 ( -3.622 -0.520 1.903) 4.124 4.826 ( -2.456 -8.346 6.571) 10.903 5.038 ( -0.542 -1.660 1.413) 2.247 5.068 ( 0.141 -1.348 -0.265) 1.381 5.310 ( 3.445 1.528 -0.403) 3.790 5.496 ( 1.854 -1.566 -6.522) 6.958 6.101 ( 1.226 -19.275 1.222) 19.353 6.147 ( -14.399 -17.232 -8.288) 23.937 7.983 ( -1.156 10.939 1.812) 11.149 8.499 ( 1.958 -2.716 -0.564) 3.395 8.699 ( 0.981 8.842 -1.416) 9.008 9.120 ( 13.086 -7.427 -2.418) 15.240 27.845 ( 0.185 55.762 0.858) 55.769 28.022 ( -2.074 53.828 -3.243) 53.966 28.238 ( -0.812 14.824 2.281) 15.020 28.666 ( 0.920 18.563 -2.497) 18.752 29.104 ( -1.492 -12.308 4.808) 13.298 29.641 ( 1.320 -13.437 -1.303) 13.565 31.321 ( -0.298 -57.681 1.943) 57.715 31.511 ( -2.052 -60.357 -1.886) 60.421 95.491 ( -0.477 18.500 2.564) 18.683 95.867 ( -4.569 11.804 -4.497) 13.432 96.424 ( -0.515 -13.267 0.275) 13.280 96.589 ( 2.712 -13.493 -0.240) 13.765 ======================= Grid point 195 (95/252) ======================= q-point: ( 0.20 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( -6.370 18.786 -4.132) 20.262 2.791 ( 3.265 12.622 2.694) 13.313 2.913 ( -3.069 14.977 0.205) 15.290 3.034 ( 0.871 9.555 -2.338) 9.876 3.204 ( -1.733 -2.810 1.122) 3.487 3.293 ( -10.010 -8.253 -7.961) 15.221 3.459 ( -9.017 3.657 1.176) 9.801 3.644 ( -2.240 -6.082 7.573) 9.967 4.171 ( -4.063 0.205 8.581) 9.497 4.325 ( -7.115 8.281 -3.459) 11.452 4.459 ( 7.729 10.362 1.477) 13.011 4.565 ( 1.773 3.044 0.877) 3.630 4.568 ( -2.166 3.567 1.584) 4.463 4.830 ( -1.710 -9.115 6.934) 11.579 5.042 ( -0.573 -1.585 2.016) 2.628 5.081 ( 0.251 -1.649 1.475) 2.227 5.358 ( 0.989 -1.450 -1.136) 2.091 5.492 ( 2.428 -1.192 -6.188) 6.753 5.802 ( -12.422 -10.207 -7.895) 17.911 6.129 ( -0.883 -20.888 1.674) 20.974 7.990 ( 1.133 12.485 0.885) 12.567 8.544 ( 2.812 -2.361 -0.550) 3.712 8.772 ( 7.478 9.692 -0.155) 12.243 9.307 ( 9.297 -9.179 -3.712) 13.582 27.848 ( -0.616 55.567 0.658) 55.574 27.956 ( -2.574 54.382 -2.756) 54.513 28.241 ( -0.674 14.841 2.374) 15.045 28.669 ( 1.289 18.469 -2.341) 18.661 29.109 ( -1.558 -12.427 4.428) 13.284 29.653 ( 0.995 -13.292 -1.495) 13.413 31.325 ( -0.817 -57.662 2.120) 57.707 31.450 ( -2.988 -60.746 -2.075) 60.854 95.495 ( -1.121 18.258 2.701) 18.491 95.744 ( -5.238 15.160 -3.751) 16.472 96.418 ( -0.317 -13.260 0.099) 13.264 96.633 ( 2.273 -16.215 -0.572) 16.384 ======================= Grid point 196 (96/252) ======================= q-point: ( 0.30 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.324 ( -0.065 11.029 0.914) 11.067 2.769 ( -2.808 9.408 -6.217) 11.621 2.919 ( 2.514 11.704 3.797) 12.559 2.991 ( -10.263 -6.097 -4.619) 12.800 3.106 ( 0.671 3.949 1.949) 4.454 3.235 ( 3.264 1.839 0.207) 3.752 3.341 ( -6.919 7.461 2.345) 10.442 3.636 ( -3.720 -3.446 5.755) 7.671 4.098 ( -8.596 4.564 -0.609) 9.751 4.202 ( -3.161 1.087 4.984) 6.001 4.488 ( -1.947 -1.299 -2.985) 3.793 4.515 ( -6.945 4.337 0.242) 8.192 4.594 ( 0.586 0.486 1.570) 1.745 4.845 ( -4.147 -9.869 7.228) 12.916 5.048 ( -0.214 -1.986 1.965) 2.802 5.084 ( -0.529 -1.895 1.353) 2.388 5.346 ( 2.059 3.107 -1.924) 4.195 5.502 ( 3.075 -1.523 -4.480) 5.643 5.654 ( -1.297 -1.017 -4.209) 4.520 6.100 ( -2.455 -20.657 -0.804) 20.818 8.041 ( 3.283 13.427 1.850) 13.946 8.590 ( 2.567 0.141 -0.125) 2.574 8.934 ( 9.395 6.374 0.016) 11.353 9.398 ( 4.189 -8.382 -4.961) 10.603 27.827 ( -1.647 55.139 -0.525) 55.166 27.905 ( -1.469 54.790 -0.934) 54.818 28.246 ( -0.669 14.851 2.380) 15.055 28.679 ( 1.539 18.732 -2.252) 18.930 29.110 ( -1.600 -12.679 3.948) 13.376 29.655 ( 0.608 -13.334 -1.945) 13.489 31.321 ( -1.115 -57.640 1.783) 57.679 31.383 ( -2.672 -61.051 -1.765) 61.134 95.488 ( -1.513 18.216 2.256) 18.418 95.637 ( -3.893 17.576 -2.620) 18.192 96.415 ( -0.181 -13.479 0.311) 13.484 96.662 ( 1.464 -18.341 -0.867) 18.420 ======================= Grid point 197 (97/252) ======================= q-point: ( 0.40 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.373 ( 2.351 3.146 2.841) 4.848 2.717 ( 2.914 6.475 -7.083) 10.029 2.789 ( -5.886 -9.323 -2.911) 11.404 3.040 ( 4.382 13.131 5.717) 14.977 3.051 ( -6.228 -2.657 1.890) 7.030 3.226 ( -7.648 9.819 2.600) 12.715 3.362 ( 7.495 7.366 1.192) 10.576 3.592 ( -4.473 1.380 2.572) 5.341 3.968 ( -3.611 2.746 -0.597) 4.576 4.197 ( -3.854 -1.666 7.055) 8.209 4.336 ( -7.027 -3.062 -3.492) 8.423 4.432 ( -2.488 4.212 -0.710) 4.944 4.610 ( -0.432 -3.222 1.848) 3.739 4.786 ( -6.280 -9.616 6.349) 13.123 5.055 ( -0.386 -2.937 1.949) 3.546 5.094 ( 0.248 -2.595 1.108) 2.833 5.421 ( 5.796 5.402 -2.375) 8.271 5.535 ( 2.985 -1.663 -2.229) 4.080 5.613 ( -0.918 3.609 -3.602) 5.181 6.040 ( -1.902 -19.101 -4.081) 19.624 8.120 ( 2.826 13.670 3.544) 14.402 8.635 ( 1.856 1.300 1.439) 2.684 9.079 ( 6.289 4.260 -1.967) 7.846 9.406 ( 1.335 -7.175 -4.869) 8.773 27.797 ( -0.891 55.056 -0.451) 55.065 27.882 ( -0.753 54.688 -0.281) 54.694 28.249 ( -0.765 14.780 2.328) 14.982 28.690 ( 1.303 19.061 -2.381) 19.253 29.107 ( -1.579 -12.908 3.567) 13.484 29.649 ( 0.498 -13.475 -2.410) 13.698 31.310 ( -1.179 -57.717 1.021) 57.738 31.337 ( -1.152 -61.099 -1.036) 61.118 95.473 ( -1.508 18.389 1.425) 18.506 95.572 ( -1.560 18.780 -1.547) 18.908 96.417 ( -0.033 -13.877 0.854) 13.903 96.676 ( 0.801 -19.580 -1.082) 19.626 ======================= Grid point 198 (98/252) ======================= q-point: (-0.50 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.384 ( -3.205 1.804 0.539) 3.717 2.752 ( 3.548 -6.593 0.224) 7.490 2.781 ( 8.586 1.131 -5.633) 10.331 2.949 ( -5.602 -1.760 1.487) 6.058 3.103 ( -7.330 12.385 2.324) 14.578 3.171 ( 4.701 10.504 7.038) 13.490 3.461 ( 0.818 3.531 -0.238) 3.632 3.518 ( -3.531 4.045 1.500) 5.575 3.970 ( 2.687 1.398 1.987) 3.623 4.127 ( -5.867 0.534 4.377) 7.339 4.314 ( 4.561 -2.954 0.528) 5.459 4.426 ( 2.396 3.687 0.168) 4.401 4.595 ( -2.204 -2.728 0.493) 3.542 4.731 ( -4.066 -10.832 6.041) 13.053 5.063 ( -0.537 -2.987 2.598) 3.995 5.104 ( 0.164 -3.065 0.995) 3.226 5.458 ( -0.060 4.125 -4.860) 6.375 5.538 ( -1.058 -0.070 -2.290) 2.524 5.611 ( 3.563 3.216 -1.668) 5.081 5.986 ( 0.153 -17.095 -6.498) 18.289 8.175 ( -0.306 13.491 4.959) 14.377 8.675 ( 0.567 0.818 3.287) 3.434 9.100 ( -1.363 4.859 -5.275) 7.301 9.410 ( 2.664 -7.388 -3.596) 8.638 27.795 ( 0.665 55.092 0.372) 55.097 27.872 ( 0.013 54.660 -0.545) 54.663 28.250 ( -0.901 14.686 2.313) 14.894 28.691 ( 0.758 19.017 -2.617) 19.211 29.103 ( -1.540 -12.979 3.348) 13.492 29.641 ( 0.669 -13.552 -2.765) 13.847 31.294 ( -0.976 -57.682 0.180) 57.691 31.330 ( 0.962 -61.129 -0.222) 61.136 95.456 ( -1.105 18.678 0.542) 18.718 95.561 ( 1.182 18.903 -0.636) 18.950 96.425 ( 0.057 -14.357 1.456) 14.431 96.677 ( 0.257 -19.825 -1.322) 19.870 ======================= Grid point 199 (99/252) ======================= q-point: (-0.40 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.311 ( -2.803 9.009 -0.732) 9.463 2.866 ( -1.795 3.731 -0.706) 4.200 2.889 ( 8.119 -3.562 2.274) 9.153 2.945 ( 10.376 -3.834 -3.734) 11.675 3.005 ( -4.244 11.006 3.481) 12.299 3.300 ( 3.833 7.485 7.190) 11.064 3.384 ( -5.870 0.268 1.001) 5.960 3.494 ( -2.177 0.133 -0.587) 2.259 4.040 ( 0.086 2.706 3.556) 4.469 4.124 ( 4.813 3.687 3.759) 7.134 4.427 ( 4.783 5.526 0.904) 7.365 4.482 ( 2.806 0.548 -5.894) 6.551 4.595 ( 3.330 -2.037 4.366) 5.856 4.723 ( -2.134 -12.284 6.599) 14.107 5.068 ( -0.970 -1.978 2.536) 3.360 5.114 ( -0.479 -3.552 2.224) 4.218 5.375 ( -3.146 5.423 -3.754) 7.308 5.524 ( 1.345 -3.110 -3.139) 4.619 5.663 ( 3.029 0.125 -1.350) 3.318 5.951 ( 1.679 -15.767 -8.297) 17.896 8.180 ( -3.261 12.703 6.256) 14.530 8.694 ( -1.564 -0.473 4.112) 4.425 8.983 ( -6.120 7.064 -6.115) 11.169 9.426 ( 1.322 -8.526 -4.512) 9.737 27.815 ( 0.754 55.233 0.219) 55.239 27.885 ( 2.156 54.743 -0.212) 54.786 28.249 ( -1.013 14.675 2.397) 14.904 28.682 ( 0.427 18.613 -2.705) 18.813 29.098 ( -1.551 -12.919 3.297) 13.423 29.635 ( 0.822 -13.525 -2.989) 13.876 31.279 ( -0.506 -57.703 -0.439) 57.707 31.366 ( 2.812 -61.001 0.384) 61.067 95.443 ( -0.458 18.942 -0.049) 18.948 95.606 ( 3.928 18.011 0.046) 18.435 96.437 ( -0.073 -14.754 1.799) 14.863 96.666 ( -0.294 -19.029 -1.622) 19.100 ======================= Grid point 200 (100/252) ======================= q-point: (-0.30 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.324 ( 5.341 17.321 -0.342) 18.129 2.820 ( -2.646 9.774 -0.336) 10.132 2.910 ( -3.005 12.247 3.667) 13.132 3.079 ( 4.496 -2.842 -7.131) 8.896 3.137 ( 9.492 -3.483 2.924) 10.525 3.337 ( 3.479 -4.561 1.992) 6.072 3.418 ( 3.610 4.887 6.835) 9.145 3.452 ( -1.083 -5.626 1.951) 6.052 4.053 ( -0.943 4.037 4.872) 6.397 4.291 ( 8.832 6.848 2.282) 11.407 4.436 ( -1.919 7.695 -4.284) 9.014 4.500 ( 2.662 4.705 -4.285) 6.898 4.635 ( -2.967 7.383 0.417) 7.968 4.744 ( -1.775 -12.909 8.581) 15.602 5.061 ( -1.555 -1.427 2.850) 3.546 5.119 ( -0.786 -3.798 2.380) 4.550 5.357 ( 1.863 -0.356 -1.267) 2.281 5.533 ( 1.350 -4.523 -3.219) 5.713 5.748 ( 9.516 -6.631 0.756) 11.623 5.933 ( 3.115 -15.078 -8.889) 17.778 8.151 ( -4.864 11.293 6.806) 14.054 8.671 ( -3.907 -2.240 3.318) 5.594 8.825 ( -6.271 9.833 -4.647) 12.555 9.374 ( -3.193 -9.421 -6.538) 11.904 27.821 ( 0.258 55.627 -0.595) 55.630 27.945 ( 3.889 54.363 0.306) 54.502 28.248 ( -1.075 14.870 2.524) 15.121 28.672 ( 0.565 18.301 -2.568) 18.489 29.093 ( -1.593 -12.836 3.475) 13.393 29.628 ( 0.784 -13.523 -3.026) 13.879 31.272 ( 0.154 -57.793 -0.562) 57.796 31.430 ( 3.619 -60.682 0.513) 60.792 95.439 ( 0.156 19.126 -0.145) 19.127 95.700 ( 6.184 15.966 0.313) 17.125 96.446 ( -0.404 -14.864 1.763) 14.974 96.642 ( -1.021 -17.226 -1.934) 17.365 ======================= Grid point 201 (101/252) ======================= q-point: (-0.20 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.490 ( 12.153 22.005 -1.319) 25.173 2.776 ( -2.248 13.113 2.804) 13.596 2.910 ( -0.224 9.513 2.866) 9.938 2.991 ( -3.557 -0.155 -8.626) 9.332 3.296 ( 6.106 0.222 3.050) 6.829 3.449 ( 1.932 0.984 1.397) 2.580 3.465 ( 3.399 -2.253 2.009) 4.546 3.656 ( 15.549 -8.832 7.186) 19.272 4.072 ( -1.505 6.115 4.585) 7.789 4.252 ( -13.988 15.666 -3.691) 21.324 4.424 ( 3.962 6.049 -0.535) 7.251 4.489 ( 0.704 4.006 -4.630) 6.163 4.621 ( 0.362 6.550 2.533) 7.032 4.766 ( -1.564 -11.217 7.154) 13.396 5.058 ( -1.360 -2.079 3.062) 3.943 5.114 ( -1.102 -3.457 1.607) 3.968 5.346 ( -2.071 0.591 -1.535) 2.645 5.522 ( 1.306 -4.100 -4.737) 6.399 5.925 ( 4.800 -14.715 -7.908) 17.381 6.054 ( 17.247 -15.029 3.593) 23.157 8.101 ( -5.576 9.976 5.850) 12.839 8.602 ( -4.688 -2.367 1.156) 5.377 8.722 ( -2.669 9.117 -1.233) 9.580 9.218 ( -7.942 -8.207 -8.242) 14.085 27.821 ( 0.324 55.837 -0.656) 55.842 28.016 ( 3.613 53.549 -0.286) 53.672 28.246 ( -1.099 15.302 2.530) 15.548 28.668 ( 0.897 18.408 -2.393) 18.585 29.090 ( -1.592 -12.744 3.920) 13.428 29.622 ( 0.746 -13.636 -2.758) 13.932 31.277 ( 0.673 -57.813 -0.166) 57.818 31.496 ( 3.140 -60.320 0.142) 60.401 95.446 ( 0.521 19.185 0.263) 19.194 95.824 ( 6.987 12.816 -0.190) 14.598 96.447 ( -0.701 -14.600 1.484) 14.692 96.602 ( -1.765 -14.569 -2.073) 14.821 ======================= Grid point 202 (102/252) ======================= q-point: (-0.10 0.38 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.633 ( 3.222 20.091 -2.907) 20.554 2.827 ( -1.692 6.947 -4.553) 8.477 2.846 ( 5.685 6.299 0.551) 8.502 3.015 ( 4.774 12.720 3.980) 14.157 3.388 ( 2.122 -0.466 0.674) 2.275 3.506 ( 0.939 3.304 -2.124) 4.038 3.510 ( 2.486 3.496 4.014) 5.874 3.875 ( -11.990 17.339 -0.382) 21.084 4.020 ( 13.717 -6.728 4.042) 15.804 4.138 ( -1.760 4.751 6.946) 8.598 4.385 ( -4.968 3.993 -2.036) 6.691 4.496 ( -0.650 1.740 -2.593) 3.190 4.627 ( -0.299 0.434 2.876) 2.924 4.790 ( -1.242 -9.516 6.272) 11.465 5.052 ( -1.284 -2.066 2.292) 3.342 5.106 ( -0.791 -3.014 0.442) 3.147 5.295 ( -1.663 7.253 -1.119) 7.525 5.520 ( 2.067 -3.629 -5.563) 6.956 5.963 ( 5.182 -16.867 -5.592) 18.510 6.347 ( 10.355 -17.217 1.135) 20.123 8.039 ( -4.762 9.409 4.343) 11.404 8.547 ( -2.700 -4.194 1.713) 5.274 8.707 ( 2.052 6.612 -0.735) 6.962 9.000 ( -8.244 -3.737 -8.255) 12.251 27.825 ( 0.458 55.807 -0.230) 55.809 28.062 ( 2.010 52.868 -1.398) 52.924 28.243 ( -1.111 15.571 2.330) 15.783 28.669 ( 0.986 18.725 -2.398) 18.903 29.091 ( -1.529 -12.583 4.483) 13.445 29.619 ( 0.955 -13.744 -2.178) 13.948 31.292 ( 0.732 -57.761 0.563) 57.768 31.539 ( 1.647 -60.071 -0.549) 60.096 95.460 ( 0.520 19.080 1.037) 19.115 95.930 ( 4.782 9.659 -1.842) 10.934 96.442 ( -0.853 -14.086 1.138) 14.157 96.558 ( -1.234 -11.884 -1.559) 12.049 ======================= Grid point 203 (103/252) ======================= q-point: ( 0.00 0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.831 ( 2.666 5.717 -2.826) 6.912 2.930 ( 3.563 -4.487 1.792) 6.003 3.030 ( -0.603 16.259 -0.804) 16.290 3.296 ( -0.349 -10.015 -0.770) 10.051 3.427 ( -2.231 14.049 -0.931) 14.255 3.516 ( -1.883 2.069 -3.995) 4.878 3.637 ( -5.038 5.741 -1.716) 7.829 3.865 ( -9.404 -14.158 -4.048) 17.472 4.159 ( 7.526 12.265 5.980) 15.583 4.304 ( -2.456 8.419 6.714) 11.045 4.326 ( 6.449 -2.321 4.316) 8.100 4.503 ( -2.890 -7.421 5.545) 9.704 4.571 ( 1.147 2.040 2.732) 3.598 4.673 ( -0.539 -6.391 6.940) 9.449 5.027 ( -0.154 0.162 0.401) 0.459 5.046 ( -0.200 -1.703 -0.142) 1.721 5.518 ( 1.521 7.762 -5.950) 9.898 5.570 ( -0.901 15.069 -3.300) 15.452 5.722 ( 3.417 -11.396 -3.718) 12.464 5.994 ( -3.802 -22.061 -4.382) 22.812 8.201 ( -1.871 10.560 2.877) 11.104 8.387 ( -1.468 -8.217 1.798) 8.539 8.819 ( 1.334 3.724 -2.604) 4.737 8.877 ( 4.001 -2.382 -3.974) 6.121 28.527 ( -1.046 15.118 2.819) 15.414 28.802 ( -1.056 -10.223 1.585) 10.399 28.911 ( 1.298 43.122 -0.876) 43.151 29.044 ( 0.370 31.877 -2.244) 31.958 29.209 ( -1.055 51.741 -0.390) 51.753 29.352 ( 1.535 -10.862 0.013) 10.970 30.161 ( 0.417 -60.020 1.313) 60.036 30.364 ( -0.497 -61.144 -1.087) 61.156 95.829 ( -0.092 17.390 1.439) 17.450 96.126 ( -0.057 3.250 -1.894) 3.762 96.158 ( -0.415 -8.898 0.806) 8.944 96.336 ( 0.540 -10.776 -1.031) 10.838 ======================= Grid point 204 (104/252) ======================= q-point: ( 0.10 0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.890 ( 4.140 7.402 -0.191) 8.484 2.962 ( -5.305 17.793 -6.465) 19.660 3.019 ( 3.523 -5.676 2.631) 7.180 3.246 ( -4.176 -9.306 -4.398) 11.108 3.287 ( -8.337 16.814 3.094) 19.021 3.424 ( -5.945 5.061 -3.463) 8.541 3.536 ( -4.761 -4.591 -0.008) 6.614 3.580 ( -13.396 -12.171 -0.346) 18.102 4.284 ( -4.516 8.929 7.481) 12.493 4.401 ( 8.194 5.934 3.010) 10.556 4.489 ( 2.278 -2.585 3.256) 4.740 4.530 ( 6.064 -3.045 4.236) 7.999 4.614 ( 0.878 3.324 3.327) 4.784 4.702 ( -1.515 -5.063 5.713) 7.782 5.038 ( 0.190 0.505 1.408) 1.508 5.048 ( -0.165 -0.709 0.991) 1.229 5.444 ( -3.674 12.771 -5.165) 14.258 5.548 ( 1.785 6.957 -4.653) 8.558 5.750 ( 0.510 -15.981 -3.253) 16.317 5.803 ( -9.391 -17.349 -6.121) 20.655 8.203 ( 0.112 11.129 1.677) 11.255 8.393 ( 1.020 -8.035 0.814) 8.141 8.856 ( 5.004 7.295 -2.036) 9.077 8.987 ( 9.125 -6.493 -2.540) 11.484 28.529 ( -0.947 15.086 2.796) 15.373 28.793 ( -0.884 -6.484 1.257) 6.663 28.942 ( 2.331 43.333 -0.217) 43.396 29.025 ( -0.445 27.484 -2.586) 27.609 29.168 ( -2.963 50.178 -0.410) 50.267 29.380 ( 1.189 -8.820 0.207) 8.903 30.174 ( -0.284 -59.906 1.954) 59.939 30.326 ( -2.403 -61.227 -1.712) 61.298 95.835 ( -0.537 16.962 1.765) 17.062 96.092 ( -1.848 9.908 -2.461) 10.375 96.152 ( -0.783 -13.095 0.992) 13.156 96.336 ( 0.235 -12.650 -1.042) 12.695 ======================= Grid point 205 (105/252) ======================= q-point: ( 0.20 0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.735 ( -10.751 16.271 -5.963) 20.394 2.976 ( 2.867 7.363 -1.521) 8.047 3.008 ( -9.303 -9.730 -4.531) 14.203 3.109 ( -2.478 -6.824 -2.836) 7.794 3.246 ( -7.151 9.168 0.343) 11.632 3.264 ( 0.396 11.368 6.021) 12.870 3.448 ( -4.540 -4.904 0.906) 6.744 3.508 ( -0.696 -8.201 6.038) 10.208 4.248 ( -5.075 7.757 7.463) 11.901 4.413 ( -3.620 -6.449 2.164) 7.706 4.513 ( -5.344 6.944 -2.415) 9.089 4.620 ( 0.744 -0.461 -1.069) 1.381 4.646 ( -1.463 2.158 3.576) 4.425 4.698 ( -1.539 -4.034 3.708) 5.692 5.034 ( -1.459 0.511 2.682) 3.095 5.053 ( -1.019 -1.252 2.226) 2.750 5.397 ( 1.685 6.473 -2.527) 7.150 5.540 ( 0.635 3.390 -5.198) 6.238 5.598 ( -2.125 -7.425 -4.330) 8.854 5.774 ( 0.460 -15.159 -2.009) 15.298 8.231 ( 2.272 11.948 0.704) 12.183 8.434 ( 3.132 -8.538 0.103) 9.095 8.961 ( 7.325 9.362 -1.451) 11.975 9.134 ( 8.400 -8.722 -2.641) 12.393 28.532 ( -0.840 15.102 2.740) 15.371 28.789 ( -0.455 -3.270 1.093) 3.477 28.969 ( -0.401 49.923 -0.542) 49.927 29.014 ( 2.235 20.210 -2.021) 20.433 29.102 ( -3.980 48.193 -0.057) 48.357 29.394 ( 0.396 -9.273 -0.298) 9.286 30.178 ( -0.870 -59.983 2.072) 60.025 30.260 ( -3.304 -61.308 -1.805) 61.423 95.834 ( -0.936 16.712 1.826) 16.838 96.033 ( -2.634 14.383 -2.194) 14.786 96.145 ( -0.768 -14.505 0.890) 14.552 96.328 ( -0.261 -15.338 -1.103) 15.380 ======================= Grid point 206 (106/252) ======================= q-point: ( 0.30 0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.543 ( -6.635 11.444 -2.308) 13.428 2.765 ( -10.220 -11.319 -4.769) 15.979 2.934 ( -4.212 7.366 -3.906) 9.341 3.057 ( -3.959 -4.782 -0.836) 6.264 3.198 ( 0.069 10.293 3.260) 10.797 3.334 ( 0.446 -0.833 3.731) 3.848 3.423 ( 1.822 6.398 3.028) 7.309 3.561 ( 1.390 -5.319 4.942) 7.393 4.196 ( -6.301 6.807 3.859) 10.046 4.311 ( -8.719 7.780 1.135) 11.740 4.366 ( -6.150 -7.303 -0.445) 9.558 4.508 ( -9.951 -7.642 -0.469) 12.556 4.620 ( -2.113 3.000 0.683) 3.733 4.689 ( -2.709 -4.916 3.932) 6.853 5.032 ( -1.086 0.215 2.714) 2.931 5.049 ( -1.032 -1.451 2.523) 3.088 5.452 ( 5.101 6.728 -2.475) 8.799 5.534 ( 2.333 2.741 -3.799) 5.233 5.607 ( 3.341 -1.712 -2.353) 4.430 5.757 ( 0.095 -14.005 -3.349) 14.400 8.296 ( 3.995 12.478 1.122) 13.150 8.504 ( 4.067 -8.336 0.450) 9.286 9.081 ( 6.763 8.135 -1.735) 10.720 9.238 ( 5.171 -8.063 -3.335) 10.143 28.536 ( -0.803 15.165 2.686) 15.422 28.792 ( 0.014 -0.307 0.979) 1.026 28.938 ( -1.541 42.082 -1.159) 42.126 29.028 ( -3.688 48.318 0.618) 48.462 29.060 ( 2.988 26.313 -1.498) 26.524 29.390 ( -0.329 -10.639 -1.042) 10.695 30.165 ( -1.952 -61.276 0.480) 61.309 30.197 ( -2.086 -60.192 -0.224) 60.229 95.827 ( -1.129 16.737 1.589) 16.851 95.974 ( -2.187 17.254 -1.660) 17.471 96.137 ( -0.724 -15.053 0.837) 15.094 96.314 ( -0.416 -17.665 -1.058) 17.701 ======================= Grid point 207 (107/252) ======================= q-point: ( 0.40 0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.461 ( -2.174 6.024 0.452) 6.420 2.606 ( -4.558 -8.805 -1.514) 10.030 2.846 ( -1.551 6.505 -3.698) 7.642 2.963 ( -4.750 -5.416 -0.567) 7.226 3.244 ( 1.522 7.446 3.801) 8.498 3.324 ( -2.432 -0.261 1.933) 3.118 3.515 ( 3.875 7.371 2.028) 8.571 3.602 ( -0.135 -1.366 1.818) 2.278 4.068 ( -5.594 7.133 -0.747) 9.095 4.219 ( -6.540 -7.699 -2.630) 10.438 4.236 ( -4.546 6.085 6.874) 10.245 4.407 ( -3.540 -9.171 5.750) 11.389 4.569 ( -3.445 3.074 0.282) 4.625 4.654 ( -4.204 -4.986 4.417) 7.877 5.029 ( -0.894 0.095 2.009) 2.201 5.049 ( -0.548 -1.800 1.627) 2.488 5.498 ( 3.142 4.516 -5.437) 7.735 5.568 ( 2.869 1.140 -2.144) 3.759 5.648 ( 2.605 0.789 -2.286) 3.555 5.738 ( 0.704 -10.656 -4.407) 11.553 8.378 ( 3.244 12.420 2.290) 13.040 8.576 ( 2.847 -7.262 1.508) 7.944 9.171 ( 4.487 5.136 -2.776) 7.363 9.277 ( 2.150 -5.974 -3.751) 7.374 28.540 ( -0.900 15.169 2.646) 15.425 28.803 ( 0.379 0.207 0.982) 1.073 28.906 ( -1.117 42.575 -0.811) 42.598 28.976 ( -2.405 45.376 1.000) 45.450 29.098 ( 2.129 30.563 -1.888) 30.695 29.371 ( -0.434 -12.994 -1.758) 13.120 30.127 ( -1.381 -62.330 -0.410) 62.347 30.176 ( -1.087 -59.258 0.626) 59.271 95.817 ( -1.054 17.016 1.145) 17.087 95.935 ( -0.941 18.763 -1.142) 18.822 96.132 ( -0.533 -15.500 0.923) 15.537 96.301 ( -0.123 -19.077 -0.935) 19.100 ======================= Grid point 208 (108/252) ======================= q-point: (-0.50 0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.451 ( 0.129 5.185 1.317) 5.352 2.584 ( 2.276 -8.382 1.269) 8.778 2.841 ( 3.776 3.393 -3.265) 6.035 2.903 ( -1.072 -2.839 -0.533) 3.081 3.271 ( -3.104 5.487 3.630) 7.275 3.311 ( 0.814 2.160 2.576) 3.459 3.535 ( -3.222 4.055 -1.107) 5.296 3.573 ( -2.669 0.707 -1.114) 2.977 4.047 ( 2.532 5.920 2.507) 6.910 4.177 ( 2.105 -3.061 2.702) 4.594 4.217 ( -0.999 3.108 4.818) 5.820 4.414 ( -1.345 -11.752 6.674) 13.582 4.525 ( -0.702 4.308 -0.085) 4.365 4.610 ( -2.977 -3.982 2.740) 5.677 5.033 ( -0.489 -0.167 2.612) 2.663 5.053 ( -0.359 -2.013 1.544) 2.562 5.510 ( 2.673 4.158 -5.597) 7.467 5.584 ( 0.188 1.002 -2.280) 2.497 5.654 ( 0.176 0.759 -3.331) 3.421 5.715 ( 0.644 -9.272 -5.647) 10.876 8.430 ( 0.003 12.208 3.506) 12.702 8.620 ( 0.230 -6.684 2.709) 7.216 9.188 ( -0.019 4.341 -4.391) 6.175 9.281 ( 1.426 -5.602 -3.699) 6.863 28.540 ( -1.091 15.100 2.575) 15.356 28.815 ( -0.085 -6.473 1.293) 6.601 28.892 ( 0.251 48.128 -0.440) 48.131 28.961 ( 0.037 47.318 1.238) 47.334 29.105 ( 0.275 32.218 -2.532) 32.319 29.355 ( 0.292 -15.398 -2.318) 15.574 30.120 ( 0.539 -62.227 0.331) 62.231 30.161 ( -0.651 -59.459 -0.147) 59.463 95.806 ( -0.748 17.434 0.670) 17.463 95.926 ( 0.730 18.841 -0.700) 18.868 96.131 ( -0.276 -15.874 1.047) 15.911 96.298 ( 0.428 -19.298 -0.831) 19.321 ======================= Grid point 209 (109/252) ======================= q-point: (-0.40 0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.496 ( 4.291 10.112 1.677) 11.112 2.701 ( 8.733 -10.911 2.726) 14.239 2.916 ( 3.659 1.598 -1.920) 4.431 2.932 ( 7.735 -0.283 -3.052) 8.320 3.227 ( -3.983 9.215 3.623) 10.673 3.338 ( -1.225 -2.448 3.556) 4.488 3.420 ( -6.384 3.090 -1.566) 7.263 3.483 ( -5.196 -2.298 -3.114) 6.479 4.152 ( 2.445 9.443 6.812) 11.898 4.249 ( 6.263 8.619 3.974) 11.372 4.365 ( 9.882 -10.031 5.820) 15.237 4.438 ( 0.698 -10.675 2.446) 10.974 4.547 ( 2.300 3.508 0.717) 4.256 4.598 ( 0.554 -2.155 1.430) 2.645 5.043 ( -0.986 -0.438 3.634) 3.791 5.057 ( -0.782 -1.926 2.710) 3.416 5.502 ( -1.195 6.927 -5.984) 9.231 5.535 ( -0.775 3.874 -3.070) 5.003 5.630 ( -0.928 -3.383 -3.041) 4.643 5.685 ( 1.619 -11.277 -7.375) 13.571 8.427 ( -3.378 12.041 4.605) 13.327 8.620 ( -2.749 -7.242 3.553) 8.522 9.121 ( -3.295 7.109 -5.059) 9.327 9.264 ( -0.478 -7.883 -4.677) 9.178 28.537 ( -1.220 15.072 2.509) 15.328 28.815 ( -1.012 -9.701 1.725) 9.905 28.910 ( 1.877 49.494 -0.415) 49.531 28.995 ( 2.487 51.293 1.574) 51.377 29.074 ( -1.283 30.640 -2.980) 30.811 29.349 ( 0.946 -15.740 -2.737) 16.004 30.128 ( -0.228 -60.540 -0.407) 60.542 30.174 ( 2.473 -61.310 0.578) 61.362 95.800 ( -0.295 17.845 0.351) 17.851 95.952 ( 2.412 17.638 -0.335) 17.805 96.135 ( -0.125 -16.159 1.057) 16.194 96.305 ( 0.934 -18.305 -0.816) 18.347 ======================= Grid point 210 (110/252) ======================= q-point: (-0.30 0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.640 ( 10.107 15.105 1.277) 18.220 2.899 ( 8.532 -9.780 -0.870) 13.008 2.978 ( 6.095 3.791 -3.865) 8.152 3.057 ( 7.233 -1.920 -2.766) 7.979 3.191 ( -2.467 10.013 3.992) 11.058 3.287 ( -3.194 -1.132 2.719) 4.345 3.359 ( -1.105 -2.508 1.737) 3.245 3.413 ( 0.043 -5.225 1.176) 5.356 4.211 ( -0.634 11.881 8.335) 14.527 4.430 ( 8.238 6.170 -0.417) 10.301 4.464 ( 0.440 -10.745 3.400) 11.279 4.519 ( 2.454 -3.557 1.099) 4.459 4.594 ( 2.353 5.378 0.980) 5.951 4.685 ( 4.652 -2.545 3.424) 6.312 5.044 ( -1.868 -0.276 3.937) 4.367 5.060 ( -1.269 -2.046 3.201) 4.006 5.424 ( -1.043 7.171 -3.053) 7.863 5.528 ( 1.893 4.024 -5.412) 7.005 5.593 ( 1.537 -8.989 -2.400) 9.430 5.677 ( 2.754 -10.832 -7.205) 13.297 8.380 ( -5.328 11.566 5.064) 13.704 8.573 ( -5.001 -7.836 3.706) 10.008 9.011 ( -4.615 9.310 -5.061) 11.559 9.190 ( -3.622 -9.341 -5.875) 11.614 28.532 ( -1.221 15.089 2.546) 15.351 28.808 ( -1.061 -9.210 1.978) 9.479 28.944 ( 1.869 53.588 -0.561) 53.624 29.026 ( -1.130 22.102 -3.213) 22.363 29.067 ( 3.693 54.711 2.007) 54.873 29.346 ( 0.836 -15.003 -2.964) 15.316 30.121 ( 0.136 -60.443 -0.793) 60.448 30.239 ( 3.723 -61.544 0.978) 61.665 95.801 ( 0.126 18.108 0.315) 18.111 96.006 ( 3.593 15.492 -0.179) 15.904 96.140 ( -0.108 -16.354 0.959) 16.383 96.318 ( 1.105 -16.295 -0.921) 16.358 ======================= Grid point 211 (111/252) ======================= q-point: (-0.20 0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.823 ( 7.408 10.202 -2.239) 12.805 2.910 ( -0.741 0.442 -6.884) 6.938 3.022 ( 2.876 9.085 -5.189) 10.850 3.166 ( 2.858 10.936 7.737) 13.698 3.252 ( 5.692 -6.154 -1.071) 8.451 3.366 ( 8.663 -7.187 3.561) 11.806 3.419 ( 5.652 0.274 3.783) 6.806 3.502 ( 7.871 -7.215 5.570) 12.043 4.253 ( -1.185 12.136 7.907) 14.533 4.458 ( -3.715 1.752 -4.475) 6.075 4.499 ( 1.917 1.121 -3.427) 4.083 4.522 ( -3.369 -9.293 6.907) 12.059 4.588 ( -4.480 7.348 0.051) 8.607 4.702 ( -4.118 -1.982 1.763) 4.899 5.040 ( -1.125 0.214 3.060) 3.268 5.060 ( -0.794 -1.882 2.232) 3.025 5.447 ( 4.706 10.618 -0.350) 11.620 5.523 ( 2.237 4.432 -5.914) 7.721 5.668 ( 3.690 -11.248 -7.307) 13.912 5.739 ( 11.745 -16.538 1.979) 20.381 8.310 ( -5.883 10.914 4.385) 13.151 8.498 ( -5.643 -7.944 3.059) 10.213 8.897 ( -3.829 8.684 -4.312) 10.425 9.059 ( -5.601 -8.173 -6.318) 11.751 28.529 ( -1.166 15.117 2.667) 15.395 28.805 ( -0.829 -9.618 2.090) 9.877 28.943 ( -1.078 50.823 -1.813) 50.867 29.016 ( 1.954 25.610 -1.790) 25.747 29.147 ( 3.477 54.154 1.669) 54.291 29.338 ( 0.503 -14.834 -2.705) 15.087 30.125 ( 0.797 -60.486 -0.356) 60.492 30.311 ( 3.256 -61.357 0.575) 61.446 95.808 ( 0.322 18.112 0.555) 18.123 96.072 ( 3.710 12.906 -0.469) 13.437 96.145 ( -0.126 -16.492 0.937) 16.519 96.329 ( 0.859 -13.633 -1.092) 13.704 ======================= Grid point 212 (112/252) ======================= q-point: (-0.10 0.46 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.841 ( -0.263 2.952 -5.848) 6.556 2.877 ( 2.015 -0.900 -1.049) 2.444 3.035 ( 0.506 15.669 -1.121) 15.717 3.293 ( 1.056 -9.786 -0.419) 9.852 3.348 ( 8.765 15.173 3.689) 17.907 3.506 ( 4.807 -2.531 -1.129) 5.548 3.584 ( 8.300 5.317 3.078) 10.326 3.773 ( 14.254 -12.581 5.088) 19.681 4.214 ( -10.807 12.984 -0.792) 16.912 4.307 ( -3.836 10.339 5.392) 12.275 4.402 ( -10.165 -3.940 -2.488) 11.182 4.518 ( -3.030 -7.943 5.725) 10.250 4.545 ( 0.380 2.245 0.058) 2.278 4.646 ( -2.027 -5.745 4.731) 7.713 5.036 ( -1.157 0.124 1.401) 1.821 5.056 ( -0.802 -1.933 0.595) 2.176 5.516 ( 2.977 5.832 -5.998) 8.880 5.556 ( 4.057 15.542 -0.591) 16.074 5.686 ( 3.969 -10.420 -5.858) 12.596 5.962 ( 8.523 -21.454 0.516) 23.091 8.238 ( -4.613 10.496 3.386) 11.955 8.424 ( -4.178 -8.287 2.333) 9.570 8.827 ( -0.719 5.640 -3.277) 6.563 8.923 ( -3.987 -4.354 -5.564) 8.112 28.527 ( -1.111 15.135 2.777) 15.428 28.806 ( -0.801 -11.305 2.009) 11.510 28.912 ( -0.457 44.855 -1.714) 44.890 29.040 ( 1.626 32.768 -1.732) 32.854 29.204 ( 1.586 54.487 0.658) 54.514 29.334 ( 0.883 -14.956 -1.454) 15.052 30.142 ( 0.909 -60.268 0.452) 60.277 30.358 ( 1.644 -61.193 -0.222) 61.216 95.819 ( 0.232 17.834 0.979) 17.863 96.121 ( 2.030 8.113 -1.384) 8.477 96.151 ( 0.142 -13.830 1.145) 13.878 96.334 ( 0.554 -11.236 -1.145) 11.308 ======================= Grid point 273 (113/252) ======================= q-point: ( 0.00 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.912 ( 21.977 0.000 24.090) 32.609 1.169 ( -0.241 0.000 28.918) 28.919 1.890 ( -12.994 0.000 45.612) 47.427 2.240 ( -15.322 0.000 -21.339) 26.270 2.590 ( -0.075 0.000 -18.178) 18.179 3.049 ( -10.789 0.000 26.091) 28.234 3.410 ( 0.778 0.000 4.864) 4.925 3.493 ( 7.394 0.000 -3.315) 8.103 3.697 ( 6.378 0.000 -1.166) 6.484 3.892 ( 6.122 0.000 12.336) 13.772 4.272 ( -0.772 0.000 -17.606) 17.623 4.570 ( -1.170 0.000 4.035) 4.201 4.674 ( -8.850 0.000 -2.646) 9.237 4.803 ( -1.787 0.000 -1.249) 2.180 4.815 ( 1.066 0.000 -5.009) 5.121 5.343 ( 3.735 0.000 2.573) 4.535 5.451 ( 0.063 0.000 -1.023) 1.024 5.820 ( 1.530 0.000 -24.190) 24.239 7.327 ( 3.601 0.000 -1.076) 3.759 7.347 ( 1.985 0.000 -1.036) 2.239 8.047 ( 0.172 0.000 13.132) 13.133 8.309 ( -4.027 0.000 -0.615) 4.074 8.473 ( -6.017 0.000 5.930) 8.449 9.028 ( 3.117 0.000 -7.412) 8.041 24.686 ( -0.297 0.000 0.142) 0.329 24.701 ( 0.454 0.000 -0.297) 0.542 27.427 ( -0.483 0.000 0.330) 0.585 27.464 ( 0.400 0.000 -0.761) 0.860 30.077 ( -8.439 0.000 2.940) 8.936 30.289 ( 2.300 0.000 -3.232) 3.967 34.653 ( -0.761 0.000 5.047) 5.104 34.995 ( 2.561 0.000 -4.909) 5.537 94.104 ( 0.219 0.000 0.114) 0.247 94.108 ( -0.091 0.000 0.001) 0.091 97.179 ( -5.599 0.000 2.484) 6.125 97.364 ( 17.851 0.000 -2.924) 18.089 ======================= Grid point 274 (114/252) ======================= q-point: ( 0.10 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.457 ( 9.441 0.000 25.544) 27.233 1.499 ( 18.427 0.000 23.916) 30.192 1.875 ( -6.244 0.000 -22.319) 23.176 2.050 ( 0.707 0.000 37.143) 37.149 2.490 ( 3.706 0.000 -18.701) 19.065 3.046 ( -10.330 0.000 28.435) 30.253 3.436 ( -1.574 0.000 4.780) 5.032 3.534 ( -1.432 0.000 -2.919) 3.251 3.751 ( 4.032 0.000 -2.763) 4.888 4.061 ( 2.293 0.000 -5.077) 5.571 4.219 ( 5.896 0.000 -2.002) 6.227 4.401 ( -10.539 0.000 -10.983) 15.222 4.578 ( -1.085 0.000 3.992) 4.137 4.824 ( 3.339 0.000 -4.714) 5.776 4.879 ( 4.049 0.000 7.131) 8.200 5.413 ( 1.678 0.000 0.750) 1.838 5.432 ( -0.584 0.000 -0.707) 0.917 5.707 ( 4.424 0.000 -22.382) 22.815 7.292 ( -8.572 0.000 -1.326) 8.674 7.309 ( -1.775 0.000 -2.949) 3.442 8.195 ( 4.432 0.000 12.637) 13.391 8.272 ( 1.810 0.000 1.189) 2.166 8.380 ( -8.973 0.000 6.320) 10.976 9.020 ( 1.850 0.000 -8.376) 8.578 24.685 ( 0.068 0.000 0.076) 0.102 24.713 ( 0.947 0.000 -0.265) 0.983 27.421 ( -0.417 0.000 0.354) 0.547 27.468 ( 0.600 0.000 -0.664) 0.895 29.947 ( -8.252 0.000 6.600) 10.567 30.305 ( 1.612 0.000 -2.466) 2.946 34.670 ( -1.348 0.000 5.043) 5.220 34.991 ( 1.112 0.000 -6.110) 6.211 94.106 ( -0.055 0.000 -0.090) 0.105 94.109 ( 0.172 0.000 0.111) 0.205 97.109 ( -3.045 0.000 0.977) 3.198 97.679 ( 18.918 0.000 -10.656) 21.713 ======================= Grid point 275 (115/252) ======================= q-point: ( 0.20 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.736 ( 9.938 0.000 -15.717) 18.595 1.811 ( -3.120 0.000 31.753) 31.905 1.848 ( 12.627 0.000 17.861) 21.873 2.414 ( 12.484 0.000 -0.510) 12.494 2.504 ( 12.845 0.000 0.345) 12.849 3.098 ( -5.961 0.000 32.177) 32.725 3.421 ( -7.500 0.000 -3.773) 8.395 3.423 ( -3.030 0.000 3.666) 4.756 3.776 ( -2.167 0.000 -0.126) 2.171 4.039 ( 9.251 0.000 -20.204) 22.221 4.179 ( -5.200 0.000 -12.031) 13.107 4.263 ( -6.267 0.000 5.987) 8.668 4.586 ( -1.177 0.000 3.975) 4.145 4.857 ( 3.783 0.000 -5.218) 6.445 4.992 ( 0.445 0.000 9.863) 9.873 5.437 ( 1.456 0.000 1.843) 2.349 5.451 ( 2.277 0.000 1.732) 2.861 5.683 ( 9.394 0.000 -19.697) 21.822 7.036 ( -16.449 0.000 -3.094) 16.738 7.276 ( 0.889 0.000 -2.679) 2.823 8.232 ( -10.171 0.000 3.131) 10.642 8.350 ( 1.312 0.000 14.137) 14.198 8.384 ( 8.464 0.000 0.814) 8.503 8.977 ( -0.255 0.000 -7.954) 7.959 24.690 ( 0.382 0.000 0.079) 0.390 24.730 ( 1.181 0.000 -0.351) 1.232 27.417 ( -0.278 0.000 0.503) 0.575 27.476 ( 0.693 0.000 -0.599) 0.916 29.879 ( -4.913 0.000 7.398) 8.881 30.309 ( 0.595 0.000 -2.326) 2.401 34.674 ( -1.943 0.000 4.721) 5.105 34.954 ( -0.226 0.000 -6.195) 6.199 94.105 ( 0.023 0.000 -0.188) 0.189 94.111 ( 0.053 0.000 0.012) 0.054 97.093 ( 0.349 0.000 1.692) 1.727 97.876 ( 11.936 0.000 -11.802) 16.786 ======================= Grid point 276 (116/252) ======================= q-point: ( 0.30 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.923 ( -7.798 0.000 31.012) 31.977 1.931 ( 21.990 0.000 -11.752) 24.933 2.213 ( 12.411 0.000 16.684) 20.794 2.502 ( 10.695 0.000 -14.853) 18.303 2.768 ( 1.436 0.000 15.863) 15.928 3.230 ( -10.223 0.000 -3.550) 10.822 3.311 ( 4.881 0.000 16.048) 16.774 3.406 ( 0.665 0.000 10.449) 10.470 3.671 ( -4.719 0.000 -8.622) 9.829 4.031 ( -2.751 0.000 -11.024) 11.362 4.056 ( -14.049 0.000 8.204) 16.269 4.158 ( 10.668 0.000 -16.794) 19.896 4.590 ( -1.563 0.000 4.127) 4.413 4.887 ( 3.855 0.000 -5.439) 6.666 5.000 ( -6.582 0.000 9.691) 11.715 5.511 ( 1.532 0.000 3.065) 3.426 5.534 ( 4.916 0.000 8.599) 9.905 5.759 ( 13.295 0.000 -18.787) 23.016 6.706 ( -14.918 0.000 -6.012) 16.084 7.294 ( 2.000 0.000 -2.633) 3.306 8.064 ( -10.786 0.000 5.825) 12.259 8.448 ( -0.326 0.000 11.082) 11.087 8.554 ( 9.523 0.000 -0.404) 9.531 8.901 ( -2.283 0.000 -7.223) 7.575 24.699 ( 0.497 0.000 0.127) 0.513 24.748 ( 1.040 0.000 -0.544) 1.173 27.418 ( -0.123 0.000 0.705) 0.716 27.484 ( 0.624 0.000 -0.599) 0.865 29.861 ( -3.028 0.000 7.241) 7.849 30.296 ( 0.064 0.000 -2.820) 2.821 34.665 ( -2.444 0.000 4.188) 4.849 34.906 ( -0.132 0.000 -5.692) 5.693 94.104 ( 0.062 0.000 -0.258) 0.265 94.111 ( -0.047 0.000 -0.131) 0.140 97.141 ( 2.378 0.000 4.311) 4.923 97.967 ( 7.404 0.000 -10.889) 13.168 ======================= Grid point 277 (117/252) ======================= q-point: ( 0.40 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.974 ( -9.743 0.000 28.630) 30.243 2.306 ( 22.758 0.000 -4.867) 23.272 2.490 ( 6.615 0.000 10.236) 12.188 2.616 ( 11.423 0.000 -10.845) 15.751 2.824 ( -7.404 0.000 19.798) 21.137 3.042 ( -6.263 0.000 -0.976) 6.338 3.313 ( -2.725 0.000 -0.309) 2.742 3.516 ( -3.802 0.000 -12.369) 12.940 3.654 ( 5.742 0.000 13.113) 14.315 3.783 ( -18.406 0.000 6.966) 19.680 3.905 ( -2.031 0.000 -10.725) 10.915 4.304 ( 13.120 0.000 -10.234) 16.640 4.584 ( -2.454 0.000 4.527) 5.150 4.927 ( 4.877 0.000 -5.262) 7.175 4.945 ( -5.830 0.000 10.891) 12.353 5.523 ( -2.118 0.000 1.256) 2.462 5.670 ( -1.290 0.000 13.874) 13.934 5.889 ( 15.089 0.000 -18.144) 23.598 6.484 ( -2.121 0.000 -6.552) 6.886 7.247 ( -5.426 0.000 -5.897) 8.014 7.973 ( -4.406 0.000 10.202) 11.113 8.498 ( -1.862 0.000 9.248) 9.434 8.701 ( 6.464 0.000 -3.685) 7.441 8.802 ( -2.146 0.000 -5.135) 5.566 24.708 ( 0.362 0.000 0.211) 0.419 24.758 ( 0.564 0.000 -0.769) 0.954 27.422 ( -0.034 0.000 0.890) 0.891 27.489 ( 0.415 0.000 -0.669) 0.787 29.863 ( -2.390 0.000 7.142) 7.531 30.277 ( 0.345 0.000 -3.446) 3.463 34.645 ( -2.702 0.000 3.561) 4.471 34.877 ( 1.133 0.000 -5.004) 5.131 94.104 ( 0.074 0.000 -0.284) 0.294 94.108 ( -0.092 0.000 -0.242) 0.259 97.225 ( 2.052 0.000 7.087) 7.378 98.003 ( 4.946 0.000 -10.508) 11.614 ======================= Grid point 278 (118/252) ======================= q-point: (-0.50 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.966 ( -13.151 0.000 27.883) 30.829 2.368 ( -14.419 0.000 3.786) 14.908 2.725 ( 0.012 0.000 2.565) 2.565 2.770 ( 20.091 0.000 -3.033) 20.318 2.823 ( 0.910 0.000 4.742) 4.828 3.075 ( 6.685 0.000 4.874) 8.273 3.252 ( -3.842 0.000 -0.158) 3.845 3.379 ( -1.253 0.000 -12.028) 12.093 3.530 ( -13.806 0.000 6.548) 15.280 3.562 ( -19.291 0.000 6.788) 20.450 3.961 ( 12.035 0.000 -7.416) 14.136 4.462 ( 10.346 0.000 -6.857) 12.412 4.569 ( -2.761 0.000 5.148) 5.842 4.965 ( -1.747 0.000 13.045) 13.161 4.996 ( 6.932 0.000 -5.471) 8.831 5.461 ( -3.978 0.000 -1.725) 4.336 5.632 ( -9.978 0.000 8.287) 12.971 6.043 ( 14.415 0.000 -14.838) 20.687 6.578 ( 12.674 0.000 1.406) 12.752 7.019 ( -12.358 0.000 -9.823) 15.787 8.032 ( 0.616 0.000 12.963) 12.977 8.514 ( -2.772 0.000 7.677) 8.162 8.621 ( -5.883 0.000 -7.739) 9.721 8.865 ( 7.254 0.000 -2.658) 7.726 24.714 ( 0.051 0.000 0.328) 0.332 24.757 ( -0.044 0.000 -0.918) 0.920 27.428 ( -0.036 0.000 1.007) 1.007 27.489 ( 0.161 0.000 -0.773) 0.790 29.872 ( -2.305 0.000 7.376) 7.728 30.263 ( 1.000 0.000 -3.918) 4.044 34.620 ( -2.533 0.000 3.065) 3.976 34.880 ( 2.837 0.000 -4.457) 5.283 94.103 ( 0.078 0.000 -0.261) 0.272 94.105 ( -0.099 0.000 -0.284) 0.301 97.303 ( 0.209 0.000 8.778) 8.780 98.001 ( 3.272 0.000 -11.419) 11.878 ======================= Grid point 279 (119/252) ======================= q-point: (-0.40 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.884 ( -17.573 0.000 27.700) 32.804 2.047 ( -22.226 0.000 4.591) 22.696 2.566 ( -17.821 0.000 -0.274) 17.823 2.941 ( 8.659 0.000 -3.655) 9.399 2.988 ( 3.258 0.000 1.759) 3.703 3.174 ( -5.307 0.000 2.594) 5.907 3.244 ( 7.495 0.000 -0.612) 7.520 3.258 ( -19.377 0.000 15.772) 24.984 3.314 ( 1.838 0.000 -10.941) 11.094 3.436 ( 1.159 0.000 6.719) 6.818 4.137 ( 12.802 0.000 -6.773) 14.484 4.559 ( -2.361 0.000 5.310) 5.811 4.567 ( 5.840 0.000 -5.559) 8.063 5.019 ( -3.361 0.000 11.757) 12.228 5.090 ( 7.472 0.000 -7.275) 10.429 5.377 ( -2.869 0.000 -3.263) 4.345 5.507 ( -6.701 0.000 3.908) 7.757 6.200 ( 11.368 0.000 -7.114) 13.411 6.714 ( -10.014 0.000 -15.122) 18.137 6.870 ( 14.535 0.000 6.512) 15.927 8.133 ( -0.547 0.000 13.387) 13.398 8.446 ( -7.231 0.000 -7.223) 10.220 8.511 ( -2.799 0.000 6.386) 6.973 8.968 ( 6.709 0.000 -4.483) 8.069 24.714 ( -0.294 0.000 0.440) 0.529 24.745 ( -0.528 0.000 -0.923) 1.063 27.434 ( -0.111 0.000 1.015) 1.021 27.485 ( -0.028 0.000 -0.864) 0.864 29.886 ( -2.029 0.000 8.205) 8.452 30.257 ( 1.533 0.000 -4.281) 4.548 34.600 ( -1.917 0.000 2.955) 3.522 34.913 ( 4.106 0.000 -4.359) 5.988 94.101 ( -0.077 0.000 -0.259) 0.270 94.103 ( 0.086 0.000 -0.192) 0.210 97.351 ( -1.994 0.000 9.222) 9.435 97.955 ( 1.176 0.000 -14.094) 14.143 ======================= Grid point 280 (120/252) ======================= q-point: (-0.30 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.663 ( -24.542 0.000 8.809) 26.075 1.678 ( -24.355 0.000 14.786) 28.492 2.151 ( -26.377 0.000 11.030) 28.590 2.998 ( -2.703 0.000 5.647) 6.261 2.999 ( -1.038 0.000 -6.422) 6.506 3.114 ( -13.460 0.000 27.313) 30.450 3.153 ( 3.674 0.000 -0.865) 3.774 3.282 ( 3.087 0.000 -7.744) 8.337 3.303 ( 2.104 0.000 -7.294) 7.592 3.588 ( 7.618 0.000 3.952) 8.582 4.335 ( 13.214 0.000 -3.937) 13.788 4.557 ( -1.907 0.000 5.107) 5.451 4.593 ( 1.547 0.000 -6.014) 6.209 4.974 ( -8.077 0.000 5.520) 9.783 5.122 ( 1.859 0.000 -10.926) 11.083 5.328 ( 0.409 0.000 -2.422) 2.456 5.473 ( -1.239 0.000 5.115) 5.263 6.290 ( -2.528 0.000 -2.641) 3.656 6.565 ( 11.376 0.000 -15.899) 19.549 7.151 ( 10.729 0.000 5.950) 12.269 8.176 ( -4.997 0.000 12.216) 13.199 8.279 ( -5.647 0.000 -4.842) 7.439 8.511 ( -1.835 0.000 5.976) 6.252 9.041 ( 5.461 0.000 -6.491) 8.483 24.710 ( -0.551 0.000 0.482) 0.732 24.727 ( -0.705 0.000 -0.795) 1.062 27.438 ( -0.240 0.000 0.889) 0.921 27.477 ( -0.089 0.000 -0.911) 0.915 29.922 ( -0.596 0.000 9.773) 9.791 30.257 ( 1.847 0.000 -4.538) 4.900 34.594 ( -1.109 0.000 3.316) 3.497 34.959 ( 4.197 0.000 -4.864) 6.424 94.098 ( -0.021 0.000 -0.179) 0.180 94.104 ( 0.100 0.000 -0.089) 0.134 97.359 ( -3.965 0.000 8.636) 9.503 97.829 ( -3.019 0.000 -18.499) 18.744 ======================= Grid point 281 (121/252) ======================= q-point: (-0.20 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( -32.980 0.000 -2.365) 33.065 1.310 ( -22.981 0.000 16.270) 28.157 1.905 ( -21.520 0.000 38.713) 44.293 2.880 ( -3.568 0.000 -11.132) 11.690 2.952 ( -5.772 0.000 -5.520) 7.986 3.084 ( -11.181 0.000 26.088) 28.383 3.250 ( 4.821 0.000 2.248) 5.319 3.257 ( 0.664 0.000 -0.505) 0.834 3.342 ( 7.147 0.000 -4.567) 8.482 3.724 ( 4.883 0.000 2.035) 5.290 4.542 ( -1.516 0.000 -8.580) 8.713 4.548 ( 4.283 0.000 2.523) 4.971 4.577 ( 7.431 0.000 2.614) 7.878 4.844 ( -7.607 0.000 1.644) 7.782 5.005 ( -4.395 0.000 -11.312) 12.135 5.364 ( 4.011 0.000 -0.910) 4.113 5.478 ( -3.195 0.000 3.535) 4.765 6.145 ( -2.590 0.000 -17.305) 17.498 6.820 ( 18.717 0.000 -0.758) 18.732 7.307 ( 3.536 0.000 0.169) 3.540 8.127 ( -8.623 0.000 10.493) 13.581 8.217 ( 1.320 0.000 1.205) 1.788 8.523 ( -1.943 0.000 6.233) 6.529 9.068 ( 3.054 0.000 -8.360) 8.900 24.702 ( -0.650 0.000 0.415) 0.771 24.710 ( -0.535 0.000 -0.602) 0.805 27.438 ( -0.399 0.000 0.655) 0.767 27.469 ( -0.011 0.000 -0.907) 0.907 30.012 ( 2.730 0.000 10.348) 10.702 30.261 ( 2.110 0.000 -4.524) 4.992 34.606 ( -0.511 0.000 3.988) 4.021 34.987 ( 2.775 0.000 -5.515) 6.174 94.098 ( 0.068 0.000 -0.069) 0.097 94.105 ( 0.122 0.000 0.036) 0.127 97.328 ( -5.496 0.000 7.168) 9.032 97.569 ( -10.492 0.000 -20.160) 22.727 ======================= Grid point 282 (122/252) ======================= q-point: (-0.10 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.667 ( -17.058 0.000 12.867) 21.366 1.106 ( -14.297 0.000 25.377) 29.127 1.851 ( -17.773 0.000 45.538) 48.884 2.666 ( -14.924 0.000 -17.282) 22.834 2.732 ( -2.281 0.000 -15.460) 15.627 3.065 ( -10.829 0.000 25.461) 27.668 3.343 ( 2.935 0.000 4.081) 5.027 3.356 ( 8.101 0.000 0.169) 8.102 3.496 ( 10.296 0.000 3.755) 10.959 3.798 ( 2.179 0.000 1.849) 2.858 4.421 ( -2.967 0.000 -13.309) 13.635 4.563 ( -1.286 0.000 4.247) 4.438 4.717 ( -3.005 0.000 5.521) 6.286 4.830 ( 8.357 0.000 -3.437) 9.036 4.868 ( -2.439 0.000 -7.483) 7.870 5.372 ( -8.497 0.000 0.378) 8.506 5.429 ( 3.064 0.000 -0.732) 3.150 5.977 ( -0.259 0.000 -23.010) 23.012 7.147 ( 14.960 0.000 2.084) 15.105 7.319 ( 0.960 0.000 -2.280) 2.474 8.041 ( -7.836 0.000 10.613) 13.192 8.311 ( 4.607 0.000 1.414) 4.819 8.517 ( -3.629 0.000 6.152) 7.143 9.041 ( 1.029 0.000 -7.858) 7.925 24.693 ( -0.563 0.000 0.274) 0.626 24.701 ( -0.100 0.000 -0.420) 0.432 27.433 ( -0.503 0.000 0.439) 0.667 27.465 ( 0.172 0.000 -0.852) 0.869 30.126 ( 1.570 0.000 4.568) 4.830 30.271 ( 2.360 0.000 -4.067) 4.702 34.629 ( -0.402 0.000 4.660) 4.677 34.987 ( 1.669 0.000 -4.735) 5.020 94.100 ( 0.166 0.000 0.040) 0.171 94.108 ( 0.083 0.000 0.079) 0.115 97.263 ( -6.266 0.000 4.951) 7.986 97.268 ( -6.468 0.000 -6.929) 9.479 ======================= Grid point 283 (123/252) ======================= q-point: ( 0.00 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.979 ( 7.992 7.517 20.714) 23.441 1.258 ( 6.806 10.684 25.425) 28.406 2.123 ( -9.422 21.049 39.160) 45.446 2.231 ( -12.998 -0.526 -20.614) 24.375 2.608 ( -1.389 2.149 -17.580) 17.765 3.084 ( -10.321 3.616 23.983) 26.359 3.385 ( 0.808 -1.397 4.207) 4.506 3.574 ( 6.004 6.618 -1.501) 9.061 3.726 ( 8.166 2.800 0.106) 8.633 3.886 ( 4.587 -0.291 9.257) 10.335 4.264 ( 0.249 -0.042 -14.010) 14.012 4.659 ( -9.825 -1.315 -3.976) 10.681 4.684 ( -1.485 9.299 2.497) 9.743 4.748 ( -4.101 -2.058 -0.616) 4.630 5.027 ( 2.171 14.851 -6.107) 16.203 5.327 ( 4.147 -1.565 2.465) 5.072 5.428 ( -0.368 -2.340 -0.816) 2.506 5.780 ( 2.015 -3.918 -23.150) 23.565 7.117 ( -3.831 -16.425 4.299) 17.405 7.285 ( 7.061 -7.397 -2.403) 10.505 7.997 ( 0.804 -4.031 11.790) 12.486 8.320 ( -7.494 0.548 -2.661) 7.971 8.494 ( -8.398 2.610 7.528) 11.577 9.060 ( 11.008 1.610 -7.839) 13.610 24.847 ( 0.532 15.434 0.003) 15.443 24.925 ( -0.316 21.735 -4.135) 22.127 27.463 ( -0.501 3.852 0.647) 3.938 27.524 ( 0.424 5.991 -1.145) 6.114 29.986 ( -6.921 -7.907 6.072) 12.136 30.256 ( 2.249 -3.341 -3.355) 5.242 34.500 ( -0.674 -15.706 4.876) 16.459 34.828 ( 2.088 -17.013 -4.622) 17.753 94.196 ( 0.258 9.466 0.853) 9.508 94.431 ( -1.356 26.796 -11.953) 29.373 97.145 ( -5.214 -3.431 2.295) 6.650 97.309 ( 15.262 -5.395 -2.102) 16.324 ======================= Grid point 284 (124/252) ======================= q-point: ( 0.10 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.332 ( 12.188 -5.474 24.055) 27.517 1.625 ( 10.079 10.075 24.259) 28.135 1.903 ( -5.306 3.300 -20.184) 21.129 2.300 ( 3.216 19.977 26.380) 33.246 2.510 ( 4.305 3.326 -15.295) 16.233 3.076 ( -9.646 3.176 26.445) 28.328 3.407 ( -1.316 -1.942 4.203) 4.814 3.587 ( -3.083 4.304 -3.037) 6.103 3.813 ( 4.650 5.952 -2.399) 7.925 4.054 ( 3.347 -0.679 -0.137) 3.418 4.220 ( 4.502 0.180 -4.559) 6.410 4.377 ( -10.073 -2.177 -10.737) 14.882 4.690 ( -0.845 10.240 3.255) 10.778 4.749 ( 0.244 -3.359 5.687) 6.609 5.055 ( 3.731 12.118 -2.693) 12.962 5.378 ( -0.376 -3.133 -0.469) 3.190 5.424 ( 1.126 -1.191 0.364) 1.679 5.678 ( 4.448 -2.792 -21.453) 22.086 6.984 ( -11.014 -19.464 2.226) 22.474 7.394 ( 3.751 -1.692 -4.478) 6.082 8.004 ( -5.422 -12.655 9.934) 16.977 8.315 ( 5.211 2.536 1.676) 6.033 8.368 ( -9.174 -0.585 8.476) 12.504 9.177 ( 7.338 10.584 -10.157) 16.402 24.861 ( 0.857 15.798 0.299) 15.824 24.889 ( -0.874 19.203 -2.435) 19.376 27.459 ( -0.412 3.987 0.684) 4.067 27.526 ( 0.629 5.847 -1.052) 5.974 29.899 ( -6.883 -4.552 7.223) 10.966 30.271 ( 1.643 -3.483 -2.719) 4.714 34.517 ( -1.287 -15.684 4.891) 16.479 34.820 ( 0.852 -17.417 -5.625) 18.322 94.206 ( -0.054 10.091 1.156) 10.157 94.320 ( -3.047 19.137 -5.510) 20.146 97.080 ( -2.805 -2.946 0.865) 4.159 97.593 ( 17.213 -8.367 -8.418) 20.908 ======================= Grid point 285 (125/252) ======================= q-point: ( 0.20 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( 9.980 -3.952 9.407) 14.272 1.822 ( 9.774 1.755 -3.417) 10.502 1.915 ( 2.671 8.198 25.951) 27.346 2.440 ( 8.311 1.165 -14.508) 16.760 2.675 ( 10.283 15.831 12.726) 22.767 3.141 ( -2.931 4.828 29.112) 29.655 3.401 ( -2.487 -1.354 3.469) 4.478 3.453 ( -7.879 2.361 -3.526) 8.949 3.830 ( -2.769 4.953 -0.782) 5.728 4.056 ( 6.752 1.927 -16.034) 17.505 4.171 ( -3.884 -0.594 -10.771) 11.465 4.250 ( -5.476 -1.250 4.225) 7.028 4.697 ( -0.304 9.297 2.211) 9.561 4.817 ( 2.142 -2.099 5.431) 6.205 5.092 ( -0.157 8.635 1.410) 8.751 5.383 ( 1.713 -4.387 0.601) 4.748 5.451 ( 1.384 -1.041 2.448) 2.998 5.658 ( 9.100 -2.464 -18.680) 20.924 6.765 ( -14.362 -21.300 0.451) 25.694 7.351 ( -1.783 2.640 -5.483) 6.342 8.058 ( -1.877 -18.396 11.331) 21.686 8.189 ( -5.400 -2.228 0.599) 5.873 8.518 ( 7.639 6.234 7.139) 12.173 9.181 ( 1.247 14.325 -9.961) 17.493 24.863 ( -0.417 17.285 -1.169) 17.330 24.882 ( 1.003 15.501 0.225) 15.535 27.458 ( -0.287 4.156 0.802) 4.242 27.532 ( 0.758 5.726 -0.944) 5.853 29.849 ( -4.454 -3.080 7.394) 9.165 30.274 ( 0.740 -3.515 -2.626) 4.450 34.521 ( -1.912 -15.705 4.575) 16.469 34.783 ( -0.330 -17.454 -5.822) 18.402 94.208 ( -0.497 10.276 0.842) 10.323 94.251 ( -1.725 13.508 -2.108) 13.780 97.065 ( 0.356 -2.814 1.526) 3.221 97.785 ( 11.387 -8.980 -10.135) 17.692 ======================= Grid point 286 (126/252) ======================= q-point: ( 0.30 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( 10.974 0.941 4.269) 11.813 2.015 ( 5.505 4.543 11.196) 13.277 2.209 ( 12.262 1.281 16.969) 20.975 2.516 ( 11.288 1.427 -13.755) 17.851 2.840 ( -3.137 6.606 17.431) 18.902 3.220 ( -9.402 -0.105 -3.017) 9.875 3.361 ( -1.537 1.674 4.309) 4.872 3.454 ( 7.787 7.085 17.069) 20.055 3.725 ( -4.436 5.090 -7.747) 10.276 4.016 ( -1.996 -1.033 -8.483) 8.776 4.036 ( -13.324 -1.614 3.653) 13.910 4.182 ( 7.105 2.695 -12.964) 15.027 4.716 ( 0.782 10.182 2.087) 10.423 4.884 ( 1.893 0.170 2.969) 3.525 5.051 ( -5.931 5.288 3.589) 8.719 5.447 ( 3.001 -5.464 2.910) 6.880 5.524 ( 2.749 -1.972 7.364) 8.104 5.733 ( 12.592 -2.675 -17.581) 21.790 6.484 ( -14.520 -20.470 -2.912) 25.265 7.303 ( -0.409 -0.277 -5.063) 5.087 7.937 ( -10.637 -10.117 6.322) 15.984 8.291 ( 6.242 -8.545 7.296) 12.854 8.684 ( 6.026 8.171 4.062) 10.935 9.100 ( -2.334 14.754 -9.063) 17.472 24.854 ( 0.093 15.693 -0.575) 15.704 24.899 ( 0.758 15.503 -0.001) 15.521 27.460 ( -0.166 4.283 0.963) 4.393 27.539 ( 0.728 5.677 -0.892) 5.793 29.834 ( -2.935 -2.729 7.144) 8.191 30.262 ( 0.253 -3.398 -3.062) 4.581 34.512 ( -2.422 -15.766 4.033) 16.452 34.736 ( -0.212 -17.405 -5.403) 18.226 94.200 ( -0.543 9.779 -0.098) 9.795 94.221 ( -0.931 10.670 -0.421) 10.719 97.111 ( 2.260 -3.109 3.993) 5.542 97.880 ( 7.166 -8.758 -9.770) 14.950 ======================= Grid point 287 (127/252) ======================= q-point: ( 0.40 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.033 ( -7.019 5.960 24.828) 26.481 2.287 ( 19.763 -1.372 -5.261) 20.497 2.508 ( 7.400 1.287 9.007) 11.728 2.652 ( 12.663 3.692 -8.613) 15.753 2.864 ( -7.899 4.038 20.291) 22.146 3.026 ( -6.572 -1.297 -1.459) 6.855 3.323 ( -3.603 0.645 0.618) 3.713 3.582 ( -3.460 6.545 -11.215) 13.438 3.704 ( 2.995 3.963 9.838) 11.021 3.781 ( -15.571 0.617 7.463) 17.279 3.930 ( 0.297 2.022 -9.855) 10.065 4.255 ( 8.132 -1.723 -8.968) 12.228 4.747 ( 0.446 12.880 2.430) 13.115 4.941 ( 2.470 1.312 3.526) 4.501 4.968 ( -4.330 2.663 3.074) 5.940 5.480 ( -1.470 -4.425 1.482) 4.892 5.630 ( -0.808 -3.913 12.149) 12.789 5.854 ( 13.498 -3.572 -16.266) 21.437 6.266 ( -3.763 -20.589 -4.660) 21.442 7.198 ( -7.043 -5.357 -8.261) 12.106 7.878 ( -1.753 -6.565 10.315) 12.352 8.436 ( 2.879 -3.271 9.438) 10.395 8.765 ( 0.584 4.669 -2.604) 5.378 9.007 ( 0.143 15.955 -6.336) 17.168 24.856 ( 0.436 15.119 -0.113) 15.126 24.907 ( 0.188 15.191 -0.438) 15.199 27.465 ( -0.122 4.330 1.114) 4.473 27.545 ( 0.550 5.704 -0.922) 5.804 29.837 ( -2.404 -2.765 7.020) 7.919 30.245 ( 0.484 -3.243 -3.603) 4.871 34.491 ( -2.666 -15.829 3.394) 16.407 34.707 ( 1.045 -17.373 -4.748) 18.041 94.192 ( -0.173 9.053 -0.219) 9.057 94.205 ( -0.562 9.521 -0.279) 9.541 97.190 ( 1.994 -3.566 6.637) 7.793 97.918 ( 4.671 -8.551 -9.637) 13.704 ======================= Grid point 288 (128/252) ======================= q-point: (-0.50 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.027 ( -12.544 6.057 24.082) 27.821 2.371 ( -14.748 0.435 2.899) 15.036 2.650 ( 14.552 -5.100 -7.191) 17.014 2.816 ( -3.976 5.159 14.288) 15.703 2.899 ( 9.088 4.864 -0.875) 10.345 3.082 ( 9.392 0.937 5.432) 10.891 3.235 ( -6.029 -1.821 -0.306) 6.305 3.451 ( -2.736 7.101 -9.388) 12.085 3.565 ( -10.398 3.599 5.809) 12.443 3.631 ( -15.482 6.500 5.019) 17.526 3.983 ( 10.153 1.934 -7.908) 13.013 4.339 ( 6.172 -6.171 -4.473) 9.808 4.747 ( -2.018 11.450 1.578) 11.733 4.956 ( -1.366 0.240 7.888) 8.009 5.047 ( 7.289 4.017 0.184) 8.325 5.429 ( -3.492 -3.258 -1.151) 4.913 5.598 ( -9.293 -3.535 7.532) 12.474 5.984 ( 12.777 -5.682 -14.383) 20.060 6.339 ( 10.166 -21.870 3.485) 24.368 6.957 ( -10.278 -6.566 -11.706) 16.905 7.981 ( 2.560 -3.744 13.199) 13.956 8.520 ( -1.144 2.152 10.112) 10.401 8.649 ( -7.298 1.715 -8.337) 11.212 9.046 ( 6.719 14.761 -4.713) 16.889 24.866 ( 0.538 15.496 0.214) 15.507 24.900 ( -0.348 14.706 -0.784) 14.731 27.470 ( -0.175 4.287 1.205) 4.457 27.546 ( 0.325 5.789 -1.001) 5.884 29.843 ( -2.351 -2.914 7.219) 8.132 30.232 ( 1.064 -3.155 -4.010) 5.212 34.465 ( -2.474 -15.862 2.891) 16.312 34.710 ( 2.728 -17.370 -4.204) 18.078 94.186 ( -0.484 8.399 -0.049) 8.413 94.202 ( 0.684 9.718 -0.488) 9.754 97.265 ( 0.281 -3.897 8.261) 9.138 97.915 ( 2.822 -8.599 -10.552) 13.902 ======================= Grid point 289 (129/252) ======================= q-point: (-0.40 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.895 ( -19.783 -0.867 16.628) 25.857 2.044 ( -21.625 3.635 9.283) 23.812 2.711 ( -11.402 12.094 5.957) 17.656 2.874 ( 9.476 -4.367 -2.373) 10.700 3.016 ( 0.060 1.523 2.006) 2.519 3.107 ( -2.834 -3.968 -5.551) 7.388 3.285 ( -11.744 4.764 11.236) 16.937 3.343 ( 4.187 8.239 0.307) 9.247 3.431 ( 0.055 6.252 0.256) 6.258 3.500 ( -1.227 7.990 2.723) 8.530 4.125 ( 11.114 -1.229 -6.865) 13.121 4.408 ( 3.480 -7.953 -1.526) 8.814 4.713 ( -2.175 6.432 0.593) 6.816 4.988 ( -1.417 -0.028 6.106) 6.269 5.183 ( 7.046 6.645 -1.454) 9.793 5.361 ( -2.489 -1.593 -2.306) 3.749 5.478 ( -6.390 -2.972 3.350) 7.803 6.116 ( 9.844 -8.228 -7.034) 14.631 6.527 ( 2.074 -18.247 -1.003) 18.392 6.770 ( 4.092 -8.275 -6.437) 11.254 8.113 ( 0.644 -1.898 13.725) 13.870 8.429 ( -9.648 -0.764 -7.729) 12.385 8.545 ( -2.927 4.321 7.964) 9.522 9.141 ( 7.572 13.577 -6.773) 16.957 24.872 ( -0.285 15.718 -0.222) 15.722 24.891 ( 0.273 15.257 -0.350) 15.263 27.474 ( -0.302 4.160 1.190) 4.337 27.543 ( 0.160 5.910 -1.074) 6.009 29.855 ( -2.172 -3.181 7.950) 8.834 30.227 ( 1.549 -3.137 -4.318) 5.558 34.445 ( -1.838 -15.861 2.774) 16.206 34.743 ( 3.958 -17.399 -4.071) 18.302 94.178 ( -0.266 7.959 -0.167) 7.965 94.222 ( 1.856 11.508 -0.368) 11.662 97.311 ( -1.852 -4.072 8.657) 9.745 97.866 ( 0.521 -8.846 -12.897) 15.648 ======================= Grid point 290 (130/252) ======================= q-point: (-0.30 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.517 ( -26.881 -8.232 5.763) 28.698 1.770 ( -21.869 8.969 16.337) 28.733 2.436 ( -21.511 22.792 9.415) 32.723 2.945 ( -5.602 -4.378 -1.687) 7.307 2.998 ( 2.486 -1.449 0.474) 2.916 3.081 ( 5.416 -1.642 -5.440) 7.850 3.148 ( -13.060 3.666 24.714) 28.192 3.379 ( 0.120 7.654 -4.035) 8.654 3.448 ( 2.165 11.270 -4.875) 12.469 3.626 ( 7.990 3.574 3.903) 9.584 4.294 ( 11.849 -3.620 -3.673) 12.923 4.438 ( 0.847 -8.123 -0.994) 8.227 4.681 ( -1.879 3.364 0.972) 3.974 4.967 ( -3.913 2.515 0.630) 4.694 5.237 ( 1.075 8.474 -6.055) 10.471 5.315 ( -0.057 -1.215 -1.565) 1.982 5.447 ( -0.795 -2.558 4.594) 5.318 6.187 ( -1.065 -9.826 -3.381) 10.446 6.501 ( 10.748 -6.707 -13.530) 18.535 6.982 ( 11.905 -15.577 6.984) 20.812 8.132 ( -8.980 -2.754 5.615) 10.943 8.249 ( -3.830 -1.668 -0.212) 4.183 8.548 ( -2.607 4.128 8.359) 9.680 9.205 ( 5.257 12.006 -9.693) 16.302 24.857 ( -0.654 14.770 -0.663) 14.800 24.904 ( 1.101 17.963 -0.139) 17.998 27.476 ( -0.452 3.988 1.048) 4.148 27.537 ( 0.102 6.033 -1.115) 6.136 29.883 ( -1.208 -3.917 9.316) 10.178 30.227 ( 1.840 -3.144 -4.527) 5.810 34.440 ( -1.017 -15.834 3.127) 16.172 34.788 ( 4.012 -17.438 -4.456) 18.440 94.175 ( 0.069 7.892 -0.118) 7.893 94.269 ( 3.974 15.508 -0.801) 16.029 97.318 ( -3.784 -4.188 8.032) 9.817 97.739 ( -3.723 -8.887 -16.380) 19.004 ======================= Grid point 291 (131/252) ======================= q-point: (-0.20 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.082 ( -24.564 -2.499 7.830) 25.902 1.437 ( -23.950 11.677 10.947) 28.806 2.176 ( -20.747 23.354 28.785) 42.479 2.801 ( -4.935 -5.025 -11.771) 13.717 3.001 ( -3.061 2.882 -3.598) 5.534 3.116 ( -9.747 3.033 23.425) 25.553 3.168 ( 4.456 -3.956 1.417) 6.125 3.348 ( 1.346 7.491 -0.280) 7.616 3.467 ( 3.425 9.336 -3.565) 10.564 3.763 ( 4.708 3.616 1.603) 6.149 4.415 ( -0.266 -7.107 -3.915) 8.118 4.524 ( 13.405 -4.235 0.865) 14.085 4.668 ( -0.616 3.441 2.418) 4.250 4.861 ( -5.874 5.342 -3.452) 8.658 5.162 ( -3.040 11.721 -6.771) 13.873 5.346 ( 3.313 -1.950 -0.395) 3.864 5.455 ( -2.752 -2.243 2.920) 4.597 6.070 ( -1.950 -7.272 -16.143) 17.812 6.729 ( 16.721 -9.011 -1.753) 19.075 7.201 ( 6.550 -11.091 3.590) 13.371 7.988 ( -8.335 -7.246 6.763) 12.951 8.231 ( 0.695 0.466 2.321) 2.467 8.568 ( -2.618 4.048 9.630) 10.769 9.174 ( -0.473 6.849 -12.712) 14.447 24.845 ( -0.233 14.815 -0.535) 14.826 24.926 ( 1.843 20.517 -1.404) 20.647 27.473 ( -0.561 3.846 0.842) 3.977 27.531 ( 0.131 6.102 -1.145) 6.210 29.946 ( 0.566 -6.063 10.164) 11.848 30.230 ( 2.086 -3.158 -4.491) 5.873 34.452 ( -0.413 -15.794 3.795) 16.249 34.818 ( 2.739 -17.291 -4.905) 18.181 94.178 ( 0.294 8.165 0.068) 8.170 94.361 ( 7.810 22.451 -3.652) 24.050 97.287 ( -5.212 -4.196 6.573) 9.379 97.492 ( -10.145 -7.435 -16.905) 21.071 ======================= Grid point 292 (132/252) ======================= q-point: (-0.10 0.08 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.834 ( -7.525 16.067 11.997) 21.417 1.163 ( -15.127 7.900 20.879) 26.967 2.082 ( -16.187 20.982 38.778) 46.968 2.582 ( -9.049 -5.056 -17.360) 20.220 2.804 ( -7.677 4.816 -14.611) 17.193 3.103 ( -9.930 3.853 23.380) 25.691 3.298 ( 5.073 -2.783 6.484) 8.691 3.442 ( 6.836 6.543 1.891) 9.650 3.544 ( 7.389 4.707 0.440) 8.772 3.824 ( 1.519 2.580 1.047) 3.172 4.356 ( -0.951 -4.437 -9.009) 10.088 4.686 ( -0.075 4.605 3.490) 5.779 4.729 ( -2.589 5.640 1.279) 6.336 4.787 ( 8.327 -2.735 -3.635) 9.489 5.067 ( -1.498 14.744 -6.753) 16.286 5.341 ( -6.799 -2.965 -0.062) 7.418 5.417 ( 1.488 -1.352 -0.050) 2.011 5.919 ( 0.208 -5.684 -21.798) 22.527 6.998 ( 11.227 -12.776 2.694) 17.220 7.259 ( 0.494 -7.124 -1.220) 7.245 7.936 ( -4.430 -7.024 11.179) 13.926 8.342 ( 7.495 3.297 0.594) 8.209 8.567 ( -5.168 4.204 8.592) 10.872 9.034 ( -2.843 -1.689 -10.664) 11.165 24.841 ( 0.182 15.107 -0.322) 15.112 24.943 ( 1.652 22.345 -3.826) 22.730 27.468 ( -0.574 3.800 0.695) 3.906 27.526 ( 0.238 6.088 -1.170) 6.204 30.017 ( -1.037 -9.235 7.598) 12.004 30.240 ( 2.311 -3.216 -4.076) 5.683 34.475 ( -0.305 -15.749 4.473) 16.375 34.823 ( 1.785 -16.807 -4.434) 17.474 94.186 ( 0.355 8.732 0.403) 8.749 94.467 ( 7.691 29.056 -11.581) 32.211 97.224 ( -5.257 -4.023 1.898) 6.886 97.227 ( -6.121 -3.994 -3.282) 8.012 ======================= Grid point 293 (133/252) ======================= q-point: ( 0.00 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.238 ( -5.941 19.055 10.448) 22.529 1.573 ( 12.001 20.575 17.050) 29.293 2.239 ( -7.559 1.932 -18.576) 20.148 2.605 ( -5.616 26.556 27.824) 38.871 2.684 ( -3.821 6.323 -13.882) 15.725 3.183 ( -8.641 6.247 18.550) 21.396 3.360 ( 0.882 -1.478 4.532) 4.848 3.696 ( 4.814 3.973 5.126) 8.077 3.796 ( 8.028 4.751 2.174) 9.578 3.919 ( 3.438 5.038 -0.897) 6.165 4.287 ( 0.902 2.306 -8.316) 8.677 4.602 ( -11.660 -4.479 -9.160) 15.490 4.690 ( -2.971 -2.395 6.368) 7.424 4.899 ( -0.507 9.901 1.595) 10.042 5.242 ( -0.173 4.453 -2.942) 5.340 5.290 ( 4.611 -2.011 2.342) 5.549 5.371 ( -1.273 -2.770 -0.642) 3.115 5.684 ( 2.757 -5.605 -19.258) 20.246 6.834 ( -6.812 -10.843 4.255) 13.494 7.084 ( 8.159 -12.891 -3.526) 15.658 7.923 ( 0.710 -3.138 9.393) 9.929 8.333 ( -11.383 1.082 -6.340) 13.075 8.554 ( -10.275 2.982 7.780) 13.229 9.055 ( 19.385 -2.007 -6.380) 20.506 25.281 ( 0.582 29.045 0.704) 29.059 25.456 ( -0.326 32.019 -6.514) 32.676 27.577 ( -0.703 7.909 1.320) 8.049 27.690 ( 0.639 10.929 -1.952) 11.120 29.819 ( -4.722 -8.853 8.191) 12.953 30.162 ( 2.170 -6.326 -3.572) 7.582 34.052 ( -0.439 -30.258 4.403) 30.580 34.346 ( 1.280 -32.356 -4.109) 32.641 94.449 ( 0.445 16.032 2.699) 16.264 94.938 ( -2.354 23.275 -18.189) 29.633 97.047 ( -4.281 -6.601 1.848) 8.082 97.169 ( 10.430 -8.726 -1.098) 13.643 ======================= Grid point 294 (134/252) ======================= q-point: ( 0.10 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.349 ( 6.773 7.962 16.931) 19.898 1.881 ( 7.039 15.673 16.755) 23.998 2.018 ( -2.659 9.020 -13.075) 16.106 2.509 ( 0.534 4.363 -15.693) 16.297 2.829 ( 6.416 25.392 18.575) 32.108 3.171 ( -6.768 6.751 21.306) 23.353 3.375 ( -1.577 -1.406 4.022) 4.543 3.677 ( -5.661 4.571 -3.622) 8.128 3.953 ( 3.892 6.937 0.465) 7.968 4.037 ( 5.444 -0.166 5.849) 7.992 4.225 ( 0.483 -0.088 -9.115) 9.128 4.341 ( -6.868 -0.585 -9.384) 11.644 4.688 ( -2.593 -3.059 8.142) 9.076 4.915 ( -0.289 11.184 4.287) 11.981 5.241 ( 1.752 2.712 -2.405) 4.026 5.319 ( -0.950 -0.178 -1.871) 2.105 5.383 ( 1.780 -3.048 1.034) 3.678 5.609 ( 3.873 -4.050 -18.167) 19.011 6.635 ( -15.417 -14.809 2.563) 21.531 7.252 ( 10.060 -12.031 -3.304) 16.027 7.821 ( -13.443 -5.807 6.389) 15.977 8.342 ( 8.524 0.028 5.953) 10.397 8.392 ( -9.602 3.430 2.050) 10.400 9.312 ( 13.297 2.759 -9.855) 16.779 25.299 ( 0.631 29.182 1.087) 29.209 25.392 ( -1.851 31.641 -4.773) 32.052 27.575 ( -0.542 7.969 1.381) 8.106 27.690 ( 0.839 10.875 -1.866) 11.066 29.786 ( -4.718 -6.875 7.704) 11.353 30.174 ( 1.727 -6.442 -3.223) 7.407 34.069 ( -1.121 -30.224 4.470) 30.573 34.329 ( 0.188 -32.882 -4.755) 33.225 94.472 ( -0.386 16.702 3.381) 17.045 94.740 ( -6.357 22.102 -11.069) 25.523 96.995 ( -2.224 -5.880 0.630) 6.318 97.383 ( 13.262 -12.662 -4.699) 18.928 ======================= Grid point 295 (135/252) ======================= q-point: ( 0.20 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.663 ( 13.583 2.758 15.299) 20.644 1.925 ( 5.810 8.868 -10.768) 15.111 2.126 ( 2.151 13.088 21.566) 25.318 2.476 ( 7.935 3.071 -15.408) 17.601 2.986 ( -3.467 13.638 14.948) 20.530 3.314 ( 5.608 12.611 14.827) 20.257 3.376 ( -0.881 -0.361 4.458) 4.559 3.502 ( -7.976 2.636 -1.949) 8.623 3.934 ( -3.441 4.863 -2.584) 6.493 4.099 ( -0.504 1.296 -1.317) 1.915 4.175 ( -3.421 1.839 -6.924) 7.938 4.236 ( 1.515 1.093 -5.819) 6.111 4.724 ( 0.476 -3.696 7.793) 8.638 4.943 ( -0.489 10.827 5.612) 12.205 5.260 ( 1.415 1.294 -1.477) 2.420 5.299 ( -0.675 2.056 -1.181) 2.465 5.406 ( 0.302 -3.676 2.704) 4.574 5.593 ( 7.902 -4.152 -15.926) 18.257 6.342 ( -18.239 -20.375 2.083) 27.425 7.320 ( 1.147 -7.391 -7.394) 10.518 7.734 ( -3.701 -11.702 11.514) 16.829 8.218 ( -6.402 4.362 1.060) 7.819 8.600 ( 11.145 2.472 6.248) 13.014 9.393 ( 4.509 6.578 -11.493) 13.989 25.312 ( -0.235 28.913 -0.184) 28.915 25.338 ( -0.830 30.696 -1.566) 30.747 27.577 ( -0.398 8.078 1.490) 8.224 27.694 ( 1.001 10.840 -1.728) 11.022 29.763 ( -3.610 -5.728 7.252) 9.921 30.177 ( 1.054 -6.449 -3.256) 7.301 34.073 ( -1.819 -30.256 4.173) 30.596 34.289 ( -0.693 -33.141 -4.981) 33.520 94.479 ( -1.471 16.869 3.008) 17.198 94.582 ( -4.524 19.314 -5.414) 20.562 96.983 ( 0.346 -5.697 1.151) 5.822 97.552 ( 9.729 -14.395 -6.759) 18.642 ======================= Grid point 296 (136/252) ======================= q-point: ( 0.30 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.971 ( 13.882 6.501 -1.778) 15.432 2.079 ( 10.949 2.708 8.197) 13.943 2.311 ( 3.703 8.753 18.552) 20.845 2.571 ( 12.417 4.806 -11.140) 17.360 2.986 ( -8.433 7.857 19.166) 22.364 3.222 ( -10.689 -0.246 -6.295) 12.408 3.363 ( -2.179 -0.895 3.760) 4.437 3.661 ( 9.483 12.495 10.384) 18.811 3.843 ( -3.000 6.387 -5.635) 9.030 3.987 ( -13.402 -1.871 6.640) 15.074 4.041 ( -1.160 3.125 -12.393) 12.833 4.258 ( 4.979 4.906 -8.287) 10.841 4.806 ( 3.653 -1.396 4.949) 6.308 4.977 ( -0.815 8.556 6.994) 11.081 5.203 ( -5.400 9.514 -1.412) 11.031 5.323 ( 2.387 -6.529 0.962) 7.018 5.453 ( 1.271 -5.332 6.645) 8.614 5.656 ( 10.068 -5.310 -15.522) 19.248 6.032 ( -16.114 -23.280 1.553) 28.356 7.229 ( -4.670 -9.157 -9.223) 13.811 7.743 ( -3.848 -7.011 10.905) 13.523 8.240 ( 6.143 2.893 4.444) 8.115 8.800 ( 6.003 3.696 4.138) 8.174 9.345 ( -0.034 9.242 -10.968) 14.343 25.289 ( -0.600 28.751 -1.363) 28.789 25.338 ( 0.073 29.405 0.559) 29.411 27.581 ( -0.318 8.180 1.610) 8.343 27.701 ( 1.017 10.843 -1.624) 11.011 29.755 ( -2.767 -5.451 6.875) 9.199 30.167 ( 0.657 -6.310 -3.605) 7.297 34.062 ( -2.355 -30.347 3.607) 30.652 34.242 ( -0.477 -33.202 -4.655) 33.531 94.461 ( -1.874 16.466 1.145) 16.612 94.496 ( -2.471 16.924 -1.780) 17.196 97.021 ( 1.925 -6.189 3.213) 7.234 97.647 ( 6.363 -14.712 -7.214) 17.578 ======================= Grid point 297 (137/252) ======================= q-point: ( 0.40 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.185 ( 4.729 7.952 7.829) 12.120 2.293 ( 9.901 3.924 3.124) 11.099 2.517 ( 5.033 -0.420 5.953) 7.807 2.762 ( 14.554 7.509 -4.190) 16.905 2.965 ( -8.263 5.275 18.023) 20.517 3.011 ( -7.036 0.681 1.137) 7.160 3.322 ( -5.421 -1.059 1.700) 5.779 3.710 ( -9.619 -2.326 6.042) 11.595 3.748 ( -2.689 9.789 -7.769) 12.783 3.890 ( -1.609 9.292 4.119) 10.290 3.974 ( 3.185 2.795 -9.098) 10.036 4.279 ( 3.394 3.612 -7.698) 9.156 4.929 ( 5.845 2.194 4.172) 7.509 4.998 ( -2.716 5.002 6.693) 8.786 5.084 ( -5.415 10.295 -0.964) 11.672 5.359 ( -0.048 -7.458 1.129) 7.543 5.530 ( -1.055 -6.244 10.382) 12.161 5.709 ( 6.583 -16.381 -10.410) 20.495 5.843 ( -1.961 -14.609 -3.809) 15.225 7.023 ( -9.171 -12.921 -11.650) 19.666 7.798 ( 1.434 -0.905 11.393) 11.519 8.424 ( 7.259 2.093 8.701) 11.523 8.843 ( -2.541 3.277 -2.199) 4.694 9.287 ( 2.076 11.249 -8.074) 14.002 25.281 ( 0.452 28.295 -0.495) 28.303 25.337 ( -0.487 28.862 -0.019) 28.866 27.587 ( -0.343 8.227 1.713) 8.410 27.707 ( 0.874 10.877 -1.602) 11.029 29.756 ( -2.450 -5.562 6.706) 9.050 30.153 ( 0.782 -6.148 -3.989) 7.371 34.040 ( -2.564 -30.447 2.937) 30.696 34.214 ( 0.795 -33.197 -4.046) 33.452 94.437 ( -1.291 15.644 0.459) 15.704 94.456 ( -0.937 15.795 -0.881) 15.847 97.088 ( 1.803 -6.962 5.497) 9.052 97.688 ( 3.923 -14.693 -7.521) 16.966 ======================= Grid point 298 (138/252) ======================= q-point: (-0.50 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.177 ( -13.141 8.160 11.690) 19.389 2.404 ( -12.481 4.088 6.675) 14.732 2.568 ( 15.285 -3.002 -8.845) 17.913 2.942 ( -1.554 6.538 14.105) 15.624 2.984 ( 2.928 4.125 5.337) 7.354 3.122 ( 12.778 3.339 3.162) 13.580 3.185 ( -7.705 -3.131 0.542) 8.335 3.584 ( -7.880 3.483 5.518) 10.231 3.686 ( 0.974 10.404 -5.675) 11.891 3.799 ( -9.722 10.519 1.112) 14.367 4.015 ( 6.566 0.888 -7.595) 10.079 4.275 ( 2.021 -0.128 -6.858) 7.151 4.891 ( -10.494 1.259 6.130) 12.218 5.031 ( 1.477 8.023 1.568) 8.307 5.133 ( 8.644 4.500 1.809) 9.912 5.340 ( -1.488 -5.500 -0.209) 5.701 5.496 ( -6.827 -6.828 4.869) 10.814 5.830 ( 8.010 -14.016 -3.026) 16.425 5.884 ( 9.102 -17.305 -0.453) 19.558 6.769 ( -7.963 -12.547 -14.227) 20.573 7.933 ( 3.162 -0.677 13.312) 13.699 8.583 ( 2.821 3.598 8.325) 9.498 8.696 ( -9.372 3.482 -5.326) 11.328 9.311 ( 5.994 10.940 -7.446) 14.528 25.297 ( 1.434 28.435 0.108) 28.472 25.321 ( -0.918 28.551 -0.610) 28.573 27.592 ( -0.469 8.206 1.767) 8.407 27.709 ( 0.662 10.921 -1.646) 11.065 29.759 ( -2.443 -5.782 6.831) 9.277 30.142 ( 1.202 -6.078 -4.259) 7.519 34.013 ( -2.314 -30.507 2.411) 30.689 34.217 ( 2.464 -33.168 -3.499) 33.443 94.414 ( -1.432 14.705 0.384) 14.780 94.459 ( 1.954 16.137 -0.883) 16.278 97.154 ( 0.429 -7.556 6.933) 10.264 97.684 ( 1.830 -14.745 -8.415) 17.075 ======================= Grid point 299 (139/252) ======================= q-point: (-0.40 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.871 ( -23.234 0.277 2.121) 23.332 2.216 ( -15.936 12.600 15.246) 25.400 2.784 ( 11.570 -2.785 -4.115) 12.592 2.968 ( -6.637 11.336 17.403) 21.803 3.006 ( -6.774 -2.645 0.688) 7.305 3.087 ( 3.697 1.821 -5.518) 6.887 3.389 ( 6.746 3.916 -0.069) 7.801 3.528 ( -1.035 10.074 4.112) 10.930 3.575 ( -9.357 10.487 5.844) 15.221 3.708 ( 0.590 12.184 -2.116) 12.380 4.095 ( 7.439 -1.598 -6.030) 9.709 4.266 ( 2.038 -6.087 -5.611) 8.525 4.758 ( -8.263 -1.616 5.943) 10.306 5.061 ( 1.390 6.167 0.390) 6.333 5.283 ( 4.443 0.437 -2.066) 4.919 5.335 ( 1.916 0.484 1.763) 2.649 5.406 ( -4.653 -2.787 2.491) 5.968 5.913 ( 6.349 -11.838 -6.008) 14.716 6.121 ( 10.069 -20.763 9.028) 24.779 6.577 ( -0.137 -11.550 -14.501) 18.539 8.074 ( 1.141 -1.610 14.025) 14.163 8.449 ( -10.288 2.891 -9.770) 14.479 8.651 ( -3.266 5.733 10.579) 12.468 9.374 ( 6.694 9.014 -9.574) 14.755 25.296 ( -1.022 28.019 -0.814) 28.050 25.335 ( 2.421 29.699 0.128) 29.798 27.594 ( -0.648 8.134 1.736) 8.343 27.708 ( 0.493 10.957 -1.709) 11.100 29.764 ( -2.412 -6.089 7.364) 9.855 30.137 ( 1.578 -6.093 -4.437) 7.701 33.993 ( -1.625 -30.515 2.272) 30.642 34.250 ( 3.662 -33.117 -3.298) 33.481 94.396 ( -0.682 14.196 0.104) 14.213 94.515 ( 4.893 17.721 -0.720) 18.399 97.195 ( -1.485 -7.865 7.217) 10.777 97.632 ( -0.651 -14.739 -10.061) 17.858 ======================= Grid point 300 (140/252) ======================= q-point: (-0.30 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.458 ( -22.403 2.949 3.473) 22.862 2.011 ( -18.159 15.375 13.502) 27.358 2.856 ( -3.849 -3.821 0.160) 5.426 2.897 ( -12.614 22.022 9.595) 27.133 2.963 ( 4.083 -1.325 -5.399) 6.897 3.098 ( 2.880 2.179 -2.891) 4.626 3.268 ( -12.735 9.370 14.565) 21.497 3.555 ( -1.655 9.476 1.447) 9.728 3.670 ( 5.180 10.557 -2.945) 12.123 3.712 ( 4.122 5.561 3.272) 7.657 4.213 ( 9.530 -4.279 -2.271) 10.691 4.273 ( 2.715 -8.024 -5.162) 9.920 4.682 ( -4.815 -2.308 6.506) 8.416 5.081 ( 0.771 7.059 -3.191) 7.785 5.261 ( -1.106 -3.557 -1.001) 3.857 5.376 ( -0.948 -2.643 2.698) 3.894 5.407 ( 1.982 5.393 -0.755) 5.795 5.958 ( 1.565 -12.400 -5.048) 13.480 6.308 ( 10.213 -12.360 -4.527) 16.661 6.652 ( 12.736 -16.631 2.008) 21.043 8.110 ( -8.495 -0.154 5.680) 10.220 8.244 ( -3.770 1.997 -1.685) 4.587 8.647 ( -4.039 5.312 9.402) 11.529 9.386 ( 2.226 5.688 -12.611) 14.012 25.275 ( -0.615 28.101 -0.707) 28.116 25.386 ( 3.384 30.944 -0.663) 31.136 27.593 ( -0.810 8.042 1.612) 8.242 27.704 ( 0.415 10.977 -1.777) 11.128 29.778 ( -2.105 -6.744 8.327) 10.920 30.136 ( 1.815 -6.130 -4.518) 7.828 33.988 ( -0.765 -30.478 2.605) 30.599 34.296 ( 3.755 -32.986 -3.505) 33.383 94.392 ( 0.058 14.121 0.268) 14.124 94.633 ( 9.275 20.417 -1.808) 22.498 97.199 ( -3.282 -7.996 6.509) 10.820 97.511 ( -4.449 -13.977 -11.882) 18.877 ======================= Grid point 301 (141/252) ======================= q-point: (-0.20 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.186 ( -10.235 13.350 8.775) 18.974 1.740 ( -19.680 18.891 7.314) 28.243 2.686 ( -17.858 27.260 17.742) 37.105 2.724 ( -5.241 -2.166 -12.314) 13.557 3.032 ( 2.435 -1.224 6.160) 6.736 3.119 ( 1.076 1.640 -7.018) 7.287 3.218 ( -7.120 6.123 18.119) 20.408 3.510 ( -2.850 8.053 4.114) 9.482 3.667 ( 1.570 11.210 -5.293) 12.496 3.846 ( 4.640 4.531 1.235) 6.602 4.287 ( 2.744 -5.340 -4.869) 7.731 4.430 ( 14.463 -5.151 1.459) 15.422 4.670 ( -1.925 -1.630 6.686) 7.146 5.020 ( -3.125 8.198 -5.364) 10.283 5.285 ( 2.428 -3.776 0.626) 4.533 5.352 ( -2.587 4.802 -0.121) 5.456 5.405 ( -2.280 -1.643 0.219) 2.818 5.891 ( -0.574 -10.315 -13.947) 17.356 6.510 ( 14.380 -12.255 -2.641) 19.077 6.926 ( 10.838 -15.575 5.864) 19.860 7.943 ( -8.861 1.613 2.156) 9.262 8.255 ( 3.649 2.386 2.556) 5.054 8.649 ( -3.834 3.808 10.870) 12.139 9.249 ( -6.712 0.788 -15.577) 16.979 25.266 ( -0.009 28.336 -0.338) 28.338 25.443 ( 4.008 31.878 -2.809) 32.251 27.588 ( -0.886 7.960 1.450) 8.140 27.698 ( 0.415 10.983 -1.861) 11.147 29.805 ( -1.826 -8.148 9.197) 12.422 30.140 ( 2.016 -6.162 -4.412) 7.842 34.001 ( -0.141 -30.411 3.263) 30.585 34.330 ( 2.805 -32.622 -3.797) 32.962 94.402 ( 0.562 14.471 0.810) 14.505 94.822 ( 14.155 22.845 -6.495) 27.648 97.169 ( -4.446 -7.926 5.019) 10.382 97.306 ( -8.559 -11.170 -10.949) 17.830 ======================= Grid point 302 (142/252) ======================= q-point: (-0.10 0.15 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.239 ( 6.298 24.504 11.066) 27.614 1.440 ( -16.475 19.956 7.831) 27.037 2.506 ( -7.065 -2.172 -17.512) 19.008 2.562 ( -13.105 26.414 28.187) 40.792 2.916 ( -8.756 6.946 -11.648) 16.143 3.196 ( -4.269 3.849 15.882) 16.890 3.248 ( 3.652 -0.899 9.917) 10.607 3.553 ( 2.259 3.686 8.010) 9.102 3.689 ( 5.843 10.337 -5.748) 13.192 3.894 ( 1.219 4.723 -0.551) 4.909 4.302 ( 2.433 -0.807 -5.217) 5.813 4.673 ( 2.692 -3.161 4.981) 6.484 4.701 ( 5.398 -3.982 -0.691) 6.743 4.932 ( -2.796 9.323 -2.812) 10.132 5.271 ( -4.390 -3.741 -0.352) 5.778 5.288 ( -2.668 5.516 -2.078) 6.470 5.377 ( 0.071 -2.304 1.209) 2.602 5.778 ( 1.246 -8.120 -18.386) 20.137 6.748 ( 10.986 -11.750 1.341) 16.142 7.053 ( 1.122 -13.025 0.198) 13.075 7.861 ( -2.760 -0.531 5.926) 6.559 8.430 ( 10.093 5.284 0.449) 11.401 8.641 ( -5.937 2.709 10.952) 12.749 8.967 ( -8.194 -4.664 -13.819) 16.729 25.269 ( 0.394 28.692 0.150) 28.695 25.479 ( 2.728 32.021 -5.715) 32.641 27.582 ( -0.840 7.912 1.339) 8.069 27.693 ( 0.489 10.970 -1.939) 11.151 29.829 ( -2.875 -9.591 8.980) 13.450 30.148 ( 2.201 -6.219 -4.061) 7.747 34.026 ( -0.035 -30.330 3.955) 30.586 34.345 ( 1.860 -32.166 -3.814) 32.445 94.423 ( 0.728 15.176 1.676) 15.285 94.993 ( 10.820 23.142 -16.115) 30.205 97.111 ( -3.173 -7.482 -1.402) 8.247 97.118 ( -5.451 -7.231 0.817) 9.092 ======================= Grid point 303 (143/252) ======================= q-point: ( 0.00 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( -9.289 24.801 1.683) 26.537 2.014 ( 9.914 23.970 9.144) 27.504 2.319 ( -1.469 6.716 -13.979) 15.578 2.831 ( -8.415 9.501 -12.711) 17.962 3.131 ( -0.025 25.789 21.504) 33.579 3.308 ( -2.253 3.665 9.801) 10.704 3.326 ( -1.331 0.778 6.821) 6.993 3.710 ( 6.889 -0.855 9.951) 12.133 3.918 ( -1.852 6.901 -0.460) 7.160 4.076 ( 6.594 9.969 -3.954) 12.590 4.334 ( -1.277 1.857 -4.340) 4.890 4.499 ( -7.870 -5.496 -7.056) 11.913 4.655 ( -3.634 -1.026 6.538) 7.550 5.033 ( 1.184 3.656 1.613) 4.168 5.204 ( -1.247 -5.197 0.000) 5.345 5.249 ( 2.814 -2.794 2.389) 4.630 5.326 ( -1.331 -3.015 1.778) 3.744 5.567 ( 2.228 -6.495 -13.314) 14.981 6.691 ( -6.012 -5.588 -0.956) 8.263 6.792 ( 8.143 -17.172 -2.233) 19.136 7.892 ( -2.954 0.236 6.858) 7.471 8.367 ( -9.642 2.537 -8.990) 13.425 8.605 ( -9.530 2.395 6.204) 11.621 8.995 ( 20.973 -3.943 -4.797) 21.873 25.957 ( 0.642 40.327 1.211) 40.350 26.155 ( -0.411 40.183 -5.614) 40.575 27.765 ( -1.027 11.407 2.210) 11.664 27.941 ( 0.978 14.794 -2.891) 15.106 29.644 ( -3.404 -9.420 8.033) 12.840 30.014 ( 2.143 -8.904 -3.689) 9.874 33.341 ( -0.111 -42.639 3.732) 42.802 33.591 ( 0.564 -45.097 -3.509) 45.237 94.794 ( 0.584 18.971 4.058) 19.409 95.321 ( -2.126 16.705 -14.580) 22.274 96.893 ( -3.220 -9.275 1.379) 9.914 96.980 ( 6.453 -10.621 -0.739) 12.449 ======================= Grid point 304 (144/252) ======================= q-point: ( 0.10 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.622 ( 0.776 18.964 7.051) 20.247 2.178 ( 4.114 14.188 -3.611) 15.207 2.281 ( 1.154 18.025 7.262) 19.467 2.618 ( -2.698 7.509 -14.798) 16.812 3.237 ( -5.875 11.346 11.548) 17.222 3.348 ( -1.481 -1.384 4.048) 4.528 3.409 ( 9.066 21.367 15.077) 27.678 3.743 ( -10.145 1.523 -4.085) 11.042 3.960 ( 4.374 -3.003 10.521) 11.783 4.150 ( -1.837 7.591 -0.929) 7.865 4.222 ( 2.891 1.830 -7.924) 8.631 4.373 ( -1.979 3.105 -6.745) 7.684 4.629 ( -4.442 -2.795 8.587) 10.064 5.074 ( 0.718 4.458 3.894) 5.962 5.181 ( -1.048 -4.214 -0.240) 4.349 5.292 ( 0.155 -5.791 1.944) 6.110 5.356 ( 3.500 0.077 -0.523) 3.540 5.519 ( 2.718 -5.569 -12.906) 14.317 6.419 ( -18.861 -8.718 -2.669) 20.949 6.960 ( 8.065 -17.772 -0.596) 19.525 7.774 ( -11.346 0.996 4.589) 12.279 8.365 ( 8.673 2.914 1.494) 9.271 8.466 ( -6.859 3.938 1.538) 8.057 9.295 ( 15.598 -3.982 -8.204) 18.068 25.976 ( 0.322 40.364 1.580) 40.396 26.094 ( -1.948 40.559 -4.830) 40.892 27.764 ( -0.818 11.442 2.279) 11.695 27.940 ( 1.187 14.799 -2.806) 15.109 29.636 ( -3.415 -8.682 7.493) 11.966 30.025 ( 1.838 -8.904 -3.609) 9.781 33.360 ( -0.881 -42.595 3.870) 42.779 33.564 ( -0.616 -45.568 -3.941) 45.743 94.826 ( -0.639 19.220 4.875) 19.839 95.139 ( -6.566 18.869 -10.914) 22.766 96.854 ( -1.612 -8.591 0.463) 8.754 97.121 ( 9.030 -14.022 -2.336) 16.840 ======================= Grid point 305 (145/252) ======================= q-point: ( 0.20 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.800 ( 10.918 10.915 11.423) 19.205 2.163 ( 1.373 15.457 -9.611) 18.253 2.392 ( 2.593 13.146 11.395) 17.590 2.580 ( 6.676 8.477 -7.090) 12.911 3.189 ( -8.081 8.140 12.839) 17.216 3.342 ( -2.061 -1.448 4.117) 4.826 3.457 ( -12.052 -1.553 -7.595) 14.330 3.713 ( 10.730 18.412 7.677) 22.651 3.997 ( -3.459 1.043 0.170) 3.617 4.092 ( -5.729 0.348 6.614) 8.758 4.260 ( -2.717 6.109 -4.998) 8.348 4.311 ( 6.339 5.731 -9.361) 12.674 4.647 ( -0.547 -3.773 10.851) 11.501 5.107 ( -0.887 5.174 4.606) 6.984 5.170 ( 1.199 -4.577 -0.733) 4.788 5.310 ( -1.171 -5.973 3.617) 7.080 5.403 ( 1.780 2.501 -1.328) 3.345 5.501 ( 6.113 -5.223 -12.494) 14.857 6.017 ( -22.669 -13.064 -1.359) 26.199 7.033 ( 0.359 -20.148 -2.743) 20.337 7.675 ( -3.313 4.057 7.431) 9.091 8.334 ( -3.675 7.294 0.842) 8.211 8.631 ( 12.692 1.127 3.514) 13.218 9.434 ( 7.427 -1.966 -10.793) 13.248 25.982 ( -0.860 39.903 0.237) 39.913 26.035 ( -1.248 40.776 -2.039) 40.846 27.767 ( -0.656 11.491 2.378) 11.753 27.945 ( 1.377 14.823 -2.665) 15.124 29.628 ( -3.036 -8.229 6.935) 11.182 30.028 ( 1.345 -8.864 -3.805) 9.740 33.363 ( -1.668 -42.616 3.602) 42.801 33.517 ( -1.289 -45.957 -4.040) 46.152 94.834 ( -2.151 19.223 4.440) 19.846 94.963 ( -5.608 19.494 -6.508) 21.303 96.845 ( 0.238 -8.475 0.813) 8.517 97.250 ( 7.319 -16.359 -3.896) 18.340 ======================= Grid point 306 (146/252) ======================= q-point: ( 0.30 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( 14.615 7.212 8.034) 18.171 2.162 ( 7.755 8.117 -7.231) 13.354 2.516 ( 0.740 11.971 12.520) 17.338 2.714 ( 11.472 9.942 -3.501) 15.579 3.122 ( -8.723 4.037 9.240) 13.332 3.205 ( -11.355 0.206 0.703) 11.378 3.333 ( -2.180 -1.989 3.569) 4.631 3.822 ( -6.828 1.436 2.301) 7.347 3.928 ( -1.805 1.828 -2.131) 3.338 4.052 ( 1.546 10.827 3.418) 11.458 4.151 ( -2.480 7.607 -9.867) 12.703 4.360 ( 2.851 5.365 -3.664) 7.095 4.750 ( 2.976 -3.724 10.323) 11.371 5.112 ( -1.778 4.540 4.230) 6.455 5.206 ( 2.023 -4.220 0.109) 4.681 5.305 ( -0.702 -6.285 1.915) 6.607 5.386 ( -1.713 3.437 -1.716) 4.206 5.534 ( -0.868 -6.297 -9.517) 11.445 5.663 ( -9.804 -13.796 2.406) 17.095 6.928 ( -7.180 -20.375 -7.631) 22.911 7.734 ( 1.688 5.264 10.333) 11.719 8.353 ( 4.431 7.724 2.570) 9.268 8.842 ( 7.361 1.235 2.188) 7.778 9.440 ( 2.641 0.634 -10.861) 11.195 25.953 ( -1.133 39.493 -1.216) 39.528 26.020 ( -0.520 40.438 0.379) 40.443 27.773 ( -0.599 11.519 2.467) 11.795 27.952 ( 1.412 14.862 -2.562) 15.147 29.623 ( -2.679 -8.189 6.517) 10.803 30.021 ( 1.011 -8.782 -4.147) 9.764 33.350 ( -2.237 -42.697 3.011) 42.862 33.468 ( -0.920 -46.149 -3.683) 46.305 94.811 ( -2.859 19.054 2.436) 19.421 94.849 ( -3.359 19.039 -2.937) 19.555 96.872 ( 1.407 -9.065 2.347) 9.470 97.331 ( 5.005 -17.411 -4.621) 18.696 ======================= Grid point 307 (147/252) ======================= q-point: ( 0.40 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.284 ( 13.980 4.664 -10.037) 17.831 2.447 ( 9.267 3.775 10.215) 14.299 2.545 ( -6.499 9.190 6.758) 13.129 2.915 ( 9.279 6.201 -2.533) 11.444 3.003 ( -1.063 2.444 2.198) 3.454 3.111 ( -8.120 6.893 17.512) 20.496 3.281 ( -6.922 -3.035 1.724) 7.752 3.659 ( -8.980 -2.343 4.550) 10.336 3.914 ( 1.553 5.114 -2.369) 5.846 4.035 ( -1.824 6.932 -8.241) 10.922 4.101 ( 0.198 9.454 -2.883) 9.886 4.360 ( 0.530 3.904 -4.615) 6.068 4.871 ( 1.050 -8.350 9.943) 13.026 5.083 ( -3.150 3.267 1.382) 4.745 5.228 ( 0.718 0.338 -0.864) 1.173 5.298 ( -4.016 6.195 -0.998) 7.450 5.355 ( 2.091 -13.204 0.841) 13.395 5.396 ( -3.973 -8.299 7.045) 11.588 5.679 ( 4.854 -6.919 -6.078) 10.411 6.708 ( -8.580 -19.040 -11.647) 23.912 7.849 ( 2.304 5.952 11.036) 12.749 8.502 ( 7.285 5.437 6.258) 11.036 8.897 ( -1.462 2.486 -2.666) 3.927 9.419 ( 3.384 2.418 -8.605) 9.557 25.938 ( 0.233 39.234 -0.391) 39.236 26.009 ( -0.890 40.030 -0.031) 40.040 27.779 ( -0.664 11.509 2.535) 11.804 27.958 ( 1.255 14.875 -2.542) 15.142 29.621 ( -2.519 -8.358 6.321) 10.778 30.009 ( 1.043 -8.720 -4.442) 9.841 33.326 ( -2.413 -42.795 2.299) 42.925 33.439 ( 0.435 -46.190 -3.062) 46.293 94.775 ( -2.578 18.638 1.418) 18.869 94.795 ( -0.792 18.664 -1.733) 18.761 96.923 ( 1.442 -9.984 4.131) 10.901 97.368 ( 2.906 -17.809 -5.158) 18.767 ======================= Grid point 308 (148/252) ======================= q-point: (-0.50 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.290 ( -16.439 3.642 -1.027) 16.869 2.537 ( 13.576 0.905 -7.755) 15.661 2.573 ( -2.952 11.643 11.001) 16.288 2.997 ( 6.641 -0.026 1.196) 6.748 3.089 ( -8.371 1.573 11.079) 13.974 3.128 ( -7.166 2.038 10.256) 12.676 3.218 ( 12.382 5.771 -0.404) 13.667 3.597 ( -3.214 -1.070 7.451) 8.185 3.920 ( 1.135 12.101 -4.458) 12.946 4.010 ( 0.072 6.894 -0.656) 6.925 4.017 ( -1.655 3.142 -6.819) 7.688 4.314 ( -1.336 3.165 -7.572) 8.314 4.838 ( -10.419 -6.383 7.855) 14.526 5.121 ( 5.089 0.239 1.303) 5.258 5.204 ( -1.679 1.427 -0.960) 2.403 5.263 ( 0.708 -2.650 -0.877) 2.880 5.389 ( 1.697 -0.430 3.179) 3.630 5.497 ( 4.404 -13.694 12.530) 19.076 5.709 ( 4.820 -7.284 -8.730) 12.349 6.484 ( -5.459 -16.492 -14.367) 22.543 7.967 ( 1.582 4.436 12.406) 13.270 8.652 ( 3.789 3.656 2.777) 5.953 8.779 ( -8.006 4.770 -1.103) 9.384 9.442 ( 5.301 2.525 -8.457) 10.295 25.954 ( 1.122 39.121 0.345) 39.139 25.990 ( -0.421 39.980 -0.732) 39.989 27.784 ( -0.823 11.476 2.575) 11.790 27.961 ( 1.013 14.834 -2.582) 15.091 29.620 ( -2.510 -8.558 6.388) 10.970 29.998 ( 1.318 -8.729 -4.602) 9.956 33.298 ( -2.100 -42.869 1.733) 42.956 33.443 ( 2.159 -46.119 -2.492) 46.237 94.737 ( -2.179 18.125 0.741) 18.270 94.803 ( 2.718 18.806 -1.150) 19.036 96.975 ( 0.512 -10.749 5.291) 11.991 97.364 ( 0.909 -17.847 -5.953) 18.836 ======================= Grid point 309 (149/252) ======================= q-point: (-0.40 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.932 ( -19.663 6.055 -1.175) 20.608 2.493 ( -11.701 15.307 12.427) 22.927 2.754 ( 10.549 -0.147 -4.073) 11.309 2.950 ( -4.484 -2.802 -1.586) 5.521 3.114 ( 3.356 1.721 0.657) 3.828 3.175 ( -2.730 8.628 14.680) 17.246 3.412 ( 9.913 -1.139 0.218) 9.980 3.661 ( 3.197 2.676 9.618) 10.482 3.823 ( -8.316 12.608 -2.125) 15.252 3.961 ( 0.659 13.420 -2.822) 13.729 4.081 ( 4.630 1.057 -1.743) 5.058 4.204 ( -2.214 0.456 -10.696) 10.932 4.699 ( -9.507 -3.404 7.743) 12.725 5.140 ( -0.210 0.619 -0.781) 1.018 5.231 ( 0.125 -3.729 0.158) 3.735 5.269 ( 0.979 -4.554 1.072) 4.780 5.453 ( 2.268 2.434 1.549) 3.670 5.691 ( 6.902 -9.708 2.719) 12.218 5.789 ( 10.323 -13.035 3.730) 17.041 6.327 ( 0.293 -14.092 -15.174) 20.710 8.072 ( -0.417 1.835 13.266) 13.399 8.538 ( -7.938 6.052 -10.930) 14.802 8.748 ( -3.661 4.123 11.135) 12.426 9.471 ( 4.418 1.030 -10.541) 11.475 25.951 ( -0.906 39.308 -0.538) 39.322 26.016 ( 3.171 40.165 -0.132) 40.291 27.785 ( -1.024 11.444 2.556) 11.770 27.959 ( 0.829 14.766 -2.632) 15.022 29.620 ( -2.518 -8.748 6.762) 11.340 29.992 ( 1.596 -8.794 -4.641) 10.071 33.278 ( -1.341 -42.904 1.555) 42.953 33.479 ( 3.418 -45.944 -2.238) 46.125 94.711 ( -1.019 17.880 0.362) 17.913 94.877 ( 6.344 19.169 -0.881) 20.211 97.009 ( -1.027 -11.140 5.458) 12.447 97.316 ( -1.253 -17.382 -6.968) 18.768 ======================= Grid point 310 (150/252) ======================= q-point: (-0.30 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.627 ( -12.362 13.760 1.541) 18.562 2.340 ( -13.867 17.875 10.626) 24.995 2.804 ( -2.081 -1.350 0.933) 2.650 2.935 ( 3.350 -1.116 -8.946) 9.617 3.143 ( 3.086 2.433 -1.226) 4.116 3.227 ( -3.103 10.900 14.402) 18.327 3.526 ( -6.573 13.437 -0.639) 14.972 3.694 ( 2.765 5.035 5.500) 7.952 3.777 ( -3.233 3.144 5.697) 7.265 3.902 ( -0.340 11.084 -1.840) 11.240 4.162 ( 7.109 0.217 -5.030) 8.711 4.173 ( 5.032 -0.937 -4.884) 7.075 4.627 ( -4.630 -2.779 8.414) 9.998 5.160 ( 2.325 -2.489 0.192) 3.411 5.186 ( -3.107 -0.929 -1.335) 3.507 5.302 ( 0.357 -3.911 2.553) 4.684 5.470 ( -1.067 -0.702 0.128) 1.283 5.747 ( 2.382 -8.980 -6.663) 11.433 6.077 ( 12.958 -10.247 2.312) 16.681 6.346 ( 12.146 -15.471 -4.395) 20.155 8.109 ( -5.686 0.610 9.708) 11.267 8.342 ( -4.753 7.668 -6.245) 10.972 8.736 ( -4.926 3.630 8.905) 10.805 9.423 ( -1.317 -1.457 -13.098) 13.244 25.934 ( -0.446 39.547 -0.592) 39.553 26.081 ( 4.126 40.445 -0.821) 40.664 27.783 ( -1.197 11.422 2.459) 11.744 27.955 ( 0.763 14.728 -2.688) 14.991 29.625 ( -2.462 -9.029 7.418) 11.942 29.991 ( 1.783 -8.863 -4.560) 10.125 33.273 ( -0.420 -42.886 1.858) 42.928 33.529 ( 3.643 -45.649 -2.376) 45.856 94.706 ( 0.061 17.878 0.638) 17.890 95.021 ( 10.475 19.211 -1.920) 21.965 97.012 ( -2.558 -11.176 4.705) 12.393 97.218 ( -3.964 -15.851 -7.613) 18.026 ======================= Grid point 311 (151/252) ======================= q-point: (-0.20 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.552 ( 1.795 22.910 5.335) 23.591 2.141 ( -14.300 21.850 5.315) 26.649 2.697 ( -4.948 -0.044 -13.122) 14.024 2.977 ( 4.642 -3.249 5.332) 7.780 3.177 ( -3.266 10.804 -0.734) 11.311 3.221 ( -6.602 17.066 7.279) 19.693 3.358 ( -7.734 9.428 9.029) 15.173 3.622 ( -8.302 3.100 5.511) 10.435 3.869 ( 4.483 6.817 -1.537) 8.303 3.951 ( 4.485 8.401 0.465) 9.535 4.224 ( 6.364 -1.397 -4.601) 7.976 4.347 ( 11.989 -2.391 1.988) 12.385 4.634 ( -1.489 -1.755 7.748) 8.082 5.115 ( -3.063 0.570 -1.946) 3.674 5.207 ( 1.600 -3.215 0.325) 3.606 5.315 ( -1.075 -4.206 3.327) 5.469 5.413 ( -5.492 -1.688 0.046) 5.746 5.698 ( 0.154 -9.350 -11.492) 14.816 6.285 ( 14.083 -11.259 -5.766) 18.930 6.635 ( 13.866 -13.999 5.195) 20.377 8.000 ( -8.677 3.592 2.678) 9.765 8.332 ( 5.196 5.571 1.221) 7.715 8.708 ( -5.043 2.220 8.674) 10.276 9.220 ( -10.217 -3.329 -15.113) 18.544 25.929 ( 0.229 39.792 -0.147) 39.793 26.145 ( 3.918 40.380 -2.607) 40.653 27.777 ( -1.268 11.407 2.323) 11.710 27.950 ( 0.780 14.744 -2.772) 15.022 29.634 ( -2.495 -9.478 8.085) 12.705 29.993 ( 1.956 -8.899 -4.331) 10.089 33.288 ( 0.242 -42.818 2.506) 42.892 33.571 ( 2.893 -45.238 -2.721) 45.412 94.722 ( 0.809 18.124 1.469) 18.202 95.216 ( 13.054 17.879 -5.646) 22.846 96.985 ( -3.392 -10.899 3.149) 11.841 97.073 ( -6.104 -12.701 -6.135) 15.369 ======================= Grid point 312 (152/252) ======================= q-point: (-0.10 0.23 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.733 ( 10.352 25.325 8.420) 28.626 1.903 ( -12.625 27.183 -0.432) 29.975 2.493 ( -4.902 1.066 -16.771) 17.505 3.042 ( -8.694 15.076 1.257) 17.449 3.094 ( -6.916 14.849 10.218) 19.307 3.175 ( 5.010 1.122 7.376) 8.987 3.339 ( -4.525 6.204 10.453) 12.970 3.589 ( -0.397 0.547 6.883) 6.916 3.906 ( 3.279 10.915 -3.337) 11.875 4.016 ( 2.541 8.049 -0.549) 8.458 4.313 ( 4.667 1.159 -1.643) 5.082 4.557 ( 7.302 -7.017 -1.138) 10.191 4.662 ( -1.179 -1.090 5.773) 5.992 5.049 ( -2.761 2.334 -1.632) 3.967 5.202 ( -1.529 -3.161 0.320) 3.526 5.279 ( -4.954 -3.417 0.120) 6.020 5.335 ( -1.991 -3.849 4.093) 5.961 5.624 ( 1.681 -7.567 -13.471) 15.542 6.524 ( 15.088 -13.196 -3.458) 20.341 6.808 ( 1.674 -10.930 1.567) 11.168 7.897 ( -4.154 3.655 3.349) 6.468 8.526 ( 10.609 4.254 0.946) 11.469 8.659 ( -5.729 -0.677 6.728) 8.863 8.887 ( -11.277 -2.901 -12.717) 17.242 25.939 ( 0.621 40.072 0.518) 40.080 26.177 ( 2.168 40.072 -4.683) 40.402 27.770 ( -1.202 11.399 2.223) 11.676 27.945 ( 0.846 14.779 -2.865) 15.078 29.644 ( -2.897 -9.782 8.322) 13.165 30.001 ( 2.130 -8.904 -3.990) 9.987 33.314 ( 0.344 -42.724 3.222) 42.847 33.593 ( 1.750 -44.937 -3.079) 45.076 94.754 ( 1.045 18.545 2.713) 18.771 95.364 ( 8.399 15.862 -12.092) 21.642 96.940 ( -2.098 -10.039 0.040) 10.256 96.952 ( -3.840 -9.754 -0.283) 10.487 ======================= Grid point 313 (153/252) ======================= q-point: ( 0.00 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.156 ( -7.275 23.966 -2.193) 25.142 2.402 ( 2.397 12.872 -7.371) 15.025 2.572 ( 4.804 21.776 2.254) 22.413 3.034 ( -9.211 10.815 -8.315) 16.461 3.248 ( 4.031 -3.947 4.884) 7.462 3.422 ( -2.730 4.061 2.756) 5.616 3.577 ( 2.931 13.684 13.442) 19.404 3.728 ( 6.071 7.660 10.293) 14.195 4.033 ( -10.279 3.637 -1.233) 10.973 4.248 ( 5.588 5.191 -4.128) 8.673 4.350 ( -0.471 2.091 -1.820) 2.812 4.435 ( -2.453 -0.037 3.432) 4.219 4.661 ( -3.200 1.726 2.651) 4.500 5.056 ( 1.969 -1.493 2.753) 3.700 5.104 ( -3.300 -4.127 1.020) 5.382 5.160 ( -0.636 -5.468 2.429) 6.017 5.266 ( 1.986 -2.871 2.494) 4.290 5.437 ( 1.478 -6.528 -10.552) 12.495 6.416 ( 10.796 -20.738 -0.558) 23.387 6.553 ( -9.143 -10.587 -5.274) 14.949 7.944 ( -5.239 5.433 6.312) 9.839 8.432 ( -4.811 3.821 -7.938) 10.037 8.652 ( -7.271 2.548 2.975) 8.259 8.910 ( 17.643 -4.697 -4.337) 18.766 26.828 ( 0.736 49.256 1.336) 49.279 27.011 ( -0.539 47.977 -4.421) 48.183 28.013 ( -1.388 14.033 3.232) 14.467 28.254 ( 1.333 17.256 -3.756) 17.710 29.447 ( -2.772 -11.004 7.565) 13.638 29.818 ( 2.196 -11.278 -3.677) 12.064 32.419 ( 0.248 -52.079 3.009) 52.166 32.621 ( -0.049 -54.399 -2.884) 54.475 95.167 ( 0.554 19.279 4.319) 19.765 95.607 ( -1.491 13.331 -9.749) 16.582 96.691 ( -2.284 -11.430 1.119) 11.710 96.764 ( 3.805 -11.590 -0.760) 12.223 ======================= Grid point 314 (154/252) ======================= q-point: ( 0.10 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.032 ( -3.657 22.308 -0.026) 22.606 2.447 ( 7.089 13.382 -4.243) 15.727 2.656 ( -1.676 19.702 7.040) 20.989 2.809 ( -5.949 12.157 -8.564) 16.016 3.304 ( -0.588 -2.678 3.612) 4.535 3.376 ( -4.400 3.449 2.587) 6.161 3.724 ( -15.749 -2.481 -4.065) 16.454 3.786 ( 7.523 6.765 9.870) 14.134 3.960 ( 7.495 10.837 9.079) 16.001 4.248 ( -3.723 5.387 -2.423) 6.982 4.355 ( 2.600 8.693 -0.906) 9.119 4.424 ( 0.100 1.695 0.440) 1.754 4.599 ( -5.190 0.307 4.346) 6.776 5.077 ( -0.361 -3.301 0.702) 3.394 5.131 ( 1.863 -1.438 4.849) 5.390 5.155 ( -1.502 -7.333 3.266) 8.166 5.338 ( 3.834 -1.775 0.415) 4.245 5.399 ( 2.934 -6.067 -10.629) 12.586 6.234 ( -19.261 -11.485 -7.505) 23.648 6.571 ( 4.888 -22.055 1.484) 22.639 7.862 ( -6.743 7.818 5.034) 11.486 8.448 ( 9.329 4.692 -2.244) 10.681 8.544 ( -5.582 4.502 1.024) 7.244 9.180 ( 15.086 -7.280 -6.851) 18.097 26.848 ( 0.089 49.218 1.632) 49.245 26.957 ( -1.794 48.325 -4.107) 48.533 28.013 ( -1.168 14.077 3.293) 14.505 28.254 ( 1.545 17.268 -3.678) 17.723 29.447 ( -2.869 -10.786 7.126) 13.242 29.830 ( 1.958 -11.183 -3.778) 11.966 32.438 ( -0.602 -52.015 3.223) 52.119 32.586 ( -1.384 -54.795 -3.225) 54.907 95.200 ( -0.758 19.033 5.005) 19.695 95.474 ( -5.205 16.002 -8.314) 18.770 96.665 ( -1.210 -10.860 0.524) 10.939 96.847 ( 5.513 -14.172 -1.343) 15.266 ======================= Grid point 315 (155/252) ======================= q-point: ( 0.20 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.057 ( 4.432 14.848 5.348) 16.392 2.501 ( -5.052 18.106 -7.929) 20.401 2.608 ( 7.736 10.577 -0.428) 13.111 2.820 ( 2.851 15.079 6.971) 16.856 3.261 ( -7.830 -3.056 -2.985) 8.919 3.312 ( -2.309 -2.217 2.431) 4.020 3.435 ( -12.486 2.679 3.544) 13.253 3.897 ( -3.292 -3.613 6.274) 7.953 4.072 ( -2.111 10.144 -2.876) 10.753 4.194 ( 0.984 9.313 4.713) 10.485 4.379 ( -1.008 5.735 -0.782) 5.875 4.432 ( 3.781 6.544 -5.838) 9.550 4.597 ( -0.014 -0.802 10.450) 10.481 5.095 ( 1.477 -2.636 0.974) 3.174 5.128 ( -1.531 -4.467 1.913) 5.094 5.200 ( -1.248 -3.757 7.784) 8.733 5.389 ( 0.726 -3.735 -3.964) 5.494 5.401 ( 5.821 -4.043 -6.565) 9.660 5.811 ( -19.604 -9.020 -6.751) 22.611 6.602 ( -2.217 -23.683 -0.252) 23.788 7.826 ( -1.104 10.430 6.099) 12.132 8.483 ( -1.080 7.228 -0.025) 7.308 8.657 ( 12.388 2.030 0.945) 12.588 9.341 ( 8.927 -6.888 -9.281) 14.604 26.844 ( -1.495 48.690 -0.029) 48.713 26.906 ( -1.094 48.863 -1.507) 48.898 28.017 ( -1.022 14.091 3.358) 14.522 28.258 ( 1.776 17.311 -3.558) 17.761 29.444 ( -2.816 -10.721 6.591) 12.896 29.834 ( 1.525 -11.132 -4.134) 11.972 32.441 ( -1.466 -51.991 2.993) 52.098 32.531 ( -1.967 -55.197 -3.177) 55.324 95.206 ( -2.284 18.870 4.549) 19.544 95.328 ( -5.077 18.088 -5.692) 19.630 96.657 ( -0.045 -10.849 0.723) 10.873 96.929 ( 4.746 -16.548 -2.220) 17.358 ======================= Grid point 316 (156/252) ======================= q-point: ( 0.30 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( 9.485 6.209 8.355) 14.082 2.381 ( 1.107 12.475 -10.911) 16.610 2.768 ( 4.718 13.895 7.145) 16.322 2.933 ( 4.579 10.400 1.172) 11.424 3.066 ( -5.978 -4.685 -4.015) 8.591 3.286 ( -3.087 -2.785 2.576) 4.891 3.309 ( -9.164 6.851 10.936) 15.827 3.786 ( -10.307 -3.242 2.673) 11.130 3.978 ( -3.630 3.465 -1.461) 5.227 4.241 ( 1.363 6.114 -0.626) 6.296 4.309 ( -2.755 8.472 -6.189) 10.847 4.463 ( -0.685 5.057 0.532) 5.131 4.681 ( 0.153 -3.164 8.073) 8.672 5.127 ( 0.347 -3.187 1.188) 3.419 5.141 ( 1.191 -1.844 1.991) 2.963 5.210 ( -1.924 -4.320 7.500) 8.867 5.305 ( -6.404 -6.488 -2.118) 9.359 5.478 ( 5.346 -6.247 -4.478) 9.363 5.528 ( -5.465 2.490 -4.945) 7.779 6.494 ( -6.876 -23.652 -5.480) 25.234 7.899 ( 2.731 10.759 8.515) 13.990 8.511 ( 3.455 7.808 1.440) 8.658 8.862 ( 8.850 1.087 -0.068) 8.917 9.389 ( 4.373 -5.214 -9.727) 11.871 26.807 ( -1.485 48.319 -0.997) 48.353 26.889 ( -0.838 48.896 0.256) 48.904 28.022 ( -0.994 14.041 3.389) 14.478 28.267 ( 1.816 17.376 -3.507) 17.820 29.439 ( -2.690 -10.822 6.176) 12.748 29.828 ( 1.199 -11.131 -4.544) 12.083 32.427 ( -2.073 -52.014 2.369) 52.110 32.478 ( -1.443 -55.445 -2.692) 55.529 95.182 ( -3.068 18.926 2.908) 19.392 95.220 ( -3.304 19.033 -3.156) 19.574 96.673 ( 0.734 -11.465 1.725) 11.618 96.985 ( 3.336 -18.078 -2.786) 18.593 ======================= Grid point 317 (157/252) ======================= q-point: ( 0.40 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( 8.974 7.691 -8.882) 14.784 2.444 ( 4.150 -0.803 4.891) 6.465 2.791 ( -4.220 8.855 1.115) 9.872 2.941 ( 0.915 2.187 3.065) 3.875 3.133 ( 4.862 5.982 4.144) 8.751 3.208 ( -7.623 0.220 4.379) 8.794 3.256 ( -2.863 5.473 8.281) 10.331 3.632 ( -7.479 -0.465 2.893) 8.033 3.950 ( 0.712 0.731 0.719) 1.249 4.207 ( -2.300 8.749 -5.452) 10.562 4.242 ( -0.915 4.766 -4.227) 6.436 4.404 ( -4.339 0.369 1.440) 4.586 4.707 ( -1.949 -5.492 5.705) 8.156 5.099 ( -3.934 -2.917 3.805) 6.202 5.171 ( 0.695 -5.907 -0.525) 5.971 5.214 ( -3.306 -6.933 7.304) 10.599 5.298 ( 4.640 3.303 1.816) 5.979 5.422 ( -1.407 5.302 -5.300) 7.627 5.554 ( 3.965 -5.516 -3.734) 7.752 6.310 ( -6.322 -21.418 -10.317) 24.599 8.013 ( 2.149 10.445 9.769) 14.462 8.615 ( 5.210 5.641 4.058) 8.685 8.945 ( 1.353 2.547 -3.793) 4.765 9.395 ( 3.988 -4.172 -8.110) 9.953 26.788 ( -0.001 48.186 -0.146) 48.186 26.872 ( -1.085 48.660 -0.158) 48.672 28.028 ( -1.068 13.945 3.413) 14.396 28.273 ( 1.598 17.368 -3.556) 17.800 29.433 ( -2.582 -10.982 5.981) 12.769 29.816 ( 1.180 -11.166 -4.830) 12.223 32.401 ( -2.233 -52.078 1.609) 52.151 32.448 ( 0.046 -55.500 -1.997) 55.536 95.143 ( -3.068 19.035 1.853) 19.370 95.165 ( -0.566 19.340 -2.043) 19.456 96.705 ( 0.887 -12.415 2.954) 12.792 97.011 ( 1.854 -18.832 -3.279) 19.205 ======================= Grid point 318 (158/252) ======================= q-point: (-0.50 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.347 ( -12.893 2.675 -0.586) 13.181 2.573 ( 14.384 3.199 -7.817) 16.680 2.813 ( 0.765 9.207 5.325) 10.664 2.965 ( 1.256 -1.877 1.451) 2.684 3.043 ( -8.707 -1.473 2.180) 9.096 3.251 ( -1.104 6.661 16.803) 18.108 3.333 ( 5.684 5.705 -2.813) 8.530 3.572 ( -2.205 -1.002 5.780) 6.267 3.988 ( 2.418 -0.175 -0.213) 2.434 4.144 ( -3.527 8.013 0.037) 8.755 4.191 ( 0.805 8.909 -2.282) 9.232 4.364 ( -0.171 1.325 -5.801) 5.953 4.703 ( -3.255 -5.743 6.439) 9.222 5.092 ( -0.262 -5.037 6.371) 8.126 5.133 ( -1.798 -4.256 -1.801) 4.959 5.254 ( -3.090 -3.722 6.347) 7.980 5.306 ( 0.503 -1.612 -0.141) 1.695 5.460 ( 5.928 4.033 -0.360) 7.179 5.582 ( 2.991 -5.388 -4.870) 7.854 6.145 ( -2.511 -18.014 -12.978) 22.344 8.103 ( -0.155 9.318 10.806) 14.269 8.723 ( 2.908 3.257 2.452) 5.008 8.873 ( -5.222 4.941 -3.209) 7.873 9.421 ( 4.570 -4.180 -8.040) 10.149 26.802 ( 0.978 48.141 0.614) 48.155 26.852 ( -0.233 48.602 -0.866) 48.611 28.031 ( -1.210 13.865 3.456) 14.340 28.274 ( 1.290 17.233 -3.627) 17.658 29.429 ( -2.521 -11.106 6.026) 12.885 29.805 ( 1.386 -11.217 -4.935) 12.333 32.372 ( -1.894 -52.165 0.993) 52.209 32.454 ( 1.905 -55.383 -1.383) 55.433 95.101 ( -2.357 19.171 0.910) 19.336 95.174 ( 2.674 19.229 -1.183) 19.450 96.741 ( 0.400 -13.284 3.780) 13.817 97.006 ( 0.399 -18.844 -3.885) 19.244 ======================= Grid point 319 (159/252) ======================= q-point: (-0.40 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.094 ( -12.098 10.219 -0.896) 15.861 2.770 ( 0.626 5.103 0.901) 5.219 2.780 ( 1.894 8.864 1.522) 9.191 2.912 ( -2.948 0.258 -0.603) 3.020 3.100 ( 7.214 -3.434 1.089) 8.064 3.322 ( -1.040 4.478 3.203) 5.603 3.389 ( 3.436 1.513 7.464) 8.355 3.638 ( 2.362 -4.008 8.330) 9.541 4.006 ( -1.124 6.535 0.185) 6.634 4.119 ( 1.398 4.988 1.169) 5.310 4.228 ( 4.120 10.419 -3.640) 11.780 4.277 ( -3.556 6.128 -8.300) 10.913 4.658 ( -6.538 -0.370 5.917) 8.825 5.090 ( -1.857 -4.592 0.384) 4.968 5.155 ( -0.590 -4.473 5.297) 6.958 5.213 ( -0.167 -1.411 1.536) 2.092 5.373 ( 2.054 -7.957 3.502) 8.933 5.588 ( 6.297 -8.375 -0.915) 10.518 5.622 ( 8.076 0.308 -0.679) 8.110 6.039 ( 1.374 -15.321 -13.818) 20.677 8.158 ( -2.595 7.075 11.555) 13.795 8.671 ( -4.861 7.093 -10.407) 13.500 8.809 ( -4.164 2.375 9.311) 10.472 9.427 ( 2.390 -5.082 -9.957) 11.432 26.805 ( -0.624 48.480 -0.317) 48.485 26.877 ( 3.234 48.436 -0.251) 48.544 28.032 ( -1.388 13.850 3.485) 14.349 28.270 ( 1.113 17.061 -3.640) 17.481 29.427 ( -2.477 -11.173 6.322) 13.074 29.798 ( 1.606 -11.279 -4.879) 12.393 32.351 ( -1.074 -52.255 0.762) 52.271 32.494 ( 3.278 -55.120 -1.101) 55.228 95.074 ( -1.100 19.295 0.541) 19.334 95.245 ( 5.939 18.623 -0.850) 19.566 96.767 ( -0.625 -13.758 3.864) 14.304 96.971 ( -1.036 -18.020 -4.468) 18.595 ======================= Grid point 320 (160/252) ======================= q-point: (-0.30 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( -2.424 18.915 0.835) 19.088 2.672 ( -8.766 14.446 7.140) 18.344 2.811 ( -1.459 3.413 1.978) 4.206 2.916 ( 1.825 -0.886 -10.472) 10.666 3.183 ( 4.541 1.630 0.178) 4.828 3.363 ( 2.300 2.611 3.785) 5.141 3.581 ( 10.226 -2.398 7.438) 12.870 3.689 ( -2.985 -6.054 6.757) 9.551 3.971 ( -4.530 13.658 -0.170) 14.391 4.118 ( -2.544 11.118 -2.662) 11.712 4.222 ( 4.556 5.118 0.904) 6.912 4.259 ( 2.980 8.593 -6.681) 11.285 4.599 ( -3.887 0.565 7.786) 8.721 5.072 ( -1.378 -4.723 2.123) 5.359 5.156 ( -1.093 -3.193 3.371) 4.770 5.231 ( -0.637 -3.335 1.945) 3.913 5.398 ( -0.315 -5.096 0.047) 5.106 5.591 ( -0.338 -7.784 -5.845) 9.740 5.909 ( 13.912 -8.414 -1.058) 16.293 6.046 ( 11.946 -15.185 -5.272) 20.027 8.160 ( -5.842 5.061 9.876) 12.541 8.512 ( -4.174 9.131 -7.314) 12.421 8.785 ( -5.110 1.540 7.649) 9.327 9.346 ( -3.239 -6.078 -12.044) 13.874 26.793 ( -0.199 48.779 -0.566) 48.782 26.944 ( 4.037 48.318 -0.676) 48.491 28.029 ( -1.555 13.895 3.444) 14.399 28.265 ( 1.122 16.997 -3.618) 17.414 29.428 ( -2.428 -11.214 6.832) 13.354 29.795 ( 1.757 -11.348 -4.663) 12.394 32.346 ( -0.075 -52.291 1.035) 52.301 32.550 ( 3.616 -54.770 -1.265) 54.904 95.070 ( 0.087 19.392 0.867) 19.412 95.373 ( 8.843 17.156 -1.559) 19.364 96.771 ( -1.727 -13.693 3.199) 14.167 96.906 ( -2.588 -16.184 -4.576) 17.017 ======================= Grid point 321 (161/252) ======================= q-point: (-0.20 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.022 ( 7.859 24.604 2.481) 25.948 2.558 ( -8.259 20.181 4.816) 22.331 2.719 ( -5.152 2.309 -12.392) 13.617 2.924 ( 4.791 -1.668 3.236) 6.017 3.276 ( 4.236 4.004 -2.420) 6.311 3.418 ( 0.913 3.391 3.253) 4.787 3.589 ( -6.764 0.644 4.953) 8.408 3.751 ( -11.632 17.609 2.092) 21.208 3.913 ( 11.118 -0.759 5.267) 12.326 4.138 ( 1.177 8.667 4.480) 9.827 4.253 ( 1.856 5.877 -5.072) 7.982 4.356 ( 8.144 2.490 0.368) 8.524 4.619 ( -0.507 0.800 6.933) 6.997 5.059 ( -2.302 -4.705 3.347) 6.216 5.163 ( -0.362 -2.423 0.688) 2.544 5.225 ( -1.522 -4.816 3.461) 6.123 5.348 ( -5.664 -3.650 -0.586) 6.764 5.528 ( 0.230 -8.183 -8.769) 11.996 6.039 ( 10.685 -14.483 -9.189) 20.208 6.384 ( 17.327 -12.704 4.001) 21.854 8.083 ( -7.871 5.461 5.563) 11.078 8.462 ( 2.953 7.282 -2.070) 8.126 8.736 ( -5.759 0.707 6.077) 8.402 9.135 ( -9.982 -5.173 -13.020) 17.202 26.793 ( 0.460 48.980 -0.143) 48.982 27.004 ( 3.369 48.095 -2.019) 48.256 28.024 ( -1.637 13.952 3.336) 14.438 28.260 ( 1.197 17.078 -3.642) 17.503 29.434 ( -2.433 -11.246 7.378) 13.669 29.796 ( 1.927 -11.394 -4.296) 12.329 32.361 ( 0.645 -52.255 1.681) 52.286 32.600 ( 2.901 -54.420 -1.747) 54.525 95.089 ( 0.902 19.456 1.771) 19.557 95.527 ( 9.661 14.669 -3.951) 18.003 96.752 ( -2.234 -13.094 1.980) 13.430 96.819 ( -3.615 -13.438 -3.398) 14.325 ======================= Grid point 322 (162/252) ======================= q-point: (-0.10 0.31 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.198 ( 5.659 22.506 2.802) 23.375 2.448 ( -4.363 26.832 -1.554) 27.228 2.553 ( -1.246 6.094 -12.175) 13.672 3.078 ( 6.841 -3.506 6.489) 10.060 3.240 ( -4.421 8.481 -6.826) 11.750 3.437 ( -1.007 3.145 2.473) 4.126 3.528 ( -5.742 12.591 10.252) 17.222 3.622 ( -2.931 9.385 8.178) 12.789 4.093 ( 3.005 8.278 2.130) 9.061 4.186 ( 1.496 7.462 2.330) 7.960 4.301 ( 6.313 -2.448 -2.172) 7.110 4.456 ( 1.195 -1.902 -0.124) 2.250 4.659 ( 0.140 0.955 4.720) 4.817 5.039 ( -1.600 -2.729 2.148) 3.824 5.147 ( -1.413 -2.536 0.818) 3.016 5.209 ( -7.325 -4.935 1.626) 8.981 5.237 ( -0.400 -3.357 2.310) 4.095 5.483 ( 1.490 -7.086 -9.898) 12.264 6.209 ( 13.166 -18.451 -4.977) 23.206 6.614 ( 5.195 -11.086 -0.403) 12.249 7.991 ( -5.502 6.183 4.729) 9.532 8.587 ( 7.635 1.837 0.256) 7.857 8.644 ( -5.069 -0.088 -0.169) 5.073 8.853 ( -9.749 -1.048 -8.287) 12.838 26.807 ( 0.827 49.131 0.589) 49.142 27.030 ( 1.578 47.892 -3.534) 48.048 28.018 ( -1.576 13.993 3.242) 14.450 28.257 ( 1.245 17.199 -3.723) 17.641 29.442 ( -2.570 -11.197 7.677) 13.817 29.805 ( 2.133 -11.369 -3.895) 12.206 32.390 ( 0.753 -52.169 2.430) 52.231 32.626 ( 1.526 -54.245 -2.338) 54.317 95.125 ( 1.117 19.435 3.046) 19.704 95.634 ( 5.647 12.558 -7.762) 15.806 96.724 ( -1.943 -12.205 1.339) 12.431 96.747 ( -1.667 -11.143 -1.475) 11.363 ======================= Grid point 323 (163/252) ======================= q-point: ( 0.00 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.567 ( 0.879 15.880 -3.600) 16.307 2.641 ( -1.945 15.549 -5.217) 16.515 3.018 ( 1.476 21.223 1.831) 21.353 3.119 ( 2.292 -4.281 4.068) 6.335 3.272 ( -5.822 8.562 -4.581) 11.322 3.432 ( -0.328 -3.050 -3.126) 4.380 3.635 ( 1.684 -0.450 5.048) 5.341 3.984 ( -12.571 -6.426 -4.780) 14.905 4.039 ( 6.439 14.612 8.944) 18.302 4.335 ( 3.675 6.744 4.272) 8.788 4.409 ( -1.073 1.905 8.616) 8.889 4.509 ( 1.995 6.362 1.994) 6.959 4.704 ( -2.471 1.282 1.960) 3.405 4.940 ( -1.633 -7.853 5.609) 9.787 5.080 ( -0.880 -0.858 1.502) 1.941 5.087 ( -2.424 -2.358 2.564) 4.244 5.249 ( 1.310 3.169 -2.124) 4.033 5.342 ( 3.008 -1.934 -10.405) 11.003 6.003 ( 9.105 -21.180 -1.171) 23.084 6.268 ( -8.554 -18.399 -7.645) 21.683 8.094 ( -4.611 9.377 6.333) 12.218 8.486 ( -2.560 0.713 -2.540) 3.676 8.703 ( -3.752 2.613 -1.434) 4.792 8.824 ( 12.878 -3.683 -5.168) 14.356 27.848 ( 0.863 55.429 1.121) 55.448 28.002 ( -0.604 53.734 -3.666) 53.863 28.302 ( -1.722 15.522 4.214) 16.176 28.600 ( 1.564 18.264 -4.453) 18.864 29.219 ( -2.505 -12.263 7.300) 14.490 29.578 ( 2.296 -13.350 -3.506) 13.993 31.346 ( 0.572 -58.065 2.410) 58.118 31.509 ( -0.549 -59.740 -2.358) 59.789 95.532 ( 0.303 18.208 3.700) 18.583 95.850 ( -0.773 11.952 -6.006) 13.398 96.452 ( -1.483 -13.222 1.260) 13.365 96.536 ( 2.084 -11.853 -1.089) 12.084 ======================= Grid point 324 (164/252) ======================= q-point: ( 0.10 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( -6.541 20.910 -4.145) 22.298 2.687 ( 7.171 11.456 -1.719) 13.624 3.021 ( -6.979 16.291 0.222) 17.725 3.066 ( -2.307 13.626 2.234) 13.999 3.237 ( 0.512 -3.436 2.911) 4.533 3.352 ( -5.846 -5.783 -6.498) 10.481 3.668 ( -11.209 -3.379 0.249) 11.710 3.741 ( -0.247 -5.435 5.501) 7.737 4.271 ( 8.601 13.847 5.920) 17.343 4.381 ( -1.375 7.997 1.837) 8.319 4.433 ( -2.568 1.322 6.635) 7.237 4.531 ( 0.225 7.851 0.049) 7.854 4.642 ( -3.702 3.559 1.119) 5.256 4.943 ( -2.019 -9.185 5.353) 10.821 5.081 ( -0.452 -1.005 3.065) 3.257 5.104 ( 1.348 -1.055 3.511) 3.906 5.291 ( 4.343 -2.116 -2.894) 5.632 5.330 ( 3.392 -0.048 -8.961) 9.581 5.963 ( -16.267 -16.166 -9.602) 24.863 6.126 ( 3.614 -23.118 1.204) 23.430 8.051 ( -3.953 10.879 5.145) 12.667 8.493 ( 3.285 -0.626 -0.104) 3.346 8.659 ( 1.650 7.053 -2.601) 7.696 9.034 ( 13.206 -7.290 -5.949) 16.215 27.867 ( -0.024 55.363 1.317) 55.379 27.954 ( -1.580 54.061 -3.486) 54.197 28.303 ( -1.496 15.633 4.311) 16.285 28.599 ( 1.782 18.077 -4.367) 18.682 29.221 ( -2.742 -12.290 6.847) 14.333 29.593 ( 2.034 -13.166 -3.723) 13.833 31.366 ( -0.334 -57.987 2.696) 58.051 31.467 ( -2.023 -60.041 -2.664) 60.135 95.556 ( -0.812 17.619 4.138) 18.117 95.767 ( -3.384 14.383 -5.548) 15.783 96.436 ( -1.053 -12.650 0.938) 12.729 96.574 ( 2.778 -13.930 -1.254) 14.260 ======================= Grid point 325 (165/252) ======================= q-point: ( 0.20 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.353 ( -2.394 15.307 0.203) 15.494 2.759 ( -2.611 9.981 -6.127) 11.999 2.899 ( 2.080 16.320 1.511) 16.521 3.113 ( -2.022 11.065 4.599) 12.152 3.131 ( -8.143 -4.646 -4.588) 10.438 3.248 ( -1.291 -3.808 2.236) 4.601 3.505 ( -6.956 1.909 3.105) 7.853 3.778 ( -3.108 -7.489 5.884) 10.018 4.252 ( -9.706 8.654 -2.997) 13.345 4.342 ( -2.936 5.584 5.885) 8.628 4.475 ( 0.521 3.518 1.861) 4.014 4.558 ( 3.304 5.310 -2.158) 6.616 4.626 ( -1.802 3.395 4.681) 6.057 4.968 ( 0.281 -8.942 7.436) 11.633 5.091 ( -1.064 0.745 2.799) 3.086 5.149 ( -0.587 -2.259 4.515) 5.082 5.307 ( 0.365 -3.103 -6.523) 7.233 5.351 ( 3.891 -0.633 -5.107) 6.452 5.648 ( -8.301 -7.929 -7.676) 13.809 6.136 ( -2.697 -23.802 -0.617) 23.962 8.049 ( 0.109 12.016 5.183) 13.087 8.548 ( 2.399 -1.389 0.981) 2.940 8.749 ( 9.104 7.602 -2.204) 12.064 9.194 ( 9.292 -7.791 -7.561) 14.291 27.853 ( -1.867 54.859 -0.614) 54.894 27.914 ( -0.839 54.748 -0.863) 54.762 28.307 ( -1.426 15.693 4.316) 16.338 28.604 ( 2.154 18.109 -4.237) 18.722 29.216 ( -2.843 -12.530 6.295) 14.308 29.598 ( 1.536 -13.160 -4.223) 13.906 31.370 ( -1.246 -57.963 2.498) 58.030 31.405 ( -2.572 -60.337 -2.498) 60.443 95.558 ( -2.008 17.376 3.737) 17.886 95.666 ( -3.686 16.865 -4.166) 17.759 96.429 ( -0.504 -12.672 0.995) 12.721 96.612 ( 2.322 -16.239 -1.603) 16.483 ======================= Grid point 326 (166/252) ======================= q-point: ( 0.30 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( 2.217 7.224 4.248) 8.668 2.624 ( -3.128 12.255 -7.814) 14.867 2.873 ( -8.099 -8.570 -4.742) 12.709 3.038 ( 4.328 12.757 5.373) 14.504 3.164 ( -2.925 0.669 3.085) 4.304 3.263 ( 3.633 7.122 2.171) 8.285 3.417 ( -6.667 3.282 5.280) 9.116 3.719 ( -5.680 -3.682 2.674) 7.278 4.069 ( -7.869 5.887 -0.534) 9.842 4.305 ( -3.543 2.119 1.063) 4.263 4.467 ( -1.792 6.774 0.791) 7.052 4.516 ( -9.090 -0.068 1.532) 9.219 4.634 ( 0.930 -1.304 3.014) 3.413 4.991 ( -5.483 -11.740 8.052) 15.255 5.104 ( -1.119 -1.478 3.422) 3.892 5.131 ( -0.916 -0.326 2.227) 2.430 5.283 ( 3.349 0.980 -3.869) 5.210 5.405 ( 5.669 -0.242 -4.731) 7.387 5.560 ( 0.495 0.495 -5.287) 5.333 6.037 ( -5.133 -22.791 -5.437) 23.986 8.125 ( 3.189 12.083 6.659) 14.160 8.610 ( 3.267 0.972 2.021) 3.962 8.905 ( 8.934 4.097 -2.832) 10.229 9.267 ( 5.169 -6.704 -8.107) 11.721 27.811 ( -1.562 54.862 -0.944) 54.892 27.898 ( -1.045 54.724 0.178) 54.734 28.311 ( -1.461 15.559 4.236) 16.191 28.615 ( 2.233 18.388 -4.258) 19.007 29.207 ( -2.773 -12.828 5.896) 14.387 29.590 ( 1.170 -13.316 -4.717) 14.176 31.346 ( -1.927 -60.703 -1.763) 60.759 31.358 ( -1.875 -57.785 1.732) 57.842 95.537 ( -2.619 17.616 2.602) 17.999 95.584 ( -2.591 18.495 -2.641) 18.861 96.432 ( -0.066 -13.262 1.492) 13.346 96.635 ( 1.608 -18.024 -1.856) 18.190 ======================= Grid point 327 (167/252) ======================= q-point: ( 0.40 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.443 ( 0.322 1.010 4.279) 4.409 2.575 ( 3.759 9.417 -7.118) 12.388 2.746 ( -2.716 -7.048 -1.270) 7.659 3.073 ( -6.886 -4.433 0.218) 8.192 3.148 ( 3.136 10.400 4.381) 11.713 3.322 ( -5.094 6.026 6.827) 10.434 3.385 ( 4.299 7.416 1.316) 8.673 3.634 ( -5.219 0.294 1.764) 5.517 3.989 ( -1.831 3.639 2.867) 4.982 4.248 ( -0.549 -1.944 -3.526) 4.063 4.355 ( -8.718 2.326 5.277) 10.453 4.432 ( -3.204 6.355 1.601) 7.294 4.656 ( -1.182 -1.782 2.762) 3.493 4.932 ( -6.556 -11.333 9.246) 16.028 5.104 ( -0.002 -1.316 1.664) 2.121 5.137 ( -1.613 -2.376 3.378) 4.434 5.336 ( 4.381 -0.863 -4.916) 6.641 5.483 ( 5.786 1.531 -3.307) 6.838 5.531 ( -0.426 3.275 -4.722) 5.762 5.905 ( -2.929 -19.505 -9.589) 21.931 8.234 ( 2.503 11.866 7.913) 14.481 8.689 ( 3.018 1.049 3.734) 4.914 9.001 ( 4.096 3.415 -5.535) 7.686 9.288 ( 3.653 -6.164 -7.120) 10.102 27.792 ( -0.087 55.007 -0.028) 55.007 27.877 ( -1.173 54.530 -0.253) 54.543 28.313 ( -1.515 15.345 4.186) 15.978 28.622 ( 1.858 18.517 -4.458) 19.137 29.199 ( -2.618 -13.018 5.737) 14.465 29.577 ( 1.167 -13.494 -5.013) 14.442 31.315 ( -0.284 -60.753 -1.041) 60.762 31.331 ( -2.058 -57.800 0.989) 57.846 95.504 ( -2.604 18.156 1.730) 18.423 95.539 ( -0.494 19.181 -1.790) 19.271 96.446 ( 0.146 -14.188 2.154) 14.352 96.644 ( 0.934 -18.976 -2.114) 19.116 ======================= Grid point 328 (168/252) ======================= q-point: (-0.50 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( -6.193 3.430 1.631) 7.265 2.655 ( 9.953 4.953 -6.435) 12.845 2.780 ( 5.849 -7.340 1.920) 9.580 2.943 ( -6.210 -3.034 -1.851) 7.155 3.161 ( -4.239 10.903 3.733) 12.280 3.360 ( 1.794 4.152 11.224) 12.101 3.429 ( -0.287 4.120 -3.136) 5.186 3.566 ( -3.567 0.196 3.137) 4.754 4.017 ( 2.630 3.253 2.551) 4.900 4.239 ( -3.020 3.327 5.449) 7.062 4.338 ( 4.507 -0.047 2.254) 5.040 4.380 ( -1.185 5.813 -4.200) 7.268 4.633 ( -2.520 -2.054 3.247) 4.595 4.905 ( -4.351 -12.057 11.868) 17.469 5.096 ( -0.469 -0.290 -0.833) 0.999 5.162 ( 0.536 -3.258 4.989) 5.983 5.346 ( 0.115 0.764 -5.097) 5.155 5.475 ( -1.356 0.522 -4.022) 4.277 5.560 ( 4.975 1.428 -3.705) 6.366 5.808 ( 0.271 -16.123 -11.571) 19.847 8.311 ( -0.626 11.542 8.809) 14.534 8.758 ( 1.000 -0.233 4.152) 4.277 8.972 ( -1.923 5.211 -6.656) 8.669 9.306 ( 3.487 -6.915 -7.074) 10.488 27.806 ( 1.005 55.004 0.680) 55.017 27.858 ( -0.181 54.635 -0.885) 54.642 28.315 ( -1.563 15.249 4.261) 15.910 28.620 ( 1.389 18.252 -4.621) 18.879 29.193 ( -2.479 -13.066 5.789) 14.504 29.564 ( 1.410 -13.567 -5.094) 14.560 31.299 ( -1.750 -58.068 0.338) 58.095 31.324 ( 1.732 -60.452 -0.391) 60.478 95.471 ( -2.014 18.786 1.002) 18.920 95.544 ( 2.112 18.936 -1.120) 19.086 96.465 ( 0.033 -15.118 2.608) 15.342 96.640 ( 0.358 -18.924 -2.448) 19.086 ======================= Grid point 329 (169/252) ======================= q-point: (-0.40 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( -3.440 11.574 0.829) 12.103 2.812 ( 9.221 1.565 -5.495) 10.848 2.842 ( -1.008 -0.700 -4.280) 4.452 2.952 ( 9.885 -6.766 3.123) 12.379 3.106 ( -4.832 10.836 6.415) 13.487 3.350 ( -3.922 1.164 -3.587) 5.441 3.467 ( 1.581 2.760 8.685) 9.250 3.543 ( -2.248 -5.139 4.487) 7.184 4.125 ( 5.813 6.718 4.235) 9.842 4.224 ( -2.598 5.832 5.424) 8.378 4.336 ( 2.852 2.680 -8.221) 9.105 4.436 ( 2.156 7.927 0.629) 8.238 4.661 ( 1.650 -0.789 3.491) 3.941 4.929 ( -3.157 -12.207 12.546) 17.787 5.102 ( 1.474 0.057 0.169) 1.484 5.188 ( -2.401 -2.110 4.971) 5.910 5.295 ( 0.377 1.140 -3.396) 3.602 5.455 ( 1.779 -4.644 -3.156) 5.890 5.613 ( 4.302 -1.912 -3.697) 5.986 5.746 ( 2.430 -14.557 -12.634) 19.428 8.334 ( -3.791 10.552 9.356) 14.603 8.762 ( -2.516 0.645 -0.837) 2.729 8.874 ( -4.523 5.540 -1.331) 7.275 9.295 ( 0.886 -7.958 -8.773) 11.878 27.815 ( -0.243 55.231 -0.242) 55.232 27.879 ( 3.015 54.505 -0.344) 54.590 28.316 ( -1.645 15.408 4.405) 16.110 28.611 ( 1.256 17.855 -4.564) 18.472 29.191 ( -2.371 -13.037 6.052) 14.568 29.556 ( 1.618 -13.559 -5.008) 14.544 31.275 ( -0.916 -58.155 0.054) 58.162 31.369 ( 3.225 -60.255 -0.092) 60.342 95.449 ( -0.942 19.218 0.727) 19.254 95.598 ( 4.542 17.849 -0.829) 18.437 96.481 ( -0.422 -15.714 2.622) 15.937 96.623 ( -0.170 -17.843 -2.738) 18.052 ======================= Grid point 330 (170/252) ======================= q-point: (-0.30 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.326 ( 4.797 18.797 0.987) 19.424 2.789 ( -0.202 2.102 -2.463) 3.245 2.894 ( 2.028 -1.420 -10.144) 10.441 3.028 ( -4.424 13.685 6.855) 15.932 3.189 ( 8.494 -2.260 2.383) 9.107 3.327 ( 5.152 -2.953 -1.879) 6.229 3.526 ( -0.421 -5.567 4.881) 7.416 3.582 ( 3.443 -3.059 7.749) 9.014 4.201 ( -1.873 10.737 8.678) 13.932 4.279 ( 5.493 6.248 -3.321) 8.958 4.342 ( 2.102 5.352 -4.835) 7.512 4.449 ( -0.629 10.103 -0.074) 10.123 4.663 ( -2.472 5.282 3.252) 6.677 4.941 ( -4.226 -9.548 10.078) 14.512 5.119 ( -0.404 0.320 1.984) 2.050 5.175 ( -2.032 -2.294 3.250) 4.467 5.320 ( 2.074 -2.252 -1.729) 3.516 5.449 ( -0.855 -6.233 -4.885) 7.965 5.707 ( 6.297 -12.495 -9.898) 17.139 5.778 ( 13.812 -12.240 -1.596) 18.524 8.303 ( -6.474 9.283 8.413) 14.102 8.664 ( -4.204 5.063 -5.404) 8.515 8.807 ( -4.777 1.813 4.343) 6.705 9.204 ( -3.572 -8.148 -10.360) 13.656 27.808 ( 0.078 55.561 -0.656) 55.565 27.941 ( 3.723 53.965 -0.614) 54.097 28.316 ( -1.797 15.755 4.437) 16.466 28.604 ( 1.472 17.758 -4.375) 18.348 29.193 ( -2.268 -12.946 6.531) 14.676 29.553 ( 1.718 -13.582 -4.738) 14.487 31.269 ( 0.173 -58.263 0.314) 58.264 31.432 ( 3.614 -59.951 -0.321) 60.061 95.448 ( 0.092 19.391 1.019) 19.418 95.691 ( 6.287 15.849 -1.247) 17.096 96.485 ( -0.941 -15.690 2.224) 15.875 96.595 ( -0.809 -15.891 -2.759) 16.149 ======================= Grid point 331 (171/252) ======================= q-point: (-0.20 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.474 ( 9.357 21.110 0.124) 23.091 2.753 ( -1.307 3.000 -8.614) 9.215 2.835 ( 0.191 2.816 -0.411) 2.852 3.018 ( -0.481 14.984 4.407) 15.626 3.329 ( 5.402 0.340 0.656) 5.452 3.418 ( 4.785 -2.321 -3.042) 6.127 3.545 ( -0.547 -3.207 3.875) 5.059 3.789 ( 12.880 -7.202 5.957) 15.914 4.135 ( -10.675 16.009 0.686) 19.254 4.298 ( -1.319 7.906 8.643) 11.787 4.398 ( 4.478 4.651 -4.183) 7.693 4.422 ( -0.755 7.149 0.808) 7.234 4.672 ( -0.330 3.695 3.005) 4.774 4.933 ( -3.738 -8.589 9.035) 13.014 5.126 ( -1.119 -0.619 2.856) 3.130 5.148 ( -2.571 -2.732 2.072) 4.286 5.313 ( -1.669 0.748 -1.600) 2.430 5.389 ( 0.837 -5.380 -8.233) 9.870 5.745 ( 7.408 -14.977 -10.197) 19.575 6.103 ( 17.379 -16.665 1.383) 24.118 8.223 ( -7.545 8.790 6.119) 13.100 8.582 ( -1.038 3.744 -2.720) 4.742 8.744 ( -5.262 0.954 3.071) 6.167 9.027 ( -7.288 -5.772 -10.405) 13.953 27.811 ( 0.614 55.605 -0.339) 55.610 27.996 ( 2.964 53.489 -1.624) 53.596 28.313 ( -1.963 15.938 4.286) 16.621 28.602 ( 1.674 18.033 -4.293) 18.613 29.200 ( -2.209 -12.743 7.076) 14.742 29.553 ( 1.890 -13.632 -4.257) 14.406 31.285 ( 0.980 -58.259 0.977) 58.275 31.488 ( 2.851 -59.698 -0.949) 59.773 95.466 ( 0.766 19.266 1.770) 19.362 95.796 ( 6.311 13.256 -2.630) 14.916 96.479 ( -1.176 -15.024 1.738) 15.170 96.557 ( -1.266 -13.470 -2.336) 13.729 ======================= Grid point 332 (172/252) ======================= q-point: (-0.10 0.38 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.568 ( 1.926 13.145 -4.523) 14.035 2.699 ( 0.467 13.417 -4.317) 14.102 2.908 ( 6.516 9.329 2.810) 11.721 3.061 ( 2.267 10.084 0.928) 10.378 3.375 ( -0.575 3.743 -2.361) 4.462 3.442 ( 0.926 -1.509 -3.437) 3.866 3.581 ( 1.757 0.931 3.105) 3.687 3.952 ( -5.955 15.232 7.380) 17.943 4.070 ( 9.715 -8.782 0.274) 13.099 4.313 ( -6.834 9.288 7.943) 14.003 4.369 ( -0.877 5.060 2.784) 5.841 4.464 ( 1.914 2.366 -0.034) 3.043 4.690 ( 0.688 1.123 3.365) 3.614 4.932 ( -2.748 -8.156 7.375) 11.334 5.106 ( -2.669 -2.095 1.843) 3.861 5.119 ( -2.539 -2.712 2.180) 4.307 5.267 ( -1.331 6.751 -1.784) 7.109 5.362 ( 2.729 -4.324 -10.062) 11.287 5.847 ( 10.006 -18.087 -6.006) 21.525 6.329 ( 6.337 -18.343 -2.786) 19.606 8.140 ( -5.687 8.944 5.656) 12.014 8.574 ( -2.431 -3.087 0.750) 4.000 8.679 ( 1.687 3.333 -3.146) 4.884 8.833 ( -6.265 -1.160 -6.683) 9.233 27.825 ( 0.956 55.484 0.367) 55.493 28.019 ( 1.281 53.480 -2.806) 53.569 28.306 ( -1.960 15.711 4.158) 16.370 28.602 ( 1.629 18.303 -4.385) 18.892 29.210 ( -2.285 -12.461 7.397) 14.670 29.562 ( 2.174 -13.564 -3.736) 14.236 31.315 ( 1.113 -58.168 1.767) 58.206 31.517 ( 1.280 -59.607 -1.715) 59.645 95.497 ( 0.869 18.839 2.770) 19.061 95.864 ( 3.545 11.395 -4.725) 12.836 96.468 ( -1.325 -14.152 1.554) 14.298 96.526 ( -0.186 -11.542 -1.621) 11.657 ======================= Grid point 333 (173/252) ======================= q-point: ( 0.00 0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.794 ( 4.988 10.103 -0.673) 11.288 2.962 ( 1.984 1.620 0.146) 2.566 2.993 ( -0.198 6.618 -1.339) 6.755 3.249 ( -1.607 -9.611 -4.148) 10.591 3.408 ( -2.403 13.060 -0.751) 13.301 3.454 ( -1.896 5.633 -1.948) 6.255 3.620 ( -3.351 0.372 0.193) 3.377 3.780 ( -9.326 -12.369 -4.281) 16.071 4.283 ( 7.444 9.199 6.142) 13.333 4.393 ( 5.439 -2.285 3.145) 6.685 4.499 ( -3.726 7.503 11.780) 14.455 4.642 ( -3.743 -2.844 7.909) 9.200 4.658 ( 0.888 4.565 5.563) 7.251 4.806 ( -1.433 -6.611 5.860) 8.950 5.046 ( -0.634 -1.068 1.778) 2.169 5.053 ( 0.748 -1.495 0.872) 1.886 5.368 ( 3.960 8.022 -9.040) 12.719 5.470 ( -1.953 13.854 -6.690) 15.509 5.634 ( 6.152 -14.245 -4.480) 16.150 5.874 ( -6.519 -21.215 -7.827) 23.533 8.281 ( -3.466 9.357 5.273) 11.286 8.435 ( -2.635 -5.852 2.843) 7.019 8.748 ( 1.460 1.893 -4.721) 5.292 8.777 ( 7.158 -1.455 -5.763) 9.304 28.604 ( -1.924 15.415 4.925) 16.297 28.839 ( -1.687 2.819 2.052) 3.873 28.883 ( 2.466 31.827 -2.172) 31.996 28.983 ( 0.624 30.523 -3.732) 30.757 29.215 ( -1.674 41.251 1.243) 41.304 29.343 ( 2.247 -1.590 -1.154) 2.985 30.196 ( 0.787 -59.716 2.196) 59.761 30.334 ( -0.881 -60.745 -1.943) 60.782 95.869 ( -0.149 16.550 2.667) 16.765 96.073 ( -0.026 10.088 -3.378) 10.638 96.184 ( -0.745 -13.398 1.738) 13.531 96.307 ( 0.890 -11.659 -1.851) 11.838 ======================= Grid point 334 (174/252) ======================= q-point: ( 0.10 0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.829 ( -8.291 17.409 -6.488) 20.344 2.896 ( 5.193 10.103 0.934) 11.398 3.064 ( 1.071 -7.095 1.840) 7.408 3.128 ( -6.554 -12.400 -6.497) 15.457 3.363 ( -2.697 14.122 2.901) 14.667 3.375 ( -5.525 10.634 -0.064) 11.984 3.561 ( -6.364 -7.740 1.272) 10.101 3.603 ( -3.815 -9.280 3.003) 10.474 4.433 ( 0.572 4.075 3.370) 5.319 4.466 ( 1.160 0.917 2.683) 3.064 4.537 ( -0.505 7.438 6.821) 10.104 4.635 ( -2.275 0.361 4.678) 5.214 4.704 ( 0.688 2.863 5.211) 5.985 4.785 ( -3.467 -5.858 3.449) 7.630 5.083 ( 1.536 0.457 2.960) 3.366 5.090 ( 0.869 -0.513 2.664) 2.849 5.337 ( -0.232 8.748 -5.377) 10.271 5.419 ( 2.615 9.150 -8.113) 12.505 5.631 ( -9.016 -16.810 -7.843) 20.624 5.714 ( 2.312 -18.342 -3.013) 18.731 8.259 ( -2.265 10.055 4.028) 11.066 8.423 ( -0.459 -6.440 2.191) 6.818 8.792 ( 6.731 6.359 -4.390) 10.247 8.908 ( 10.397 -5.886 -5.245) 13.048 28.604 ( -1.824 15.486 4.750) 16.301 28.825 ( -1.320 6.751 1.916) 7.140 28.921 ( 3.426 26.541 -2.594) 26.887 28.962 ( -0.160 34.342 -3.040) 34.477 29.179 ( -3.354 38.389 1.490) 38.564 29.366 ( 1.361 -1.257 -1.584) 2.438 30.217 ( -0.263 -59.659 2.459) 59.711 30.288 ( -2.409 -60.783 -2.199) 60.870 95.880 ( -0.844 15.819 2.851) 16.096 96.035 ( -1.331 12.890 -3.309) 13.374 96.178 ( -1.108 -13.381 1.700) 13.534 96.307 ( 0.506 -13.630 -1.874) 13.768 ======================= Grid point 335 (175/252) ======================= q-point: ( 0.20 0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.639 ( -7.663 13.957 -3.551) 16.313 2.885 ( -10.155 -10.118 -6.076) 15.569 2.952 ( -1.088 7.715 -1.615) 7.957 3.099 ( -1.151 -5.186 0.884) 5.385 3.271 ( -3.906 11.202 2.437) 12.111 3.387 ( 0.111 11.167 5.860) 12.612 3.468 ( -3.450 -4.779 1.151) 6.006 3.614 ( -0.425 -9.572 4.617) 10.636 4.377 ( -7.902 4.882 1.918) 9.485 4.454 ( -3.653 -0.465 -1.913) 4.150 4.521 ( -6.656 7.210 9.888) 13.931 4.618 ( -1.104 0.671 0.487) 1.381 4.682 ( -4.010 2.079 -0.254) 4.524 4.786 ( -2.553 -9.364 6.814) 11.860 5.106 ( -1.476 0.196 3.693) 3.982 5.115 ( -0.123 -1.070 3.652) 3.808 5.334 ( 2.445 6.385 -4.142) 7.994 5.410 ( 3.167 5.849 -7.627) 10.120 5.506 ( 1.708 -5.295 -4.935) 7.437 5.709 ( -0.867 -19.264 -3.872) 19.668 8.274 ( 1.231 10.836 3.661) 11.504 8.456 ( 2.507 -7.559 2.127) 8.243 8.906 ( 8.309 7.879 -4.125) 12.171 9.049 ( 8.942 -7.172 -5.774) 12.834 28.605 ( -1.644 15.714 4.618) 16.461 28.818 ( -0.884 11.665 1.826) 11.840 28.929 ( -0.051 25.478 -4.046) 25.797 28.975 ( 3.179 35.922 -1.347) 36.088 29.120 ( -4.239 33.634 1.830) 33.949 29.368 ( 0.350 -2.008 -2.346) 3.107 30.209 ( -2.487 -61.128 -0.188) 61.178 30.234 ( -1.686 -59.569 0.452) 59.594 95.878 ( -1.506 15.640 2.608) 15.928 95.984 ( -1.796 15.963 -2.701) 16.290 96.169 ( -1.134 -13.898 1.609) 14.036 96.299 ( 0.070 -16.020 -1.816) 16.123 ======================= Grid point 336 (176/252) ======================= q-point: ( 0.30 0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.523 ( -3.875 8.180 0.465) 9.063 2.688 ( -7.221 -8.535 -2.915) 11.554 2.862 ( -4.940 10.437 -3.416) 12.041 3.046 ( -4.957 -8.091 -0.330) 9.495 3.271 ( 0.526 9.507 3.836) 10.266 3.404 ( -2.340 -3.331 3.315) 5.249 3.477 ( 2.730 9.596 2.166) 10.209 3.632 ( -0.402 -5.862 2.308) 6.313 4.200 ( -9.673 7.327 -0.919) 12.170 4.322 ( -8.252 -3.184 -2.886) 9.304 4.471 ( -7.788 2.480 11.115) 13.797 4.576 ( -4.281 -3.869 6.331) 8.566 4.637 ( -2.003 5.900 1.435) 6.394 4.776 ( -2.785 -8.905 5.875) 11.027 5.102 ( -2.285 0.667 4.129) 4.766 5.122 ( -2.684 -0.965 4.722) 5.516 5.337 ( 3.589 6.461 -9.553) 12.078 5.450 ( 4.804 1.357 -4.905) 6.999 5.543 ( 4.164 -1.499 -4.170) 6.080 5.653 ( -0.051 -14.698 -6.812) 16.200 8.352 ( 3.819 11.072 4.639) 12.597 8.538 ( 4.142 -7.506 3.102) 9.117 9.016 ( 7.003 6.558 -4.824) 10.738 9.141 ( 5.817 -6.311 -6.333) 10.667 28.609 ( -1.551 15.762 4.649) 16.506 28.819 ( -0.378 17.649 1.675) 17.732 28.899 ( -0.351 30.772 -3.094) 30.929 29.019 ( 2.671 31.400 -2.438) 31.608 29.059 ( -3.666 28.822 2.509) 29.163 29.348 ( -0.342 -3.867 -3.187) 5.023 30.153 ( -2.347 -61.744 -1.136) 61.799 30.215 ( -1.719 -59.282 1.378) 59.323 95.863 ( -1.816 16.075 2.054) 16.307 95.938 ( -1.434 18.085 -1.989) 18.250 96.161 ( -0.965 -14.660 1.619) 14.781 96.287 ( -0.037 -17.955 -1.672) 18.033 ======================= Grid point 337 (177/252) ======================= q-point: ( 0.40 0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.490 ( -1.586 3.915 2.575) 4.947 2.594 ( -2.033 -6.595 0.293) 6.908 2.773 ( -1.458 9.341 -3.690) 10.149 2.943 ( -4.878 -7.934 -1.521) 9.437 3.320 ( 1.881 5.998 3.074) 6.998 3.378 ( -2.739 -0.109 3.818) 4.700 3.533 ( 1.620 6.850 -0.380) 7.049 3.622 ( -2.158 -2.179 0.342) 3.086 4.079 ( -3.281 5.105 1.944) 6.372 4.177 ( -3.723 -4.825 -1.283) 6.228 4.410 ( -6.838 5.594 10.339) 13.600 4.559 ( -4.622 -6.686 5.371) 9.742 4.598 ( -3.526 7.083 5.828) 9.827 4.746 ( -5.313 -7.498 5.503) 10.711 5.091 ( -1.371 -0.291 3.947) 4.188 5.101 ( -2.227 -1.315 4.253) 4.977 5.345 ( 4.718 4.053 -10.005) 11.781 5.480 ( 3.792 -5.816 -7.599) 10.293 5.580 ( 2.782 1.511 -4.761) 5.718 5.621 ( 1.183 -6.212 -6.740) 9.242 8.457 ( 3.113 10.806 5.785) 12.646 8.633 ( 3.040 -6.666 4.299) 8.495 9.081 ( 4.124 4.720 -6.219) 8.830 9.177 ( 3.280 -5.190 -6.360) 8.840 28.612 ( -1.725 15.485 4.714) 16.278 28.829 ( 0.266 21.361 1.590) 21.422 28.876 ( 0.089 33.565 -2.393) 33.650 29.005 ( -2.062 25.078 0.917) 25.179 29.055 ( 1.121 32.576 -1.163) 32.616 29.316 ( -0.246 -7.513 -3.844) 8.442 30.120 ( -0.542 -61.871 -0.289) 61.874 30.188 ( -1.955 -59.378 0.515) 59.412 95.843 ( -1.732 16.828 1.570) 16.990 95.908 ( -0.321 18.952 -1.552) 19.019 96.158 ( -0.707 -15.492 1.745) 15.606 96.277 ( 0.232 -18.941 -1.562) 19.006 ======================= Grid point 338 (178/252) ======================= q-point: (-0.50 0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.489 ( -0.362 5.523 2.662) 6.142 2.618 ( 3.649 -7.572 1.988) 8.637 2.768 ( 3.956 5.398 -3.893) 7.742 2.867 ( -1.455 -4.588 -2.986) 5.664 3.338 ( -2.145 6.399 2.970) 7.373 3.400 ( 0.791 -0.274 5.921) 5.980 3.501 ( -4.145 3.528 -2.427) 5.960 3.557 ( -4.785 -1.725 -0.252) 5.093 4.105 ( 4.365 5.610 3.179) 7.787 4.222 ( 7.496 -5.664 1.777) 9.562 4.372 ( -5.038 6.822 9.573) 12.789 4.484 ( -2.990 0.404 -0.266) 3.028 4.598 ( -2.638 -0.149 6.087) 6.635 4.691 ( -4.744 -8.474 8.309) 12.781 5.103 ( -0.085 0.636 3.458) 3.517 5.121 ( -0.256 -1.268 6.044) 6.181 5.359 ( 3.910 3.332 -9.070) 10.424 5.494 ( 3.811 -7.591 -8.737) 12.185 5.544 ( -1.696 1.838 -7.036) 7.467 5.597 ( 0.324 -3.172 -5.797) 6.616 8.530 ( -0.159 10.535 6.660) 12.465 8.697 ( 0.187 -6.174 5.049) 7.978 9.073 ( 0.234 5.156 -7.212) 8.869 9.178 ( 1.813 -5.987 -6.733) 9.190 28.611 ( -1.984 15.451 4.626) 16.250 28.848 ( 0.250 14.315 1.969) 14.452 28.871 ( 1.111 37.894 -1.867) 37.957 28.989 ( -0.178 30.709 0.173) 30.710 29.054 ( -0.254 33.775 -0.965) 33.789 29.291 ( 0.649 -11.593 -4.169) 12.337 30.128 ( 0.991 -61.630 0.533) 61.640 30.157 ( -1.124 -59.748 -0.302) 59.759 95.825 ( -1.346 17.666 1.203) 17.758 95.907 ( 1.324 18.543 -1.225) 18.630 96.159 ( -0.538 -16.267 1.805) 16.376 96.274 ( 0.726 -18.753 -1.554) 18.831 ======================= Grid point 339 (179/252) ======================= q-point: (-0.40 0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.532 ( 3.725 11.220 2.061) 12.001 2.738 ( 7.666 -9.570 0.060) 12.261 2.847 ( 2.768 0.643 -4.650) 5.450 2.856 ( 7.562 -0.940 -3.354) 8.326 3.316 ( -3.194 9.512 5.043) 11.230 3.386 ( -5.668 2.588 -0.910) 6.297 3.441 ( -1.819 -3.987 4.654) 6.392 3.463 ( -3.707 -4.338 1.797) 5.982 4.266 ( 9.292 6.783 1.315) 11.579 4.347 ( 3.217 0.171 -2.540) 4.103 4.371 ( -0.146 7.824 7.454) 10.807 4.539 ( 6.740 -0.712 4.270) 8.011 4.604 ( 1.467 -2.397 5.184) 5.897 4.693 ( -3.184 -9.369 10.461) 14.399 5.130 ( -0.194 1.729 4.149) 4.499 5.154 ( -1.549 -1.136 6.802) 7.068 5.348 ( 1.526 3.976 -8.598) 9.595 5.452 ( -1.943 4.098 -5.575) 7.187 5.494 ( 3.297 -10.850 -11.874) 16.419 5.548 ( -0.363 -4.657 -5.486) 7.205 8.542 ( -3.781 10.220 7.095) 13.004 8.705 ( -3.223 -6.063 4.858) 8.411 9.000 ( -2.411 6.869 -6.873) 10.012 9.139 ( -0.589 -7.677 -7.872) 11.012 28.607 ( -2.007 15.672 4.578) 16.450 28.857 ( -0.908 4.942 2.489) 5.607 28.892 ( 2.401 40.325 -1.716) 40.433 28.984 ( 0.219 33.945 -3.945) 34.174 29.056 ( 0.786 38.844 2.801) 38.953 29.281 ( 1.365 -13.013 -4.225) 13.750 30.121 ( -0.924 -60.309 -0.313) 60.317 30.185 ( 3.156 -61.229 0.566) 61.313 95.814 ( -0.657 18.317 1.058) 18.360 95.938 ( 2.861 17.180 -1.035) 17.447 96.163 ( -0.491 -16.878 1.701) 16.971 96.281 ( 1.156 -17.497 -1.621) 17.610 ======================= Grid point 340 (180/252) ======================= q-point: (-0.30 0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.652 ( 7.853 13.693 0.121) 15.786 2.809 ( 2.380 -2.380 -6.872) 7.652 2.882 ( 4.573 2.838 -5.651) 7.804 3.027 ( 11.568 -9.834 0.065) 15.183 3.291 ( -2.637 9.623 4.683) 11.022 3.345 ( 0.529 4.375 3.640) 5.716 3.413 ( -0.144 -5.033 3.229) 5.982 3.495 ( 1.450 -6.868 5.887) 9.161 4.347 ( 3.316 4.162 -1.961) 5.671 4.391 ( 3.168 -0.002 -5.439) 6.295 4.460 ( -0.225 12.354 11.179) 16.663 4.628 ( 2.637 8.050 1.727) 8.645 4.701 ( -3.614 -8.541 8.561) 12.622 4.739 ( 2.355 -5.389 5.818) 8.273 5.142 ( -2.313 0.901 5.045) 5.623 5.149 ( -3.428 -0.367 5.708) 6.668 5.329 ( 3.455 3.530 -7.211) 8.740 5.404 ( 1.219 2.816 -6.028) 6.764 5.474 ( 4.349 -9.967 -10.702) 15.257 5.557 ( 6.693 -10.404 -3.666) 12.903 8.495 ( -6.518 9.713 6.417) 13.342 8.650 ( -5.842 -5.517 3.515) 8.771 8.902 ( -3.428 6.907 -5.266) 9.338 9.046 ( -3.242 -7.912 -8.454) 12.024 28.604 ( -1.904 15.745 4.713) 16.545 28.854 ( -1.176 4.225 2.317) 4.960 28.927 ( 1.959 50.276 -1.312) 50.331 28.947 ( -0.030 17.731 -4.457) 18.283 29.115 ( 2.812 45.364 3.061) 45.554 29.278 ( 1.479 -12.449 -3.951) 13.145 30.112 ( 0.242 -60.512 -0.070) 60.513 30.253 ( 3.614 -61.081 0.358) 61.189 95.816 ( 0.005 18.549 1.238) 18.590 95.992 ( 3.740 15.231 -1.238) 15.733 96.166 ( -0.424 -17.156 1.588) 17.234 96.291 ( 1.248 -15.474 -1.750) 15.623 ======================= Grid point 341 (181/252) ======================= q-point: (-0.20 0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.751 ( 2.430 5.313 -5.608) 8.098 2.794 ( 3.402 -0.087 -3.616) 4.965 2.944 ( 5.917 13.167 -2.693) 14.685 3.207 ( 7.229 -11.561 -1.824) 13.757 3.314 ( 1.686 12.704 5.196) 13.829 3.419 ( 4.115 0.898 2.319) 4.808 3.493 ( 5.542 -0.644 3.151) 6.408 3.618 ( 8.448 -10.019 5.365) 14.161 4.366 ( -4.010 6.411 -2.889) 8.095 4.405 ( 2.404 1.607 0.551) 2.944 4.485 ( -2.502 8.317 6.339) 10.753 4.603 ( -5.149 9.107 2.455) 10.745 4.668 ( -4.742 -6.310 4.480) 9.076 4.763 ( -3.272 -7.398 7.821) 11.252 5.119 ( -3.736 -0.339 3.746) 5.301 5.125 ( -3.537 -0.327 5.216) 6.310 5.340 ( 4.413 3.170 -10.725) 12.023 5.445 ( 5.751 11.604 -2.022) 13.108 5.486 ( 5.959 -10.928 -10.973) 16.593 5.754 ( 13.556 -18.350 -0.637) 22.823 8.404 ( -7.321 9.309 4.877) 12.808 8.557 ( -6.189 -5.653 2.471) 8.738 8.810 ( -3.007 5.211 -3.946) 7.195 8.917 ( -4.308 -5.625 -7.576) 10.373 28.603 ( -1.871 15.659 4.904) 16.516 28.850 ( -0.719 7.619 1.589) 7.816 28.899 ( -1.265 28.959 -2.046) 29.059 28.969 ( 2.807 32.537 -2.904) 32.786 29.184 ( 2.318 47.365 2.249) 47.475 29.282 ( 1.781 -11.357 -2.997) 11.880 30.129 ( 1.232 -60.403 0.666) 60.420 30.313 ( 2.799 -60.900 -0.365) 60.965 95.830 ( 0.357 18.252 1.665) 18.331 96.048 ( 3.412 12.874 -1.961) 13.462 96.171 ( -0.242 -16.769 1.670) 16.853 96.300 ( 1.040 -13.105 -1.873) 13.279 ======================= Grid point 342 (182/252) ======================= q-point: (-0.10 0.46 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.742 ( 2.388 7.214 -4.016) 8.595 2.867 ( 4.977 -5.550 0.321) 7.462 3.009 ( 2.062 15.700 -1.572) 15.913 3.266 ( 1.910 -9.638 -2.497) 10.138 3.398 ( 3.176 12.566 1.214) 13.018 3.479 ( 1.377 1.696 -1.315) 2.550 3.617 ( 5.080 4.618 0.182) 6.868 3.822 ( 8.197 -13.327 -0.231) 15.648 4.230 ( -6.621 10.576 3.080) 12.852 4.370 ( -5.614 -3.937 0.713) 6.894 4.487 ( -3.221 8.192 9.924) 13.265 4.588 ( 1.723 7.576 4.474) 8.965 4.648 ( -2.475 -4.513 7.067) 8.742 4.770 ( -1.434 -8.091 7.896) 11.396 5.070 ( -3.043 -0.782 1.117) 3.335 5.082 ( -4.141 -1.745 3.178) 5.503 5.351 ( 5.073 4.697 -10.651) 12.698 5.498 ( 3.747 4.202 -6.104) 8.303 5.561 ( 6.469 0.549 -5.886) 8.764 5.929 ( 5.481 -21.869 -3.832) 22.869 8.320 ( -5.217 9.158 4.771) 11.569 8.477 ( -4.405 -6.764 2.848) 8.559 8.748 ( 0.189 3.357 -4.835) 5.889 8.802 ( -2.699 -2.176 -5.903) 6.845 28.604 ( -1.914 15.516 4.995) 16.412 28.851 ( -0.839 2.597 1.986) 3.375 28.871 ( 0.113 31.891 -2.198) 31.967 28.988 ( 1.711 31.753 -3.452) 31.986 29.220 ( 0.251 44.468 1.266) 44.486 29.306 ( 2.546 -5.757 -1.493) 6.470 30.162 ( 1.411 -60.036 1.514) 60.071 30.343 ( 1.103 -60.772 -1.239) 60.795 95.850 ( 0.298 17.493 2.202) 17.634 96.079 ( 1.786 10.224 -2.865) 10.767 96.180 ( -0.195 -14.912 1.774) 15.019 96.304 ( 0.914 -11.397 -1.879) 11.587 ======================= Grid point 403 (183/252) ======================= q-point: ( 0.00 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.372 ( 20.012 0.000 23.383) 30.777 1.700 ( -1.270 0.000 23.726) 23.760 1.823 ( -16.718 0.000 -19.701) 25.838 2.186 ( 0.049 0.000 -22.724) 22.724 2.712 ( -14.344 0.000 37.847) 40.474 3.295 ( 14.833 0.000 -20.034) 24.927 3.462 ( -0.576 0.000 10.383) 10.399 3.557 ( -4.165 0.000 15.632) 16.177 3.595 ( 0.054 0.000 -6.744) 6.744 3.892 ( -1.604 0.000 -17.571) 17.644 4.198 ( 11.575 0.000 15.186) 19.094 4.481 ( -12.656 0.000 -13.399) 18.431 4.652 ( -1.645 0.000 4.099) 4.417 4.731 ( 1.453 0.000 -4.033) 4.287 4.966 ( -0.079 0.000 15.222) 15.222 5.348 ( 2.676 0.000 -22.885) 23.040 5.390 ( 1.886 0.000 2.200) 2.898 5.428 ( -1.052 0.000 -2.085) 2.335 7.318 ( 0.138 0.000 0.104) 0.173 7.328 ( 1.655 0.000 -0.842) 1.857 8.225 ( 2.541 0.000 5.467) 6.029 8.288 ( -2.660 0.000 -1.764) 3.192 8.639 ( -6.032 0.000 10.812) 12.381 8.853 ( 3.932 0.000 -10.481) 11.194 24.690 ( -0.430 0.000 0.242) 0.494 24.695 ( 0.500 0.000 -0.312) 0.589 27.435 ( -0.567 0.000 0.587) 0.816 27.449 ( 0.530 0.000 -0.778) 0.942 30.143 ( -5.693 0.000 3.775) 6.831 30.218 ( 3.823 0.000 -3.906) 5.466 34.764 ( -1.287 0.000 6.238) 6.369 34.886 ( 1.867 0.000 -6.177) 6.453 94.106 ( 0.222 0.000 0.096) 0.242 94.108 ( -0.164 0.000 -0.045) 0.170 97.235 ( -8.466 0.000 3.275) 9.077 97.301 ( 11.955 0.000 -3.471) 12.449 ======================= Grid point 404 (184/252) ======================= q-point: ( 0.10 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.432 ( -4.311 0.000 -22.393) 22.804 1.923 ( 20.905 0.000 19.593) 28.651 1.947 ( 6.123 0.000 23.849) 24.623 2.079 ( 6.119 0.000 -21.711) 22.557 2.723 ( -10.012 0.000 29.861) 31.494 3.411 ( 13.596 0.000 -23.306) 26.982 3.504 ( -1.842 0.000 -12.681) 12.814 3.509 ( -2.325 0.000 6.499) 6.903 3.603 ( -4.850 0.000 24.291) 24.771 3.766 ( -1.113 0.000 -9.772) 9.836 4.165 ( -10.105 0.000 -13.015) 16.478 4.458 ( 2.670 0.000 13.922) 14.176 4.659 ( -1.055 0.000 4.330) 4.457 4.742 ( 2.816 0.000 -3.980) 4.876 5.102 ( 2.343 0.000 15.803) 15.976 5.266 ( 6.425 0.000 -21.988) 22.907 5.415 ( 1.847 0.000 -1.321) 2.271 5.428 ( 1.111 0.000 1.092) 1.558 7.254 ( -9.704 0.000 -2.480) 10.016 7.275 ( -2.701 0.000 -0.605) 2.768 8.269 ( 3.230 0.000 -1.545) 3.580 8.299 ( 0.615 0.000 1.602) 1.717 8.615 ( -5.480 0.000 14.189) 15.211 8.846 ( 2.828 0.000 -9.553) 9.962 24.688 ( 0.005 0.000 0.215) 0.215 24.706 ( 0.911 0.000 -0.369) 0.983 27.431 ( -0.407 0.000 0.708) 0.817 27.455 ( 0.691 0.000 -0.685) 0.973 30.068 ( -5.854 0.000 6.026) 8.401 30.252 ( 2.260 0.000 -2.930) 3.701 34.776 ( -2.011 0.000 5.816) 6.154 34.865 ( 0.879 0.000 -6.783) 6.840 94.104 ( -0.142 0.000 -0.128) 0.191 94.110 ( 0.114 0.000 0.015) 0.115 97.138 ( -3.463 0.000 2.023) 4.011 97.505 ( 13.609 0.000 -7.747) 15.660 ======================= Grid point 405 (185/252) ======================= q-point: ( 0.20 0.00 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.411 ( 16.554 0.000 -14.864) 22.248 2.077 ( 11.548 0.000 -20.373) 23.418 2.243 ( 8.972 0.000 20.091) 22.003 2.345 ( 5.326 0.000 23.053) 23.660 2.807 ( 2.434 0.000 16.948) 17.122 3.348 ( -7.290 0.000 -4.613) 8.627 3.426 ( 8.496 0.000 -33.852) 34.902 3.459 ( -5.289 0.000 1.054) 5.393 3.723 ( -4.015 0.000 28.525) 28.806 3.759 ( 7.138 0.000 -6.458) 9.626 3.964 ( -3.122 0.000 -8.558) 9.110 4.437 ( -12.369 0.000 7.948) 14.703 4.673 ( -1.071 0.000 5.213) 5.322 4.763 ( 2.805 0.000 -4.786) 5.547 5.206 ( -3.150 0.000 10.551) 11.012 5.282 ( 11.351 0.000 -19.826) 22.846 5.491 ( 5.010 0.000 1.466) 5.220 5.508 ( 6.763 0.000 7.235) 9.904 6.961 ( -18.360 0.000 -4.516) 18.907 7.254 ( 0.553 0.000 0.345) 0.652 8.245 ( -6.016 0.000 0.003) 6.016 8.373 ( 8.479 0.000 -2.076) 8.730 8.645 ( -3.054 0.000 14.172) 14.497 8.817 ( 0.864 0.000 -8.494) 8.538 24.693 ( 0.364 0.000 0.260) 0.447 24.721 ( 1.061 0.000 -0.528) 1.185 27.431 ( -0.219 0.000 0.889) 0.916 27.463 ( 0.727 0.000 -0.673) 0.991 30.022 ( -4.360 0.000 7.291) 8.495 30.253 ( 0.324 0.000 -3.556) 3.571 34.773 ( -2.675 0.000 5.416) 6.041 34.827 ( 0.312 0.000 -6.711) 6.718 94.101 ( -0.053 0.000 -0.193) 0.200 94.110 ( -0.047 0.000 -0.119) 0.128 97.153 ( 2.350 0.000 4.711) 5.265 97.664 ( 10.666 0.000 -10.155) 14.727 ======================= Grid point 406 (186/252) ======================= q-point: ( 0.30 0.00 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.761 ( 27.475 0.000 -5.469) 28.014 2.195 ( 15.311 0.000 -16.277) 22.346 2.473 ( -7.193 0.000 25.274) 26.277 2.531 ( 8.025 0.000 15.846) 17.762 3.009 ( 6.623 0.000 9.397) 11.497 3.170 ( -8.728 0.000 -3.369) 9.355 3.302 ( 2.614 0.000 -27.281) 27.406 3.357 ( -4.802 0.000 -2.082) 5.234 3.755 ( -3.637 0.000 1.529) 3.946 3.894 ( 13.361 0.000 -11.558) 17.666 3.975 ( -1.595 0.000 18.038) 18.108 4.196 ( -17.277 0.000 5.372) 18.093 4.691 ( -1.710 0.000 6.622) 6.839 4.784 ( 3.561 0.000 -5.477) 6.533 5.165 ( -6.024 0.000 7.003) 9.237 5.387 ( 14.331 0.000 -18.125) 23.106 5.557 ( 0.836 0.000 1.172) 1.439 5.758 ( 10.421 0.000 14.524) 17.875 6.582 ( -17.481 0.000 -6.539) 18.664 7.262 ( -1.325 0.000 -1.070) 1.703 8.140 ( -4.952 0.000 2.999) 5.789 8.513 ( 8.501 0.000 -4.130) 9.451 8.680 ( -3.381 0.000 11.834) 12.307 8.759 ( -0.987 0.000 -7.262) 7.328 24.703 ( 0.507 0.000 0.361) 0.622 24.735 ( 0.880 0.000 -0.735) 1.147 27.435 ( -0.071 0.000 1.057) 1.059 27.471 ( 0.600 0.000 -0.758) 0.967 30.008 ( -3.165 0.000 7.696) 8.322 30.222 ( -0.149 0.000 -4.994) 4.997 34.755 ( -3.329 0.000 5.038) 6.038 34.790 ( 0.754 0.000 -6.139) 6.185 94.099 ( 0.019 0.000 -0.212) 0.213 94.107 ( -0.121 0.000 -0.212) 0.244 97.269 ( 4.245 0.000 9.062) 10.007 97.752 ( 7.458 0.000 -11.142) 13.408 ======================= Grid point 407 (187/252) ======================= q-point: ( 0.40 0.00 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( 26.654 0.000 -0.772) 26.665 2.388 ( 15.981 0.000 -11.249) 19.543 2.495 ( -8.788 0.000 24.005) 25.563 2.686 ( -3.977 0.000 9.157) 9.984 3.050 ( -0.190 0.000 1.148) 1.163 3.080 ( -6.611 0.000 6.222) 9.078 3.167 ( 2.119 0.000 -21.964) 22.066 3.293 ( -0.557 0.000 -1.385) 1.493 3.706 ( 2.218 0.000 -7.790) 8.099 3.890 ( -14.758 0.000 3.030) 15.066 4.021 ( -9.759 0.000 21.114) 23.261 4.098 ( 13.369 0.000 -11.313) 17.514 4.699 ( -2.981 0.000 7.592) 8.156 4.816 ( 4.528 0.000 -6.436) 7.869 5.140 ( -2.270 0.000 9.070) 9.350 5.465 ( 2.181 0.000 -10.825) 11.043 5.613 ( 10.768 0.000 -5.623) 12.148 5.948 ( -7.729 0.000 13.240) 15.331 6.376 ( 5.922 0.000 -3.116) 6.692 7.134 ( -10.258 0.000 -6.070) 11.919 8.147 ( 1.174 0.000 8.229) 8.313 8.572 ( 0.926 0.000 -8.904) 8.952 8.685 ( -4.222 0.000 9.532) 10.425 8.720 ( 3.248 0.000 -4.086) 5.219 24.715 ( 0.388 0.000 0.506) 0.638 24.742 ( 0.446 0.000 -0.891) 0.996 27.442 ( -0.022 0.000 1.156) 1.156 27.474 ( 0.370 0.000 -0.908) 0.980 30.011 ( -2.556 0.000 7.784) 8.193 30.186 ( 0.634 0.000 -5.936) 5.970 34.725 ( -3.628 0.000 4.620) 5.874 34.773 ( 1.994 0.000 -5.458) 5.811 94.099 ( 0.065 0.000 -0.174) 0.185 94.104 ( -0.126 0.000 -0.214) 0.248 97.406 ( 2.392 0.000 11.627) 11.871 97.782 ( 4.783 0.000 -12.004) 12.922 ======================= Grid point 408 (188/252) ======================= q-point: (-0.50 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.462 ( -13.977 0.000 5.870) 15.160 2.463 ( -11.876 0.000 20.228) 23.457 2.615 ( 13.327 0.000 -5.195) 14.304 2.726 ( 16.599 0.000 -3.081) 16.883 2.908 ( -12.763 0.000 1.704) 12.876 3.074 ( 4.640 0.000 -15.092) 15.790 3.177 ( 6.944 0.000 3.466) 7.762 3.241 ( -4.881 0.000 -2.068) 5.301 3.660 ( -12.851 0.000 6.101) 14.226 3.744 ( 2.651 0.000 0.753) 2.755 3.949 ( -8.558 0.000 13.732) 16.180 4.268 ( 14.002 0.000 -13.968) 19.777 4.692 ( -3.489 0.000 7.647) 8.405 4.856 ( 5.603 0.000 -8.670) 10.323 5.199 ( -0.011 0.000 10.990) 10.990 5.380 ( -3.017 0.000 -7.130) 7.742 5.745 ( -14.703 0.000 3.560) 15.128 5.824 ( 16.292 0.000 -6.731) 17.627 6.661 ( 17.253 0.000 7.154) 18.677 6.831 ( -16.110 0.000 -9.631) 18.769 8.262 ( 3.001 0.000 10.925) 11.330 8.457 ( -4.818 0.000 -9.275) 10.452 8.663 ( -4.664 0.000 7.326) 8.684 8.787 ( 6.202 0.000 -5.356) 8.195 24.723 ( 0.064 0.000 0.653) 0.656 24.739 ( -0.061 0.000 -0.917) 0.919 27.450 ( -0.088 0.000 1.157) 1.160 27.471 ( 0.145 0.000 -1.050) 1.060 30.023 ( -2.101 0.000 7.905) 8.180 30.163 ( 1.539 0.000 -6.333) 6.517 34.693 ( -3.231 0.000 4.408) 5.466 34.786 ( 3.364 0.000 -5.036) 6.056 94.099 ( 0.095 0.000 -0.089) 0.130 94.100 ( -0.105 0.000 -0.153) 0.186 97.507 ( -0.607 0.000 12.078) 12.094 97.757 ( 2.108 0.000 -13.332) 13.498 ======================= Grid point 409 (189/252) ======================= q-point: (-0.40 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.183 ( -20.183 0.000 9.240) 22.197 2.236 ( -24.287 0.000 4.505) 24.701 2.692 ( -9.949 0.000 18.519) 21.022 2.848 ( 7.737 0.000 -4.990) 9.207 2.885 ( 7.551 0.000 -14.425) 16.282 3.119 ( -4.111 0.000 -3.980) 5.722 3.143 ( 8.583 0.000 -3.477) 9.261 3.267 ( -1.288 0.000 1.289) 1.822 3.567 ( -0.662 0.000 6.823) 6.855 3.701 ( -14.388 0.000 21.665) 26.007 4.033 ( 12.442 0.000 -3.877) 13.032 4.386 ( 9.237 0.000 -14.284) 17.010 4.681 ( -3.366 0.000 7.083) 7.842 4.888 ( 5.405 0.000 -11.751) 12.934 5.232 ( -6.885 0.000 11.081) 13.046 5.288 ( -1.255 0.000 -6.133) 6.260 5.565 ( -5.658 0.000 2.122) 6.043 6.106 ( 18.810 0.000 -3.691) 19.169 6.450 ( -16.839 0.000 -10.974) 20.099 7.006 ( 14.025 0.000 7.145) 15.740 8.300 ( -5.098 0.000 -7.748) 9.275 8.374 ( -0.218 0.000 11.449) 11.451 8.628 ( -3.651 0.000 5.512) 6.612 8.852 ( 5.724 0.000 -7.462) 9.405 24.726 ( -0.344 0.000 0.731) 0.808 24.728 ( -0.444 0.000 -0.809) 0.923 27.455 ( -0.247 0.000 1.049) 1.078 27.465 ( 0.009 0.000 -1.130) 1.130 30.049 ( -1.196 0.000 8.148) 8.236 30.152 ( 2.127 0.000 -6.548) 6.885 34.674 ( -2.243 0.000 4.629) 5.144 34.820 ( 4.125 0.000 -5.077) 6.541 94.098 ( -0.066 0.000 -0.061) 0.089 94.101 ( 0.118 0.000 0.017) 0.119 97.552 ( -3.431 0.000 11.445) 11.948 97.666 ( -1.326 0.000 -14.876) 14.935 ======================= Grid point 410 (190/252) ======================= q-point: (-0.30 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( -30.820 0.000 -1.039) 30.837 1.893 ( -20.262 0.000 14.395) 24.855 2.672 ( -12.578 0.000 32.739) 35.072 2.813 ( -4.588 0.000 -11.804) 12.664 2.881 ( 3.837 0.000 -16.218) 16.666 3.148 ( 7.204 0.000 0.797) 7.248 3.157 ( -3.920 0.000 -6.534) 7.620 3.285 ( 4.435 0.000 4.402) 6.249 3.597 ( -12.796 0.000 20.530) 24.191 3.671 ( 5.069 0.000 4.806) 6.985 4.273 ( 15.980 0.000 -3.003) 16.260 4.387 ( 2.778 0.000 -16.867) 17.094 4.670 ( -2.949 0.000 6.222) 6.886 4.870 ( 1.781 0.000 -12.455) 12.582 5.109 ( -12.733 0.000 10.022) 16.204 5.270 ( 3.309 0.000 -3.997) 5.189 5.548 ( -0.517 0.000 2.254) 2.313 6.073 ( -11.942 0.000 -16.959) 20.742 6.474 ( 19.898 0.000 3.649) 20.230 7.233 ( 6.446 0.000 2.469) 6.903 8.199 ( -0.637 0.000 -3.405) 3.464 8.385 ( -6.511 0.000 9.024) 11.128 8.628 ( -0.942 0.000 6.250) 6.320 8.886 ( 4.579 0.000 -9.431) 10.484 24.713 ( -0.569 0.000 -0.633) 0.851 24.721 ( -0.692 0.000 0.683) 0.973 27.455 ( -0.454 0.000 0.858) 0.970 27.457 ( 0.001 0.000 -1.129) 1.129 30.098 ( 0.387 0.000 7.919) 7.929 30.148 ( 2.596 0.000 -6.622) 7.113 34.678 ( -1.156 0.000 5.230) 5.356 34.857 ( 3.855 0.000 -5.433) 6.662 94.097 ( 0.000 0.000 0.030) 0.030 94.104 ( 0.138 0.000 0.116) 0.181 97.498 ( -5.500 0.000 -14.815) 15.803 97.544 ( -5.939 0.000 10.327) 11.913 ======================= Grid point 411 (191/252) ======================= q-point: (-0.20 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.196 ( -26.351 0.000 6.630) 27.172 1.676 ( -16.574 0.000 20.582) 26.425 2.599 ( -6.500 0.000 -13.857) 15.306 2.691 ( -14.050 0.000 37.224) 39.787 2.719 ( -10.573 0.000 -16.056) 19.225 3.099 ( 6.308 0.000 -12.760) 14.234 3.290 ( 6.074 0.000 2.852) 6.711 3.418 ( 6.571 0.000 5.333) 8.463 3.533 ( -8.907 0.000 17.786) 19.891 3.786 ( 3.950 0.000 5.129) 6.474 4.259 ( -1.408 0.000 -21.241) 21.287 4.542 ( 14.320 0.000 -2.791) 14.590 4.666 ( -1.463 0.000 5.238) 5.438 4.800 ( -0.499 0.000 -8.520) 8.535 4.965 ( -10.804 0.000 11.585) 15.841 5.332 ( 5.332 0.000 -3.024) 6.130 5.509 ( -5.433 0.000 -0.051) 5.433 5.771 ( -7.403 0.000 -18.788) 20.194 6.871 ( 19.673 0.000 4.438) 20.168 7.281 ( 0.252 0.000 -2.040) 2.056 8.239 ( 4.850 0.000 0.740) 4.906 8.294 ( -8.583 0.000 6.382) 10.696 8.657 ( -1.786 0.000 7.752) 7.955 8.885 ( 3.175 0.000 -10.785) 11.242 24.700 ( -0.401 0.000 -0.466) 0.614 24.711 ( -0.855 0.000 0.530) 1.006 27.450 ( 0.118 0.000 -1.049) 1.056 27.450 ( -0.626 0.000 0.668) 0.915 30.155 ( 3.236 0.000 -6.319) 7.099 30.165 ( 1.138 0.000 5.845) 5.955 34.703 ( -0.531 0.000 5.917) 5.941 34.880 ( 2.907 0.000 -5.585) 6.296 94.098 ( 0.094 0.000 0.094) 0.133 94.107 ( 0.129 0.000 0.149) 0.197 97.288 ( -6.667 0.000 -9.863) 11.905 97.482 ( -8.194 0.000 8.700) 11.951 ======================= Grid point 412 (192/252) ======================= q-point: (-0.10 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 245 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.009 ( -1.650 0.000 20.790) 20.855 1.602 ( -8.950 0.000 25.405) 26.936 2.313 ( -19.031 0.000 -19.017) 26.904 2.378 ( -4.099 0.000 -20.162) 20.574 2.704 ( -15.338 0.000 41.357) 44.109 3.173 ( 12.304 0.000 -16.458) 20.549 3.395 ( 2.276 0.000 5.494) 5.947 3.526 ( -5.266 0.000 16.437) 17.259 3.568 ( 6.138 0.000 -0.320) 6.146 3.921 ( 6.226 0.000 11.061) 12.693 4.071 ( -1.695 0.000 -22.081) 22.146 4.638 ( -0.612 0.000 1.446) 1.570 4.714 ( 0.639 0.000 -6.691) 6.721 4.748 ( 0.092 0.000 -5.118) 5.119 4.903 ( -5.118 0.000 14.420) 15.301 5.388 ( -5.183 0.000 1.264) 5.335 5.392 ( 4.022 0.000 -5.752) 7.019 5.540 ( -3.679 0.000 -18.105) 18.475 7.200 ( 12.197 0.000 2.977) 12.556 7.283 ( 2.330 0.000 -1.310) 2.673 8.202 ( -4.959 0.000 5.782) 7.617 8.316 ( 1.823 0.000 -0.420) 1.870 8.663 ( -4.005 0.000 8.882) 9.743 8.862 ( 3.161 0.000 -10.995) 11.440 24.693 ( 0.000 0.000 -0.351) 0.351 24.699 ( -0.760 0.000 0.356) 0.839 27.443 ( -0.661 0.000 0.571) 0.874 27.447 ( 0.317 0.000 -0.916) 0.970 30.179 ( 3.911 0.000 -5.376) 6.649 30.194 ( -1.910 0.000 3.098) 3.639 34.737 ( -0.641 0.000 6.325) 6.357 34.887 ( 2.346 0.000 -5.559) 6.033 94.102 ( 0.191 0.000 0.117) 0.224 94.110 ( -0.011 0.000 0.060) 0.061 97.185 ( 1.683 0.000 -2.902) 3.355 97.371 ( -9.614 0.000 6.246) 11.465 ======================= Grid point 413 (193/252) ======================= q-point: ( 0.00 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( 13.183 2.724 21.813) 25.632 1.730 ( -0.447 3.451 15.179) 15.573 1.843 ( -9.700 2.943 -11.704) 15.483 2.216 ( -2.487 3.541 -22.042) 22.463 2.850 ( -12.317 13.174 34.210) 38.672 3.365 ( 11.128 6.085 -14.783) 19.478 3.455 ( -0.983 -0.550 9.449) 9.516 3.532 ( 1.282 -0.080 1.001) 1.629 3.672 ( -3.037 5.834 3.715) 7.554 3.914 ( 0.202 2.160 -14.463) 14.625 4.186 ( 10.582 -0.936 13.333) 17.048 4.454 ( -12.483 -2.592 -13.220) 18.367 4.766 ( -0.369 10.410 5.121) 11.607 4.844 ( -3.322 7.349 0.218) 8.068 4.988 ( 2.780 4.477 8.868) 10.315 5.328 ( 1.860 -2.134 -22.073) 22.254 5.372 ( 2.323 -1.738 1.992) 3.519 5.407 ( -0.719 -1.735 -1.581) 2.455 7.183 ( -5.594 -12.107 2.919) 13.653 7.236 ( 6.863 -9.284 -2.640) 11.843 8.171 ( 3.050 -4.350 6.401) 8.319 8.262 ( -4.841 -2.404 -3.509) 6.444 8.676 ( -9.575 2.976 10.760) 14.708 8.884 ( 9.730 2.170 -10.256) 14.303 24.853 ( 0.619 16.294 0.674) 16.319 24.874 ( -0.538 18.032 -1.650) 18.115 27.479 ( -0.590 4.492 1.010) 4.642 27.501 ( 0.556 5.256 -1.231) 5.427 30.090 ( -5.219 -5.086 4.950) 8.810 30.181 ( 3.659 -3.804 -4.359) 6.845 34.607 ( -1.148 -16.093 6.016) 17.219 34.724 ( 1.646 -16.546 -5.930) 17.653 94.224 ( 0.341 11.792 2.148) 11.991 94.286 ( -0.539 16.587 -4.587) 17.218 97.197 ( -7.875 -3.863 3.002) 9.270 97.257 ( 10.913 -4.464 -3.071) 12.184 ======================= Grid point 414 (194/252) ======================= q-point: ( 0.10 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.479 ( -3.428 5.017 -19.032) 19.978 1.807 ( 12.284 -5.311 21.588) 25.399 2.031 ( 7.657 3.258 -1.606) 8.474 2.128 ( 9.088 6.229 0.645) 11.037 2.878 ( -7.274 14.287 25.636) 30.236 3.441 ( 3.585 0.973 -6.220) 7.245 3.487 ( -1.860 -1.345 3.829) 4.465 3.537 ( 7.477 4.897 -21.766) 23.530 3.640 ( -6.074 3.587 18.010) 19.342 3.822 ( -0.910 5.061 -8.411) 9.859 4.152 ( -9.180 -0.934 -11.856) 15.024 4.435 ( 2.701 -2.438 13.500) 13.982 4.756 ( -2.560 8.160 1.961) 8.774 4.850 ( 1.389 9.513 3.505) 10.233 5.119 ( 3.151 2.489 11.307) 11.999 5.246 ( 6.043 -2.141 -20.262) 21.252 5.372 ( 0.485 -3.078 -1.530) 3.471 5.431 ( 2.286 -0.607 0.098) 2.367 7.019 ( -11.789 -16.085 1.402) 19.992 7.313 ( 1.219 -2.997 -3.784) 4.978 8.116 ( -1.487 -11.829 2.167) 12.118 8.325 ( -0.416 2.472 0.250) 2.519 8.585 ( -4.455 -2.097 11.947) 12.922 8.976 ( 7.063 8.814 -10.402) 15.355 24.855 ( -0.418 16.819 -1.152) 16.863 24.871 ( 0.767 16.727 0.788) 16.763 27.476 ( -0.463 4.636 1.078) 4.782 27.505 ( 0.779 5.129 -1.069) 5.296 30.030 ( -5.367 -3.749 6.414) 9.165 30.209 ( 2.346 -4.286 -3.636) 6.090 34.620 ( -1.920 -16.021 5.628) 17.089 34.702 ( 0.687 -16.730 -6.465) 17.949 94.233 ( -1.105 12.763 0.069) 12.811 94.251 ( -0.443 13.441 -0.340) 13.452 97.107 ( -3.207 -3.191 1.878) 4.899 97.446 ( 12.635 -5.912 -6.863) 15.547 ======================= Grid point 415 (195/252) ======================= q-point: ( 0.20 0.08 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.459 ( 14.274 5.308 -13.875) 20.601 2.060 ( 11.116 -1.326 -12.843) 17.037 2.178 ( 11.654 -3.981 13.389) 18.192 2.402 ( 3.773 5.702 22.189) 23.219 2.966 ( 1.511 13.829 14.968) 20.434 3.341 ( -7.886 -0.906 -4.386) 9.069 3.454 ( -3.293 0.120 -1.057) 3.460 3.505 ( 7.917 7.031 -29.235) 31.093 3.735 ( -3.155 1.461 26.952) 27.175 3.792 ( 4.296 2.659 -6.824) 8.491 3.977 ( -1.986 2.175 -8.891) 9.366 4.411 ( -12.319 -2.577 7.559) 14.681 4.735 ( -0.492 5.703 0.553) 5.751 4.893 ( 0.283 11.466 3.199) 11.907 5.205 ( -1.131 -0.045 5.641) 5.753 5.269 ( 8.876 -0.980 -14.411) 16.953 5.430 ( 5.469 -4.439 1.939) 7.306 5.510 ( 5.887 -1.252 4.417) 7.466 6.764 ( -16.934 -16.995 -0.665) 24.001 7.270 ( -1.290 -0.723 -2.813) 3.178 8.164 ( -7.620 -10.707 -0.286) 13.145 8.224 ( 4.660 -6.284 2.882) 8.337 8.694 ( 3.562 4.850 10.746) 12.316 8.983 ( 1.868 10.903 -10.320) 15.128 24.845 ( 0.003 15.591 -0.628) 15.603 24.889 ( 0.627 16.812 0.533) 16.833 27.477 ( -0.280 4.749 1.181) 4.901 27.513 ( 0.838 5.084 -0.969) 5.242 29.992 ( -4.149 -3.067 7.311) 8.948 30.209 ( 0.707 -4.318 -4.160) 6.037 34.616 ( -2.640 -16.047 5.207) 17.076 34.663 ( 0.171 -16.809 -6.389) 17.983 94.205 ( -0.860 10.638 -1.211) 10.741 94.246 ( -1.233 12.898 1.631) 13.059 97.121 ( 2.203 -3.276 4.362) 5.884 97.598 ( 10.081 -6.666 -9.184) 15.179 ======================= Grid point 416 (196/252) ======================= q-point: ( 0.30 0.08 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.753 ( 24.193 -0.290 -7.486) 25.326 2.223 ( 16.978 3.160 -12.889) 21.549 2.448 ( 3.218 -2.239 18.423) 18.835 2.561 ( 0.495 3.669 18.812) 19.173 3.108 ( 2.142 8.061 8.515) 11.919 3.155 ( -8.300 -0.445 -1.675) 8.479 3.365 ( 0.115 5.298 -14.800) 15.720 3.416 ( -1.498 5.996 -10.385) 12.085 3.769 ( -1.476 1.771 -1.700) 2.865 3.904 ( 6.162 -0.094 3.149) 6.920 3.973 ( 2.905 1.163 2.992) 4.330 4.172 ( -16.889 -1.880 5.054) 17.729 4.751 ( 2.001 5.212 0.014) 5.583 4.905 ( -0.873 11.059 2.010) 11.274 5.170 ( -5.537 0.569 6.075) 8.239 5.368 ( 13.257 -1.817 -15.508) 20.483 5.507 ( 0.840 -4.585 0.857) 4.739 5.723 ( 10.012 -3.829 12.830) 16.719 6.420 ( -17.996 -15.259 -3.472) 23.848 7.218 ( -3.788 -5.125 -4.210) 7.638 8.022 ( -4.757 -8.015 3.489) 9.952 8.398 ( 8.965 -7.146 1.984) 11.635 8.798 ( -0.466 8.116 8.392) 11.684 8.916 ( -0.454 11.599 -9.792) 15.186 24.846 ( 0.444 14.818 -0.172) 14.826 24.899 ( 0.241 16.436 0.020) 16.438 27.482 ( -0.147 4.812 1.310) 4.989 27.520 ( 0.728 5.109 -1.014) 5.259 29.980 ( -3.128 -2.913 7.606) 8.725 30.183 ( 0.249 -3.921 -5.296) 6.594 34.597 ( -3.288 -16.155 4.771) 17.163 34.626 ( 0.628 -16.824 -5.816) 17.812 94.188 ( -0.274 9.211 -0.771) 9.247 94.228 ( -1.550 11.590 0.883) 11.727 97.229 ( 4.041 -4.014 8.382) 10.134 97.684 ( 7.089 -6.857 -10.216) 14.200 ======================= Grid point 417 (197/252) ======================= q-point: ( 0.40 0.08 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( 23.103 -6.085 -5.128) 24.435 2.472 ( 14.111 4.928 -4.260) 15.542 2.531 ( -4.359 4.297 17.955) 18.969 2.675 ( -3.037 -0.848 7.425) 8.067 3.026 ( 0.175 -1.459 1.515) 2.110 3.162 ( -5.796 7.525 8.445) 12.710 3.265 ( 2.234 9.683 -18.515) 21.013 3.332 ( -3.787 2.965 -0.388) 4.825 3.734 ( 2.436 2.716 -6.848) 7.759 3.907 ( -14.570 0.379 5.054) 15.427 4.000 ( -7.210 -1.564 15.620) 17.275 4.054 ( 11.129 -2.118 -11.404) 16.075 4.802 ( 2.735 7.802 0.940) 8.320 4.890 ( -1.062 8.095 -0.367) 8.173 5.145 ( -2.084 0.517 8.471) 8.739 5.447 ( 0.801 -2.036 -9.101) 9.360 5.555 ( 10.804 -5.508 -5.477) 13.306 5.921 ( -8.156 -2.848 12.103) 14.870 6.196 ( 5.131 -17.069 -0.575) 17.832 7.031 ( -11.158 -10.110 -9.249) 17.671 8.066 ( 3.421 -5.097 9.538) 11.343 8.528 ( 4.125 -2.393 -3.654) 6.008 8.764 ( -5.704 5.644 4.681) 9.289 8.891 ( 2.593 13.455 -4.729) 14.496 24.857 ( 0.717 14.695 0.214) 14.714 24.897 ( -0.255 15.749 -0.465) 15.758 27.490 ( -0.137 4.817 1.408) 5.021 27.524 ( 0.522 5.179 -1.166) 5.334 29.982 ( -2.593 -2.995 7.676) 8.638 30.152 ( 0.869 -3.509 -6.037) 7.037 34.566 ( -3.561 -16.242 4.359) 17.189 34.609 ( 1.879 -16.830 -5.165) 17.705 94.184 ( 0.286 8.772 -0.468) 8.789 94.206 ( -1.267 10.011 0.284) 10.095 97.360 ( 2.398 -4.748 10.814) 12.051 97.714 ( 4.443 -6.860 -11.105) 13.788 ======================= Grid point 418 (198/252) ======================= q-point: (-0.50 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.376 ( -13.801 -5.015 8.519) 16.976 2.493 ( 0.909 -2.832 -0.852) 3.094 2.555 ( 0.965 0.843 10.249) 10.329 2.786 ( 14.182 4.143 -7.208) 16.439 3.035 ( -10.013 11.284 5.729) 16.137 3.178 ( 5.934 0.064 2.825) 6.572 3.196 ( 1.723 8.575 -8.365) 12.102 3.243 ( -1.979 2.806 -3.983) 5.259 3.697 ( -10.676 3.418 6.409) 12.913 3.790 ( 1.900 4.533 0.759) 4.973 3.921 ( -7.638 -2.504 9.901) 12.752 4.189 ( 11.806 -6.067 -11.665) 17.671 4.805 ( -4.542 9.407 4.619) 11.421 4.915 ( 6.143 5.468 -6.005) 10.182 5.202 ( 0.132 0.247 9.840) 9.844 5.364 ( -2.529 -1.790 -6.185) 6.917 5.691 ( -11.437 -5.587 2.752) 13.023 5.768 ( 12.753 -5.324 -6.892) 15.443 6.482 ( 13.967 -16.259 10.927) 24.060 6.720 ( -12.938 -10.538 -12.757) 21.004 8.226 ( 4.566 -2.599 12.155) 13.242 8.448 ( -5.443 -0.679 -10.757) 12.075 8.738 ( -4.693 6.905 10.439) 13.367 8.921 ( 5.956 11.091 -8.146) 14.995 24.873 ( 0.579 15.260 0.490) 15.279 24.885 ( -0.496 14.972 -0.747) 14.998 27.496 ( -0.271 4.747 1.418) 4.962 27.523 ( 0.339 5.284 -1.325) 5.459 29.992 ( -2.199 -3.178 7.800) 8.705 30.131 ( 1.642 -3.268 -6.343) 7.322 34.534 ( -3.145 -16.284 4.154) 17.097 34.622 ( 3.256 -16.825 -4.746) 17.782 94.187 ( -0.691 8.827 0.179) 8.856 94.193 ( 0.780 9.302 -0.419) 9.344 97.456 ( -0.449 -5.145 11.294) 12.419 97.689 ( 1.792 -6.826 -12.380) 14.251 ======================= Grid point 419 (199/252) ======================= q-point: (-0.40 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.049 ( -23.672 -8.129 5.590) 25.645 2.322 ( -19.650 6.223 10.901) 23.317 2.768 ( 11.296 -2.353 -2.743) 11.860 2.886 ( 3.748 1.266 -11.727) 12.377 2.904 ( -9.041 13.027 10.524) 19.032 3.063 ( -5.220 -2.202 -1.035) 5.759 3.271 ( 5.745 9.903 -4.594) 12.336 3.345 ( 4.656 5.477 -0.576) 7.212 3.604 ( -2.845 4.201 6.621) 8.342 3.725 ( -13.471 2.301 19.899) 24.140 4.012 ( 12.477 -1.515 -5.061) 13.549 4.297 ( 8.200 -7.883 -11.109) 15.900 4.750 ( -4.118 6.506 3.501) 8.458 4.974 ( 4.182 6.486 -6.055) 9.809 5.226 ( -3.924 -0.320 4.791) 6.201 5.303 ( -1.462 1.592 -2.182) 3.071 5.521 ( -5.149 -4.351 1.268) 6.859 6.030 ( 17.582 -8.056 -2.039) 19.447 6.345 ( -14.447 -9.331 -13.164) 21.657 6.845 ( 14.132 -15.022 9.298) 22.623 8.250 ( -7.357 -2.869 -9.307) 12.206 8.363 ( 0.149 -1.260 11.191) 11.263 8.711 ( -4.402 7.200 7.961) 11.601 8.978 ( 6.376 10.341 -9.422) 15.374 24.864 ( -0.852 14.638 -0.478) 14.671 24.890 ( 0.652 16.093 0.220) 16.108 27.499 ( -0.495 4.599 1.215) 4.782 27.519 ( 0.239 5.413 -1.320) 5.576 30.014 ( -1.464 -3.529 8.056) 8.916 30.121 ( 2.167 -3.141 -6.507) 7.544 34.515 ( -2.142 -16.293 4.372) 17.005 34.656 ( 4.024 -16.798 -4.761) 17.917 94.178 ( -0.360 8.278 0.165) 8.287 94.214 ( 1.714 10.902 -0.453) 11.045 97.499 ( -3.285 -5.438 10.397) 12.185 97.602 ( -1.442 -6.453 -13.429) 14.969 ======================= Grid point 420 (200/252) ======================= q-point: (-0.30 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( -26.112 -5.776 5.800) 27.365 1.993 ( -22.543 8.421 9.997) 26.058 2.750 ( -5.884 -4.180 -12.891) 14.774 2.834 ( -11.200 13.929 25.817) 31.400 2.898 ( 4.208 1.915 -12.528) 13.354 3.080 ( 5.425 -3.361 3.698) 7.375 3.284 ( -1.205 10.529 -6.187) 12.272 3.383 ( 2.907 6.466 0.741) 7.128 3.599 ( -8.979 1.666 15.978) 18.404 3.725 ( 2.814 4.667 7.798) 9.514 4.232 ( 13.741 -3.462 -4.038) 14.734 4.315 ( 4.025 -7.336 -12.698) 15.207 4.714 ( -2.091 5.849 2.638) 6.748 4.964 ( -2.096 4.948 -1.962) 5.721 5.155 ( -6.249 5.931 1.899) 8.822 5.273 ( 2.068 0.511 -3.029) 3.703 5.508 ( -0.070 -3.972 1.472) 4.237 6.004 ( -11.576 -7.177 -14.690) 20.032 6.372 ( 20.128 -9.403 0.247) 22.218 7.120 ( 9.045 -11.420 6.255) 15.854 8.094 ( -3.103 -6.252 -4.112) 8.101 8.356 ( -6.987 -2.182 5.665) 9.256 8.725 ( -1.169 7.241 9.703) 12.163 8.997 ( 3.204 8.606 -11.219) 14.498 24.848 ( -0.632 14.538 -0.305) 14.554 24.901 ( 0.441 17.344 -0.159) 17.351 27.495 ( -0.615 4.484 0.798) 4.596 27.514 ( 0.127 5.462 -1.100) 5.573 30.055 ( -0.287 -4.292 7.984) 9.069 30.118 ( 2.594 -3.069 -6.557) 7.690 34.519 ( -1.042 -16.280 4.967) 17.053 34.694 ( 3.796 -16.708 -5.083) 17.872 94.177 ( 0.088 8.369 0.346) 8.376 94.249 ( 2.761 13.688 -1.157) 14.011 97.436 ( -5.404 -6.122 -11.574) 14.164 97.496 ( -5.595 -4.997 7.683) 10.738 ======================= Grid point 421 (201/252) ======================= q-point: (-0.20 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.237 ( -20.571 4.666 9.078) 22.964 1.710 ( -18.052 4.602 17.524) 25.576 2.518 ( -7.943 -5.882 -16.731) 19.432 2.772 ( -6.788 4.370 -14.188) 16.324 2.831 ( -13.483 13.464 33.709) 38.721 3.216 ( 6.339 8.197 -7.942) 13.056 3.258 ( 5.256 -0.090 2.070) 5.649 3.443 ( 0.949 1.121 4.721) 4.944 3.577 ( -4.273 4.693 14.433) 15.767 3.826 ( 2.670 3.811 5.571) 7.258 4.201 ( -0.105 -5.037 -18.620) 19.289 4.511 ( 15.004 -3.350 -2.783) 15.623 4.712 ( -0.043 6.919 2.172) 7.252 4.904 ( -4.960 2.742 6.152) 8.365 5.047 ( -5.395 11.606 -1.959) 12.948 5.325 ( 4.502 -0.788 -2.287) 5.111 5.474 ( -4.463 -3.376 -0.859) 5.661 5.722 ( -7.260 -4.956 -17.253) 19.363 6.739 ( 18.556 -12.262 1.649) 22.303 7.238 ( 1.921 -5.377 0.999) 5.797 8.109 ( 1.639 -9.969 5.065) 11.301 8.253 ( -2.860 -1.849 -0.131) 3.409 8.764 ( -3.213 8.450 9.797) 13.331 8.934 ( -0.825 2.867 -11.372) 11.757 24.839 ( -0.181 14.930 -0.014) 14.931 24.903 ( 0.193 18.391 -0.950) 18.417 27.489 ( -0.608 4.428 0.651) 4.517 27.508 ( 0.068 5.434 -1.069) 5.539 30.108 ( 0.083 -5.489 6.488) 8.499 30.125 ( 3.153 -3.115 -6.185) 7.609 34.544 ( -0.403 -16.246 5.651) 17.205 34.719 ( 2.912 -16.517 -5.277) 17.582 94.186 ( 0.435 9.053 0.714) 9.091 94.292 ( 3.378 17.046 -3.093) 17.651 97.244 ( -6.124 -4.372 -8.864) 11.627 97.431 ( -7.818 -5.127 7.960) 12.279 ======================= Grid point 422 (202/252) ======================= q-point: (-0.10 0.08 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( -1.109 11.079 17.314) 20.585 1.615 ( -8.257 2.229 24.304) 25.765 2.217 ( -11.598 -5.689 -20.198) 23.976 2.478 ( -9.992 6.916 -18.722) 22.320 2.837 ( -14.095 12.831 38.025) 42.534 3.271 ( 9.976 9.203 -14.324) 19.733 3.392 ( 3.295 -0.279 5.353) 6.292 3.486 ( -0.426 -1.865 8.013) 8.239 3.644 ( 1.517 5.251 7.797) 9.522 3.918 ( 3.217 -0.579 7.750) 8.411 4.070 ( 1.260 1.052 -17.957) 18.032 4.661 ( 2.525 -2.683 -9.386) 10.083 4.735 ( 0.359 8.245 2.731) 8.693 4.896 ( -4.185 -0.502 13.925) 14.549 4.941 ( -2.264 14.888 -5.846) 16.154 5.347 ( -2.116 -3.120 0.383) 3.790 5.400 ( 1.628 -0.162 -4.685) 4.963 5.500 ( -3.845 -3.868 -16.702) 17.570 7.031 ( 12.566 -13.560 0.423) 18.491 7.258 ( -0.508 -5.093 1.506) 5.335 8.093 ( -2.202 -9.324 4.723) 10.681 8.335 ( 4.257 2.696 -0.745) 5.094 8.727 ( -4.799 4.691 4.786) 8.243 8.855 ( -0.405 -1.133 -5.396) 5.528 24.841 ( 0.272 15.597 0.329) 15.603 24.894 ( -0.212 18.717 -1.651) 18.791 27.483 ( -0.608 4.406 0.836) 4.525 27.502 ( 0.243 5.383 -1.220) 5.525 30.130 ( -2.266 -6.058 4.540) 7.902 30.147 ( 3.649 -3.365 -5.377) 7.318 34.579 ( -0.499 -16.184 6.069) 17.291 34.728 ( 2.259 -16.396 -5.365) 17.399 94.202 ( 0.603 10.271 1.349) 10.377 94.313 ( 1.755 18.570 -5.152) 19.351 97.151 ( 1.568 -3.470 -2.740) 4.692 97.325 ( -9.040 -4.683 5.739) 11.687 ======================= Grid point 423 (203/252) ======================= q-point: ( 0.00 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.509 ( 0.862 9.827 16.543) 19.261 1.823 ( -1.746 6.212 -9.430) 11.427 1.988 ( 6.594 12.443 10.571) 17.608 2.338 ( -7.693 9.144 -19.023) 22.465 3.169 ( -8.724 18.531 26.655) 33.616 3.428 ( 1.038 -0.194 1.795) 2.082 3.452 ( -2.106 0.260 6.592) 6.925 3.637 ( 10.580 10.931 -13.804) 20.542 3.799 ( -3.101 6.727 5.657) 9.321 3.957 ( 4.005 1.565 -5.059) 6.640 4.183 ( 5.717 1.355 5.525) 8.066 4.389 ( -10.836 -3.741 -11.997) 16.593 4.882 ( -5.067 -1.092 12.453) 13.488 4.976 ( 2.452 9.064 4.434) 10.384 5.159 ( 1.318 7.892 -4.370) 9.117 5.264 ( 0.156 -4.105 -14.461) 15.033 5.337 ( 1.742 -1.265 2.026) 2.956 5.387 ( 0.807 0.383 -4.861) 4.942 6.922 ( -8.560 -13.152 4.668) 16.372 7.009 ( 9.062 -13.164 -4.241) 16.534 8.085 ( 3.766 -4.074 7.386) 9.238 8.214 ( -7.518 -2.209 -6.195) 9.989 8.725 ( -14.130 1.667 9.512) 17.115 8.906 ( 17.174 -0.171 -8.868) 19.329 25.305 ( 0.711 29.896 1.899) 29.965 25.358 ( -0.616 31.112 -3.731) 31.341 27.609 ( -0.846 8.834 1.906) 9.077 27.649 ( 0.818 9.913 -2.186) 10.184 29.962 ( -4.300 -7.773 6.652) 11.097 30.077 ( 3.321 -6.759 -5.176) 9.138 34.148 ( -0.781 -30.935 5.416) 31.415 34.254 ( 1.117 -31.689 -5.309) 32.150 94.526 ( 0.702 18.284 5.418) 19.083 94.671 ( -1.206 21.352 -10.094) 23.649 97.089 ( -6.413 -7.201 2.368) 9.929 97.135 ( 8.495 -7.954 -2.261) 11.855 ======================= Grid point 424 (204/252) ======================= q-point: ( 0.10 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.623 ( 0.831 9.240 -2.517) 9.613 1.792 ( 7.159 5.440 8.617) 12.454 2.106 ( 2.039 5.625 -16.421) 17.477 2.315 ( 9.755 12.391 14.552) 21.458 3.207 ( -4.465 17.861 18.141) 25.847 3.439 ( -1.121 -0.062 1.934) 2.236 3.460 ( -2.565 -0.926 2.949) 4.016 3.695 ( 2.582 7.610 -5.905) 9.972 3.726 ( 0.138 6.851 -8.440) 10.872 3.937 ( -1.056 6.448 -4.959) 8.203 4.153 ( -5.392 1.682 -7.824) 9.650 4.368 ( 2.161 -4.282 12.064) 12.982 4.861 ( -4.496 1.325 7.583) 8.915 5.053 ( 0.654 9.837 9.537) 13.717 5.176 ( 2.003 -2.591 -12.299) 12.727 5.220 ( 6.605 3.671 -2.760) 8.045 5.322 ( -0.779 -0.991 -3.641) 3.853 5.409 ( 2.260 -1.285 -0.841) 2.733 6.695 ( -16.066 -16.178 3.264) 23.033 7.170 ( 7.509 -10.878 -4.685) 14.024 7.922 ( -8.280 -6.794 3.454) 11.254 8.387 ( 3.564 3.275 1.139) 4.973 8.530 ( -5.162 -3.198 9.586) 11.347 9.100 ( 11.323 3.357 -11.776) 16.678 25.315 ( -1.063 30.041 -1.766) 30.112 25.335 ( 0.429 30.488 1.171) 30.514 27.608 ( -0.677 8.912 1.981) 9.154 27.651 ( 1.064 9.860 -2.003) 10.118 29.929 ( -4.416 -6.551 6.994) 10.552 30.095 ( 2.473 -7.262 -4.929) 9.119 34.163 ( -1.673 -30.824 5.105) 31.289 34.227 ( 0.177 -31.981 -5.676) 32.482 94.554 ( -2.336 19.174 1.370) 19.365 94.581 ( -1.702 19.351 -1.701) 19.500 97.016 ( -2.585 -6.188 1.542) 6.881 97.288 ( 10.232 -10.141 -4.953) 15.234 ======================= Grid point 425 (205/252) ======================= q-point: ( 0.20 0.15 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( 8.065 12.585 -11.572) 18.904 2.046 ( 10.232 0.388 10.454) 14.633 2.164 ( 14.193 3.267 -7.480) 16.373 2.557 ( 2.633 10.011 19.046) 21.678 3.261 ( -1.616 13.925 12.619) 18.862 3.314 ( -8.751 -0.899 -6.356) 10.853 3.446 ( -1.583 -0.466 2.877) 3.316 3.689 ( 5.812 10.277 -23.585) 26.376 3.745 ( 2.277 0.962 11.440) 11.704 3.887 ( -1.849 7.119 -1.343) 7.476 4.062 ( -0.217 6.080 -6.400) 8.831 4.345 ( -10.993 -3.974 6.840) 13.544 4.843 ( -1.792 3.982 3.788) 5.780 5.106 ( -0.737 7.577 4.721) 8.958 5.185 ( 5.120 -1.733 -5.109) 7.438 5.287 ( -0.297 2.646 0.414) 2.695 5.347 ( 6.757 -2.620 -2.789) 7.765 5.459 ( 3.856 -3.765 2.162) 5.807 6.398 ( -18.935 -19.234 3.285) 27.190 7.182 ( -1.074 -8.847 -6.769) 11.192 7.910 ( -0.650 -9.647 6.081) 11.422 8.244 ( -5.244 4.451 1.672) 7.078 8.744 ( 9.228 -0.022 8.924) 12.837 9.153 ( 4.770 5.953 -13.046) 15.112 25.284 ( -0.773 29.207 -1.483) 29.255 25.350 ( -0.081 30.249 1.617) 30.293 27.612 ( -0.501 9.012 2.022) 9.250 27.658 ( 1.171 9.842 -1.829) 10.079 29.905 ( -3.722 -5.890 7.264) 10.065 30.094 ( 1.411 -7.326 -5.298) 9.150 34.159 ( -2.521 -30.872 4.583) 31.312 34.185 ( -0.240 -32.145 -5.493) 32.612 94.484 ( -2.245 17.241 -3.387) 17.714 94.566 ( -3.353 19.015 4.759) 19.886 97.027 ( 1.806 -6.344 3.520) 7.476 97.418 ( 8.522 -11.509 -6.926) 15.907 ======================= Grid point 426 (206/252) ======================= q-point: ( 0.30 0.15 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.782 ( 17.118 4.009 -10.846) 20.658 2.328 ( 17.399 7.324 -1.048) 18.907 2.416 ( 10.765 -0.010 8.475) 13.701 2.671 ( -3.559 7.386 16.202) 18.158 3.111 ( -8.146 -2.017 -4.675) 9.607 3.320 ( -2.145 10.363 12.658) 16.499 3.423 ( -3.258 1.200 2.367) 4.202 3.609 ( 1.851 12.401 -17.731) 21.716 3.833 ( 1.117 3.912 -7.178) 8.250 3.880 ( -0.647 -0.411 10.929) 10.956 4.019 ( -1.019 1.537 -4.780) 5.124 4.167 ( -8.036 2.856 0.420) 8.539 4.861 ( 2.171 5.319 1.211) 5.871 5.116 ( -0.175 8.038 0.819) 8.081 5.187 ( -3.243 0.968 1.101) 3.559 5.331 ( 5.243 -2.133 -0.874) 5.728 5.410 ( 2.360 -3.802 -5.017) 6.722 5.599 ( 7.244 -8.851 9.086) 14.607 6.079 ( -17.909 -17.589 3.197) 25.305 7.043 ( -7.913 -13.005 -10.328) 18.396 7.912 ( -1.104 -2.382 7.213) 7.676 8.335 ( 9.410 0.779 3.656) 10.125 8.891 ( 0.326 1.881 5.452) 5.777 9.129 ( 3.005 8.691 -10.374) 13.863 25.269 ( 0.038 28.458 -0.605) 28.465 25.352 ( -0.731 29.773 0.809) 29.793 27.618 ( -0.405 9.075 2.088) 9.321 27.667 ( 1.100 9.876 -1.814) 10.101 29.895 ( -3.060 -5.777 7.356) 9.841 30.076 ( 1.021 -6.953 -5.910) 9.182 34.137 ( -2.937 -31.136 3.448) 31.464 34.148 ( 0.037 -32.102 -4.325) 32.392 94.436 ( -0.918 15.778 -1.998) 15.930 94.523 ( -4.091 17.868 2.866) 18.553 97.116 ( 3.463 -7.531 6.726) 10.674 97.498 ( 6.068 -12.044 -7.966) 15.663 ======================= Grid point 427 (207/252) ======================= q-point: ( 0.40 0.15 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.072 ( 21.069 -1.774 -8.007) 22.608 2.557 ( -3.849 3.952 4.565) 7.160 2.622 ( 2.710 2.556 11.953) 12.520 2.698 ( 8.471 5.772 -1.449) 10.353 3.016 ( 1.153 0.584 2.340) 2.674 3.339 ( -7.376 7.652 9.113) 14.000 3.351 ( -5.566 1.896 5.776) 8.242 3.523 ( 0.880 14.560 -12.542) 19.237 3.794 ( -1.547 1.424 -1.198) 2.420 3.863 ( -2.288 -1.660 0.084) 2.828 3.980 ( -4.836 -0.161 5.503) 7.328 4.102 ( 3.010 6.031 -9.996) 12.056 4.938 ( 5.995 6.274 -1.221) 8.763 5.086 ( -4.532 9.310 0.402) 10.362 5.157 ( -1.566 0.942 6.535) 6.786 5.359 ( -2.824 -8.085 -2.582) 8.945 5.446 ( 8.963 -4.415 -6.141) 11.727 5.801 ( -7.556 -16.839 -1.071) 18.488 5.846 ( 4.034 -8.404 15.973) 18.494 6.773 ( -11.313 -15.820 -14.204) 24.084 8.015 ( 4.429 0.176 11.256) 12.097 8.504 ( 6.021 -0.079 -3.516) 6.973 8.865 ( -4.312 4.498 6.111) 8.727 9.128 ( 2.878 9.651 -7.422) 12.511 25.276 ( 0.925 28.209 0.042) 28.224 25.336 ( -1.227 29.107 -0.040) 29.133 27.625 ( -0.456 9.080 2.159) 9.344 27.672 ( 0.919 9.941 -1.947) 10.172 29.895 ( -2.679 -5.924 7.402) 9.852 30.054 ( 1.347 -6.539 -6.273) 9.161 34.104 ( -3.361 -31.171 3.623) 31.560 34.131 ( 1.540 -32.227 -4.319) 32.552 94.422 ( 0.552 15.245 -1.168) 15.299 94.468 ( -3.320 16.363 1.299) 16.747 97.227 ( 2.317 -8.775 8.794) 12.638 97.526 ( 3.574 -12.181 -8.876) 15.489 ======================= Grid point 428 (208/252) ======================= q-point: (-0.50 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.303 ( -16.702 -2.047 4.566) 17.436 2.411 ( 15.424 -3.200 -6.805) 17.160 2.652 ( -8.650 7.042 14.462) 18.264 2.876 ( 10.249 5.060 -7.982) 13.941 3.170 ( 2.878 -0.780 1.705) 3.435 3.188 ( -1.213 -0.558 -0.160) 1.345 3.306 ( -8.408 12.310 12.822) 19.663 3.493 ( 4.249 15.990 -8.450) 18.577 3.755 ( -4.761 1.220 6.841) 8.423 3.874 ( -2.746 -1.442 -1.534) 3.460 3.901 ( -0.576 6.195 4.166) 7.487 4.104 ( 5.110 -1.284 -10.841) 12.053 4.979 ( -7.930 6.600 3.838) 11.008 5.039 ( 4.974 6.869 -1.677) 8.645 5.200 ( 0.743 -0.994 4.951) 5.104 5.300 ( 0.604 -5.022 -4.383) 6.693 5.546 ( -3.621 -7.915 2.878) 9.167 5.649 ( 5.063 -5.998 -7.824) 11.083 6.132 ( 9.682 -17.877 17.046) 26.532 6.468 ( -9.105 -14.598 -16.852) 24.084 8.192 ( 4.608 -0.465 13.408) 14.185 8.443 ( -4.806 0.487 -12.291) 13.206 8.881 ( -3.951 6.814 13.590) 15.707 9.127 ( 5.239 8.859 -11.440) 15.388 25.301 ( 1.557 28.508 0.318) 28.552 25.310 ( -1.330 28.551 -0.546) 28.587 27.631 ( -0.655 9.037 2.156) 9.314 27.673 ( 0.741 10.007 -2.101) 10.252 29.901 ( -2.405 -6.170 7.547) 10.041 30.038 ( 1.862 -6.284 -6.385) 9.150 34.071 ( -2.919 -31.249 3.455) 31.574 34.143 ( 2.984 -32.202 -3.943) 32.580 94.425 ( -1.991 15.190 0.710) 15.336 94.441 ( 2.225 15.700 -0.935) 15.884 97.312 ( -0.098 -9.513 9.309) 13.310 97.502 ( 1.083 -12.084 -10.010) 15.729 ======================= Grid point 429 (209/252) ======================= q-point: (-0.40 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( -23.350 -2.434 5.341) 24.076 2.479 ( -14.858 9.748 9.865) 20.325 2.709 ( 13.291 -2.174 -2.842) 13.764 2.883 ( -3.226 -0.521 -11.132) 11.602 3.055 ( -1.629 1.092 -0.904) 2.159 3.238 ( -8.338 17.530 12.155) 22.904 3.371 ( 8.158 0.901 -1.442) 8.333 3.546 ( 4.711 14.567 -3.489) 15.703 3.727 ( -1.674 7.005 3.743) 8.117 3.769 ( -8.730 2.200 11.921) 14.939 4.010 ( 8.668 2.257 -2.098) 9.199 4.127 ( 4.499 -8.821 -8.558) 13.088 4.874 ( -6.718 4.251 5.565) 9.704 5.071 ( -0.909 3.503 1.000) 3.755 5.230 ( 1.695 0.405 -2.713) 3.225 5.339 ( 4.299 -0.483 -1.152) 4.476 5.425 ( -5.543 -2.788 -0.172) 6.207 5.811 ( 11.056 -12.875 -2.884) 17.214 6.151 ( -6.548 -10.055 -12.728) 17.492 6.500 ( 13.283 -19.052 11.403) 25.873 8.234 ( -7.752 1.368 -10.963) 13.496 8.335 ( 0.056 -1.184 11.594) 11.654 8.858 ( -6.105 6.969 9.151) 13.022 9.161 ( 5.789 7.302 -10.897) 14.338 25.282 ( -1.081 28.157 -0.556) 28.183 25.336 ( 1.972 29.408 0.003) 29.474 27.631 ( -0.900 8.977 1.984) 9.237 27.670 ( 0.605 10.038 -2.134) 10.280 29.915 ( -1.978 -6.567 7.832) 10.410 30.031 ( 2.257 -6.135 -6.416) 9.160 34.051 ( -1.869 -31.285 3.659) 31.553 34.179 ( 3.798 -32.102 -3.920) 32.562 94.404 ( -0.804 14.611 0.678) 14.649 94.494 ( 4.452 17.212 -1.295) 17.826 97.347 ( -2.912 -9.993 7.693) 12.943 97.427 ( -1.514 -11.312 -9.844) 15.072 ======================= Grid point 430 (210/252) ======================= q-point: (-0.30 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.585 ( -19.780 2.126 9.012) 21.840 2.204 ( -20.642 13.245 7.264) 25.579 2.679 ( -7.565 -2.589 -13.177) 15.414 2.909 ( 9.745 0.130 -6.762) 11.862 3.050 ( 1.372 0.514 0.597) 1.581 3.182 ( -9.498 19.069 18.466) 28.192 3.445 ( 0.706 1.491 1.803) 2.444 3.541 ( -1.057 14.362 -5.413) 15.384 3.704 ( -4.906 8.237 7.275) 12.035 3.820 ( 3.731 4.289 8.937) 10.592 4.126 ( 3.957 -8.144 -9.772) 13.322 4.192 ( 11.548 -2.876 -1.167) 11.957 4.821 ( -3.638 2.861 6.484) 7.966 5.033 ( -3.972 4.342 0.695) 5.925 5.240 ( 2.408 -0.193 -1.629) 2.914 5.352 ( -0.933 7.347 -2.887) 7.949 5.408 ( 1.742 -5.423 -0.612) 5.729 5.803 ( -6.533 -12.592 -10.705) 17.772 6.166 ( 15.864 -10.801 -6.424) 20.239 6.826 ( 12.223 -17.565 11.761) 24.419 8.044 ( -5.172 1.235 -6.655) 8.519 8.330 ( -6.231 -0.330 4.381) 7.624 8.846 ( -2.350 4.780 10.278) 11.576 9.138 ( -0.576 5.021 -11.341) 12.416 25.266 ( -0.408 28.239 -0.202) 28.243 25.369 ( 1.992 30.399 -0.979) 30.479 27.626 ( -1.043 8.927 1.735) 9.153 27.665 ( 0.483 10.021 -2.092) 10.248 29.940 ( -1.443 -7.306 8.006) 10.935 30.030 ( 2.588 -6.031 -6.385) 9.156 34.056 ( -0.726 -31.271 4.238) 31.565 34.220 ( 3.676 -31.905 -4.210) 32.390 94.406 ( 0.275 14.751 1.152) 14.798 94.583 ( 6.822 19.435 -3.105) 20.831 97.275 ( -4.837 -10.195 -7.950) 13.804 97.352 ( -4.771 -9.605 5.278) 11.953 ======================= Grid point 431 (211/252) ======================= q-point: (-0.20 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.400 ( -7.941 12.595 12.152) 19.219 1.883 ( -19.463 13.281 9.439) 25.383 2.426 ( -8.570 -3.108 -16.988) 19.279 2.880 ( -3.698 6.737 -13.812) 15.806 3.153 ( -10.466 17.659 25.764) 32.942 3.183 ( 7.581 -2.651 7.605) 11.061 3.452 ( -1.394 0.258 3.550) 3.823 3.491 ( 1.831 15.299 -7.919) 17.324 3.678 ( -3.488 4.161 8.361) 9.969 3.918 ( 0.298 5.465 6.393) 8.415 4.122 ( 5.015 -1.912 -12.573) 13.671 4.431 ( 14.295 -4.583 -1.991) 15.143 4.830 ( -1.142 2.002 7.845) 8.176 4.958 ( -4.277 5.659 1.557) 7.262 5.287 ( 1.578 3.474 -2.162) 4.386 5.302 ( -1.761 4.520 -2.490) 5.452 5.398 ( -1.170 -3.776 -2.397) 4.623 5.594 ( -5.852 -7.675 -13.967) 16.978 6.457 ( 18.055 -15.538 -2.772) 23.982 7.054 ( 4.693 -13.031 6.670) 15.373 7.965 ( -2.558 -3.277 -0.157) 4.160 8.273 ( 2.863 3.382 -0.759) 4.496 8.880 ( -3.387 1.210 9.960) 10.590 8.973 ( -8.601 2.539 -9.850) 13.321 25.265 ( 0.300 28.680 0.401) 28.685 25.390 ( 1.546 31.152 -2.486) 31.289 27.619 ( -1.053 8.875 1.648) 9.088 27.658 ( 0.441 9.990 -2.134) 10.225 29.970 ( -1.524 -8.306 7.601) 11.361 30.036 ( 3.008 -6.026 -6.186) 9.145 34.082 ( -0.046 -31.206 4.922) 31.592 34.249 ( 2.889 -31.625 -4.525) 32.078 94.429 ( 1.073 15.550 2.116) 15.730 94.684 ( 7.545 21.472 -7.070) 23.832 97.124 ( -4.792 -7.848 -6.676) 11.363 97.290 ( -6.773 -9.315 6.189) 13.074 ======================= Grid point 432 (212/252) ======================= q-point: (-0.10 0.15 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.430 ( -0.460 20.819 10.071) 23.132 1.724 ( -5.957 9.377 19.376) 22.335 2.140 ( -8.102 -1.561 -19.641) 21.303 2.638 ( -10.175 9.679 -15.981) 21.275 3.151 ( -11.320 18.323 30.428) 37.279 3.361 ( 4.751 -1.624 5.195) 7.225 3.455 ( -1.941 0.362 4.562) 4.971 3.524 ( 9.687 12.740 -10.526) 19.156 3.721 ( 2.162 1.528 8.615) 9.012 3.933 ( -1.269 3.831 2.959) 5.004 4.130 ( 4.363 4.690 -9.849) 11.749 4.579 ( 2.517 -5.456 -8.971) 10.798 4.871 ( -3.012 -0.816 12.428) 12.814 4.922 ( -0.154 7.801 1.249) 7.902 5.213 ( -2.431 10.260 -5.265) 11.786 5.276 ( -1.004 -4.050 0.621) 4.218 5.393 ( 1.697 -0.290 -2.309) 2.880 5.412 ( -2.923 -4.094 -14.502) 15.349 6.746 ( 15.036 -14.931 -1.635) 21.253 7.088 ( -4.574 -11.477 3.384) 12.810 7.940 ( 1.967 -4.763 1.762) 5.446 8.414 ( 3.785 4.867 -1.499) 6.345 8.728 ( -1.092 -5.317 -10.998) 12.265 8.867 ( -8.807 2.754 12.057) 15.182 25.281 ( 0.714 29.321 1.163) 29.352 25.387 ( 0.480 31.398 -3.706) 31.620 27.612 ( -0.975 8.829 1.755) 9.055 27.652 ( 0.565 9.960 -2.216) 10.219 29.982 ( -2.876 -8.670 6.828) 11.405 30.053 ( 3.401 -6.256 -5.738) 9.145 34.118 ( -0.112 -31.088 5.378) 31.550 34.261 ( 2.018 -31.492 -4.827) 31.924 94.473 ( 1.392 16.855 3.633) 17.298 94.728 ( 3.748 22.224 -10.892) 25.032 97.053 ( 1.296 -6.590 -2.337) 7.111 97.196 ( -7.573 -8.492 4.515) 12.241 ======================= Grid point 433 (213/252) ======================= q-point: ( 0.00 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.780 ( -6.448 17.542 8.785) 20.651 1.991 ( 2.773 11.223 -11.878) 16.575 2.298 ( 11.343 18.751 12.106) 25.036 2.564 ( -10.975 13.860 -14.340) 22.764 3.403 ( 0.296 -1.892 3.878) 4.325 3.430 ( -2.164 1.464 2.544) 3.647 3.567 ( -3.410 17.457 19.363) 26.293 3.874 ( 2.366 8.064 -0.858) 8.448 3.890 ( 11.594 5.245 -1.223) 12.784 3.986 ( -4.609 2.700 -2.735) 6.001 4.240 ( -0.934 3.774 -1.019) 4.019 4.339 ( -4.237 0.106 -8.579) 9.569 4.849 ( -5.050 -2.105 12.794) 13.915 5.065 ( 5.175 0.597 -3.134) 6.080 5.179 ( 0.633 -3.587 -2.799) 4.594 5.204 ( -0.981 -2.715 -5.352) 6.081 5.338 ( -0.076 0.485 2.691) 2.736 5.403 ( 0.438 -0.786 -3.734) 3.841 6.696 ( -9.100 -10.843 1.499) 14.235 6.741 ( 9.830 -14.776 -2.809) 17.969 8.035 ( -0.295 -0.363 7.911) 7.925 8.195 ( -4.526 0.875 -8.620) 9.775 8.739 ( -13.988 -0.095 7.399) 15.825 8.880 ( 18.348 -2.384 -6.906) 19.749 25.993 ( 0.777 40.651 2.575) 40.739 26.058 ( -0.686 40.803 -4.255) 41.030 27.817 ( -1.257 12.514 3.039) 12.939 27.879 ( 1.235 13.723 -3.339) 14.178 29.796 ( -3.562 -9.428 7.387) 12.495 29.923 ( 3.039 -9.076 -5.689) 11.134 33.423 ( -0.285 -43.457 4.587) 43.699 33.513 ( 0.478 -44.341 -4.497) 44.571 94.900 ( 0.920 19.700 7.045) 20.942 95.072 ( -1.425 19.554 -10.907) 22.435 96.923 ( -4.707 -9.743 1.736) 10.959 96.956 ( 5.906 -10.269 -1.594) 11.952 ======================= Grid point 434 (214/252) ======================= q-point: ( 0.10 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.823 ( 2.895 12.045 12.121) 17.332 2.030 ( 6.708 17.187 -5.606) 19.282 2.270 ( -5.573 11.603 -14.923) 19.707 2.589 ( 7.881 15.447 13.510) 21.982 3.385 ( -3.944 -0.076 1.461) 4.207 3.422 ( -1.453 -1.753 2.445) 3.341 3.613 ( -6.247 14.309 6.919) 17.078 3.754 ( -6.196 3.355 4.380) 8.296 3.937 ( 7.619 11.248 -17.535) 22.182 4.065 ( 1.177 6.498 0.690) 6.640 4.219 ( 0.398 3.759 -0.282) 3.791 4.292 ( -1.393 -1.485 5.262) 5.643 4.843 ( -4.628 -2.204 12.147) 13.184 5.089 ( 2.834 -3.061 -8.047) 9.064 5.173 ( 1.063 -1.325 -2.848) 3.316 5.237 ( 4.897 0.105 1.450) 5.109 5.348 ( -0.010 1.451 -0.347) 1.492 5.385 ( -0.009 -2.001 -1.431) 2.460 6.407 ( -19.389 -13.923 1.368) 23.910 6.919 ( 7.472 -14.840 -3.220) 16.924 7.874 ( -9.171 1.923 4.881) 10.566 8.409 ( 16.469 -0.866 3.602) 16.881 8.515 ( -13.515 2.230 3.346) 14.101 9.107 ( 13.030 -2.319 -10.769) 17.062 26.001 ( -1.552 40.444 -1.406) 40.498 26.030 ( 0.286 40.900 0.829) 40.909 27.817 ( -1.048 12.543 3.128) 12.969 27.881 ( 1.496 13.717 -3.170) 14.157 29.780 ( -3.691 -8.827 7.176) 11.959 29.934 ( 2.520 -9.350 -5.807) 11.292 33.440 ( -1.326 -43.332 4.348) 43.570 33.479 ( -0.500 -44.656 -4.677) 44.903 94.939 ( -2.842 19.834 1.764) 20.114 94.964 ( -2.314 19.683 -1.918) 19.911 96.870 ( -1.918 -8.754 1.223) 9.044 97.066 ( 7.396 -12.469 -3.182) 14.842 ======================= Grid point 435 (215/252) ======================= q-point: ( 0.20 0.23 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.933 ( 0.582 17.652 -8.874) 19.765 2.096 ( 7.962 5.277 12.904) 16.054 2.307 ( 14.929 11.355 -7.419) 20.170 2.776 ( 1.364 12.211 14.879) 19.297 3.245 ( -8.672 -4.409 -6.854) 11.900 3.407 ( -2.135 -0.901 3.577) 4.262 3.518 ( -6.629 5.946 11.621) 14.641 3.789 ( 3.952 7.866 -2.441) 9.135 3.938 ( 4.371 12.008 -12.377) 17.790 4.031 ( -3.802 6.743 -0.583) 7.763 4.176 ( -4.730 4.407 -3.435) 7.321 4.290 ( -2.366 0.495 4.154) 4.806 4.867 ( -1.430 -0.990 9.694) 9.848 5.102 ( 5.424 -2.902 -8.156) 10.216 5.195 ( 0.909 -3.054 2.084) 3.807 5.289 ( -1.469 2.684 0.921) 3.195 5.367 ( 2.617 -3.717 -1.315) 4.732 5.399 ( 2.922 0.997 0.654) 3.156 6.052 ( -20.746 -16.389 4.502) 26.819 6.927 ( -2.873 -16.813 -7.386) 18.588 7.851 ( -0.145 3.011 9.157) 9.641 8.353 ( -4.029 6.355 0.879) 7.576 8.717 ( 12.232 -1.937 5.930) 13.731 9.204 ( 7.184 -0.607 -12.411) 14.353 25.958 ( -1.396 40.040 -1.749) 40.103 26.042 ( -0.530 40.739 1.947) 40.789 27.822 ( -0.884 12.568 3.157) 12.989 27.888 ( 1.640 13.720 -3.007) 14.142 29.765 ( -3.395 -8.532 7.052) 11.578 29.932 ( 1.875 -9.423 -6.131) 11.397 33.431 ( -1.356 -44.458 -1.891) 44.519 33.438 ( -1.799 -43.785 1.301) 43.841 94.844 ( -3.065 19.358 -4.735) 20.163 94.947 ( -4.389 19.622 6.164) 21.031 96.878 ( 1.234 -8.984 2.604) 9.434 97.166 ( 6.445 -14.159 -4.578) 16.216 ======================= Grid point 436 (216/252) ======================= q-point: ( 0.30 0.23 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.923 ( 8.923 10.511 -11.705) 18.086 2.395 ( 11.147 1.246 13.727) 17.727 2.563 ( 15.945 13.097 -2.652) 20.804 2.829 ( -5.568 8.225 8.748) 13.235 3.068 ( -4.905 -2.227 -2.853) 6.096 3.390 ( -2.937 -1.750 3.130) 4.635 3.506 ( -6.671 5.053 16.763) 18.736 3.808 ( 0.513 5.274 -5.889) 7.922 3.895 ( -6.759 1.173 -1.005) 6.933 3.938 ( 1.125 9.458 -8.382) 12.687 4.070 ( -2.803 5.569 -2.395) 6.679 4.274 ( 0.461 6.887 -4.737) 8.371 4.920 ( 2.020 0.170 4.522) 4.955 5.166 ( 6.635 -1.225 -7.408) 10.020 5.203 ( -1.372 -8.698 -0.193) 8.808 5.233 ( -4.701 3.495 3.247) 6.697 5.410 ( -1.299 -3.843 2.646) 4.843 5.455 ( 3.398 -0.358 2.088) 4.005 5.780 ( -12.767 -13.734 8.395) 20.545 6.730 ( -10.095 -18.698 -12.272) 24.538 7.943 ( 2.185 5.255 10.435) 11.886 8.400 ( 7.090 5.214 0.872) 8.844 8.898 ( 3.271 -0.553 4.256) 5.397 9.226 ( 4.942 1.373 -10.224) 11.438 25.933 ( -0.386 39.625 -0.728) 39.634 26.035 ( -1.397 40.389 1.110) 40.428 27.829 ( -0.820 12.556 3.181) 12.979 27.897 ( 1.588 13.733 -2.984) 14.143 29.756 ( -3.029 -8.554 7.012) 11.468 29.918 ( 1.575 -9.280 -6.436) 11.403 33.392 ( -0.311 -44.983 -3.587) 45.127 33.413 ( -2.925 -43.513 2.969) 43.712 94.776 ( -1.391 18.795 -2.915) 19.071 94.889 ( -5.499 19.322 3.889) 20.462 96.942 ( 2.591 -10.301 4.860) 11.681 97.232 ( 4.628 -15.090 -5.462) 16.702 ======================= Grid point 437 (217/252) ======================= q-point: ( 0.40 0.23 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.096 ( 17.222 4.322 -8.727) 19.785 2.576 ( -6.969 -0.948 4.051) 8.117 2.712 ( 0.648 6.352 9.206) 11.203 2.854 ( 11.643 8.825 -3.655) 15.060 3.049 ( 2.374 2.937 2.507) 4.533 3.307 ( -8.637 -3.552 1.407) 9.444 3.502 ( -7.878 5.403 19.772) 21.959 3.713 ( -3.373 -2.071 -0.875) 4.053 3.834 ( -0.107 12.678 -5.084) 13.660 3.919 ( 0.870 4.312 -2.052) 4.854 4.025 ( 0.147 5.039 -5.047) 7.134 4.232 ( -0.348 6.733 -7.878) 10.369 5.008 ( 5.003 -1.829 1.941) 5.670 5.136 ( -7.422 -4.859 3.553) 9.556 5.156 ( 1.393 -5.189 -6.517) 8.446 5.245 ( 0.528 4.994 -1.099) 5.140 5.377 ( -0.342 -2.652 3.609) 4.492 5.562 ( 3.836 -6.116 3.367) 7.966 5.693 ( -4.696 -9.173 11.016) 15.085 6.437 ( -10.064 -18.520 -15.911) 26.409 8.074 ( 3.376 5.702 11.965) 13.678 8.526 ( 5.763 2.458 -5.940) 8.633 8.933 ( -1.541 2.509 7.652) 8.199 9.244 ( 3.786 2.270 -8.804) 9.849 25.935 ( 0.904 39.430 0.089) 39.440 26.009 ( -1.854 39.969 0.098) 40.012 27.836 ( -0.893 12.520 3.221) 12.959 27.903 ( 1.393 13.728 -3.094) 14.141 29.753 ( -2.770 -8.719 7.077) 11.566 29.902 ( 1.716 -9.100 -6.538) 11.336 33.373 ( -1.440 -44.200 0.492) 44.226 33.379 ( -0.576 -44.467 -0.998) 44.482 94.754 ( 0.717 18.505 -1.749) 18.601 94.815 ( -4.660 18.845 1.966) 19.512 97.026 ( 1.988 -11.772 6.437) 13.563 97.256 ( 2.500 -15.452 -6.300) 16.873 ======================= Grid point 438 (218/252) ======================= q-point: (-0.50 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.302 ( -17.813 1.786 2.518) 18.078 2.389 ( 17.159 0.911 -6.349) 18.319 2.803 ( -3.983 7.891 10.884) 14.021 2.962 ( 4.623 2.893 -5.113) 7.475 3.132 ( -8.853 -2.461 2.157) 9.439 3.184 ( 9.455 0.962 -2.828) 9.915 3.502 ( -6.369 6.311 18.273) 20.354 3.724 ( 3.246 -2.903 2.142) 4.853 3.807 ( 1.643 15.199 -4.395) 15.906 3.892 ( -1.164 3.700 -6.423) 7.504 4.031 ( 1.464 7.514 3.235) 8.310 4.148 ( -2.628 4.650 -8.530) 10.064 4.994 ( -10.316 -5.626 8.531) 14.521 5.144 ( 6.969 1.935 -2.108) 7.533 5.166 ( 0.478 -5.458 -2.550) 6.043 5.193 ( 0.177 0.557 -2.905) 2.964 5.457 ( 2.249 -0.925 4.382) 5.011 5.559 ( 0.993 -3.489 -6.285) 7.257 5.818 ( 4.700 -14.833 18.413) 24.107 6.172 ( -5.466 -15.751 -17.633) 24.268 8.221 ( 2.447 3.609 13.534) 14.219 8.479 ( -2.526 3.416 -12.855) 13.539 8.980 ( -3.362 3.263 13.817) 14.589 9.239 ( 4.564 2.541 -12.352) 13.411 25.963 ( 1.108 39.450 0.575) 39.470 25.976 ( -0.798 39.757 -0.751) 39.772 27.841 ( -1.096 12.499 3.215) 12.952 27.904 ( 1.180 13.697 -3.217) 14.119 29.755 ( -2.572 -8.911 7.276) 11.788 29.890 ( 2.047 -8.983 -6.473) 11.260 33.339 ( -2.629 -43.773 2.469) 43.921 33.391 ( 2.654 -44.935 -2.808) 45.101 94.755 ( -2.931 18.392 1.110) 18.657 94.779 ( 3.172 18.630 -1.294) 18.942 97.095 ( 0.196 -12.746 6.920) 14.504 97.234 ( 0.428 -15.287 -7.235) 16.918 ======================= Grid point 439 (219/252) ======================= q-point: (-0.40 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.965 ( -19.212 5.020 4.497) 20.360 2.645 ( 8.044 3.525 -2.102) 9.031 2.732 ( -5.127 7.306 6.562) 11.078 2.876 ( -7.786 0.377 -5.829) 9.733 3.089 ( 1.185 2.001 -1.592) 2.818 3.332 ( 7.277 -2.743 -0.620) 7.802 3.540 ( -1.007 8.861 12.290) 15.185 3.800 ( -1.339 6.736 -1.798) 7.100 3.830 ( 2.147 10.377 4.687) 11.587 3.862 ( 7.520 3.902 -6.609) 10.745 4.006 ( -6.313 -0.286 -6.102) 8.785 4.102 ( 2.294 6.809 4.266) 8.357 4.879 ( -9.123 -2.671 10.498) 14.162 5.121 ( -0.364 -0.743 -1.064) 1.348 5.210 ( 1.799 -3.037 -2.586) 4.376 5.253 ( 3.709 -1.896 -1.420) 4.401 5.450 ( 0.173 0.855 -2.499) 2.647 5.611 ( 4.751 -6.507 -3.960) 8.977 5.950 ( -0.522 -11.040 -7.852) 13.557 6.138 ( 11.709 -18.128 9.230) 23.471 8.295 ( -5.809 4.034 -4.710) 8.497 8.343 ( -1.045 3.184 5.171) 6.162 8.960 ( -6.820 3.442 9.090) 11.874 9.243 ( 3.862 1.140 -11.077) 11.786 25.941 ( -1.152 39.475 -0.471) 39.495 26.012 ( 2.804 40.020 -0.213) 40.119 27.841 ( -1.347 12.508 3.090) 12.955 27.901 ( 1.023 13.662 -3.254) 14.081 29.762 ( -2.332 -9.145 7.597) 12.115 29.885 ( 2.345 -8.897 -6.341) 11.175 33.319 ( -1.504 -43.854 2.641) 43.959 33.429 ( 3.559 -44.749 -2.781) 44.976 94.726 ( -1.130 18.156 1.121) 18.226 94.851 ( 5.945 19.083 -1.726) 20.062 97.120 ( -2.409 -13.244 4.526) 14.202 97.176 ( -1.208 -14.265 -5.826) 15.456 ======================= Grid point 440 (220/252) ======================= q-point: (-0.30 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.725 ( -10.793 11.944 8.176) 18.056 2.492 ( -15.928 15.628 4.943) 22.856 2.655 ( -8.111 0.354 -12.406) 14.827 2.895 ( 9.625 -1.434 0.758) 9.760 3.090 ( 1.167 3.159 -3.714) 5.013 3.412 ( 1.346 0.175 2.400) 2.757 3.584 ( -4.707 16.434 8.712) 19.187 3.793 ( -0.454 5.640 -3.879) 6.860 3.836 ( -5.930 2.719 2.295) 6.916 3.894 ( 5.734 7.688 1.472) 9.703 4.011 ( 7.948 0.093 -1.480) 8.085 4.196 ( 5.754 3.138 2.960) 7.191 4.820 ( -5.615 -1.708 10.866) 12.349 5.129 ( -0.369 3.639 -2.399) 4.374 5.184 ( -0.463 -5.150 0.860) 5.242 5.307 ( 3.378 -3.095 -1.944) 4.977 5.455 ( 0.555 0.583 -1.846) 2.014 5.584 ( -2.382 -8.142 -9.290) 12.580 5.960 ( 10.297 -10.853 -9.804) 17.887 6.478 ( 14.433 -17.906 12.802) 26.322 8.123 ( -5.927 6.157 -7.579) 11.423 8.349 ( -3.743 2.547 5.532) 7.149 8.909 ( -4.695 1.857 7.106) 8.717 9.181 ( -3.476 -0.462 -9.090) 9.743 25.927 ( -0.175 39.612 -0.079) 39.613 26.059 ( 2.805 40.457 -1.307) 40.575 27.836 ( -1.519 12.528 2.909) 12.951 27.896 ( 0.919 13.657 -3.253) 14.069 29.777 ( -2.122 -9.495 7.897) 12.531 29.886 ( 2.597 -8.807 -6.174) 11.064 33.323 ( -0.285 -43.860 3.205) 43.978 33.475 ( 3.546 -44.488 -3.110) 44.737 94.730 ( 0.447 18.281 1.837) 18.379 94.964 ( 8.319 19.424 -3.682) 21.448 97.052 ( -3.767 -12.581 -5.258) 14.146 97.132 ( -3.613 -12.935 3.642) 13.915 ======================= Grid point 441 (221/252) ======================= q-point: (-0.20 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.718 ( 2.453 19.451 11.008) 22.484 2.207 ( -17.489 19.434 2.732) 26.288 2.404 ( -8.045 0.862 -15.986) 17.917 3.022 ( 0.649 7.222 -9.852) 12.233 3.107 ( 6.222 -3.526 6.265) 9.508 3.441 ( 0.391 1.020 2.111) 2.377 3.533 ( -9.088 17.182 16.563) 25.537 3.693 ( -3.349 -0.906 -1.842) 3.928 3.804 ( -0.257 14.985 -0.924) 15.016 4.047 ( 2.107 7.458 7.947) 11.100 4.124 ( 8.956 1.224 -5.855) 10.770 4.356 ( 10.224 -2.308 -1.505) 10.589 4.819 ( -3.232 -1.668 10.885) 11.477 5.066 ( -2.388 3.843 -3.149) 5.512 5.209 ( 0.378 -5.397 -0.321) 5.420 5.340 ( 0.353 -2.735 0.256) 2.770 5.413 ( -3.722 0.973 -1.070) 3.993 5.455 ( -1.870 -5.590 -11.433) 12.863 6.162 ( 17.321 -14.938 -6.394) 23.750 6.772 ( 8.220 -15.259 8.142) 19.149 7.985 ( -4.639 4.632 -4.135) 7.750 8.356 ( 4.690 4.763 0.765) 6.728 8.842 ( -8.225 -3.141 -1.638) 8.955 9.014 ( -9.227 0.454 1.317) 9.331 25.934 ( 0.696 39.927 0.716) 39.939 26.090 ( 2.021 40.731 -2.834) 40.880 27.828 ( -1.550 12.529 2.834) 12.939 27.889 ( 0.897 13.686 -3.314) 14.110 29.793 ( -2.263 -9.879 7.939) 12.874 29.893 ( 2.881 -8.749 -5.974) 10.979 33.351 ( 0.460 -43.784 3.905) 43.961 33.509 ( 2.781 -44.225 -3.583) 44.457 94.766 ( 1.575 18.723 3.177) 19.056 95.083 ( 8.272 19.294 -7.479) 22.285 96.947 ( -3.209 -10.278 -4.522) 11.678 97.079 ( -5.279 -12.225 4.242) 13.976 ======================= Grid point 442 (222/252) ======================= q-point: (-0.10 0.23 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.896 ( -0.699 26.116 2.952) 26.291 1.967 ( -3.694 14.948 11.659) 19.314 2.174 ( -3.170 5.551 -14.796) 16.118 2.849 ( -8.849 11.905 -12.564) 19.439 3.304 ( 6.882 -3.842 7.119) 10.621 3.450 ( -0.974 0.071 1.102) 1.473 3.516 ( -7.386 17.830 22.200) 29.416 3.695 ( 4.624 -0.555 2.217) 5.158 3.823 ( 4.236 14.413 -4.098) 15.571 4.067 ( -3.408 8.966 4.271) 10.500 4.225 ( 5.426 4.341 -5.808) 9.056 4.461 ( 2.170 -6.107 -8.031) 10.320 4.840 ( -3.635 -1.866 11.930) 12.610 5.020 ( 0.507 2.058 -2.992) 3.667 5.191 ( 0.197 -4.503 -2.545) 5.176 5.278 ( -4.499 -1.926 -0.787) 4.957 5.358 ( -2.530 -1.844 -2.069) 3.753 5.406 ( 2.438 -0.217 -5.048) 5.610 6.457 ( 17.804 -15.458 -3.325) 23.811 6.854 ( -3.658 -12.211 3.125) 13.124 7.930 ( 1.764 3.448 -0.413) 3.895 8.498 ( -5.917 2.997 -3.981) 7.736 8.608 ( 5.722 -5.114 -7.400) 10.661 8.898 ( -10.349 0.034 10.077) 14.445 25.959 ( 1.077 40.330 1.701) 40.380 26.090 ( 0.616 40.820 -4.045) 41.025 27.820 ( -1.447 12.513 2.907) 12.928 27.883 ( 1.005 13.717 -3.382) 14.164 29.802 ( -2.907 -9.917 7.690) 12.882 29.906 ( 3.117 -8.826 -5.783) 11.003 33.389 ( 0.426 -43.637 4.430) 43.863 33.523 ( 1.667 -44.143 -4.063) 44.361 94.828 ( 1.935 19.290 5.070) 20.039 95.132 ( 3.880 19.163 -11.060) 22.464 96.900 ( 1.038 -9.069 -1.878) 9.319 97.004 ( -5.736 -11.129 3.171) 12.915 ======================= Grid point 443 (223/252) ======================= q-point: ( 0.00 0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( -8.000 20.195 2.353) 21.849 2.247 ( 5.592 14.744 -7.034) 17.266 2.687 ( 9.753 20.704 8.017) 24.250 2.858 ( -10.838 15.871 -9.317) 21.358 3.345 ( 1.995 -4.103 4.791) 6.616 3.421 ( -1.057 -1.965 -2.546) 3.385 3.812 ( 6.949 -0.919 10.464) 12.595 3.945 ( 0.512 13.693 10.847) 17.476 3.975 ( -11.568 -2.486 -5.074) 12.874 4.135 ( 4.551 11.522 -7.396) 14.428 4.350 ( -0.988 8.860 1.830) 9.101 4.415 ( 0.779 6.542 -4.139) 7.780 4.806 ( -5.359 -2.179 11.972) 13.297 5.047 ( 5.489 -1.858 -9.183) 10.859 5.121 ( 0.658 -2.368 0.331) 2.480 5.131 ( -1.956 -3.646 -1.097) 4.280 5.307 ( 1.476 -3.843 1.697) 4.453 5.327 ( -1.638 -6.455 -0.540) 6.681 6.415 ( 13.414 -18.872 0.801) 23.168 6.460 ( -12.694 -14.817 -3.867) 19.890 8.088 ( -4.285 5.750 8.405) 11.048 8.261 ( 0.157 5.730 -9.246) 10.879 8.726 ( -10.643 -1.090 4.482) 11.600 8.819 ( 14.932 -3.787 -4.917) 16.171 26.866 ( 0.891 49.134 2.587) 49.210 26.929 ( -0.812 48.763 -3.867) 48.922 28.087 ( -1.703 15.172 4.254) 15.849 28.173 ( 1.679 16.322 -4.482) 17.009 29.596 ( -3.155 -11.227 7.469) 13.848 29.726 ( 2.911 -11.247 -5.826) 12.997 32.485 ( 0.241 -52.858 3.707) 52.989 32.557 ( -0.155 -53.692 -3.655) 53.816 95.273 ( 0.847 18.664 6.661) 19.835 95.424 ( -1.193 16.868 -8.848) 19.085 96.716 ( -3.200 -11.531 1.404) 12.048 96.743 ( 3.796 -11.627 -1.308) 12.301 ======================= Grid point 444 (224/252) ======================= q-point: ( 0.10 0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.098 ( -0.943 15.997 6.578) 17.322 2.371 ( 11.289 16.452 -3.229) 20.212 2.570 ( -12.169 19.367 -8.723) 24.480 2.896 ( 5.099 15.804 10.265) 19.523 3.338 ( -5.926 -4.618 -5.300) 9.194 3.378 ( -1.090 -2.832 3.422) 4.573 3.689 ( -11.866 -0.937 -0.323) 11.908 3.972 ( 1.714 6.841 7.940) 10.620 4.067 ( 2.094 5.530 0.154) 5.915 4.199 ( 8.484 9.320 -5.982) 13.950 4.301 ( -4.282 7.974 2.279) 9.333 4.384 ( -1.573 8.021 -2.822) 8.647 4.795 ( -4.509 -2.429 12.796) 13.783 5.051 ( 2.681 -0.606 -8.632) 9.059 5.108 ( 1.740 -3.926 -2.334) 4.888 5.208 ( 5.183 -2.881 1.882) 6.221 5.297 ( -1.034 -6.673 0.152) 6.755 5.346 ( 1.674 -2.087 0.407) 2.706 6.127 ( -19.912 -15.604 -2.894) 25.463 6.588 ( 4.217 -19.510 0.507) 19.967 7.983 ( -6.857 8.491 6.396) 12.650 8.422 ( 14.140 2.767 0.357) 14.413 8.567 ( -7.999 2.412 1.194) 8.439 9.027 ( 12.472 -5.493 -8.514) 16.069 26.869 ( -1.889 48.802 -1.446) 48.860 26.906 ( 0.346 49.102 0.977) 49.112 28.088 ( -1.497 15.193 4.324) 15.867 28.174 ( 1.946 16.311 -4.347) 16.992 29.587 ( -3.348 -11.054 7.045) 13.529 29.733 ( 2.512 -11.324 -6.169) 13.138 32.504 ( -0.944 -52.720 3.465) 52.842 32.518 ( -1.192 -53.989 -3.612) 54.123 95.309 ( -2.626 18.236 1.707) 18.503 95.332 ( -2.193 18.109 -1.701) 18.321 96.681 ( -1.461 -10.712 1.124) 10.869 96.813 ( 4.797 -13.553 -2.094) 14.529 ======================= Grid point 445 (225/252) ======================= q-point: ( 0.20 0.31 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( 5.546 9.692 8.158) 13.829 2.316 ( -6.841 17.057 -8.129) 20.095 2.595 ( 13.368 17.869 0.345) 22.319 3.016 ( -0.432 12.049 9.859) 15.575 3.138 ( -8.778 -6.221 -6.681) 12.665 3.371 ( -2.301 -2.727 3.243) 4.821 3.569 ( -5.227 0.725 6.886) 8.675 3.968 ( -4.874 3.070 -0.156) 5.762 4.032 ( -4.937 3.396 -0.266) 5.999 4.206 ( 0.887 10.754 -9.346) 14.275 4.284 ( -3.392 8.450 1.913) 9.305 4.384 ( 4.136 7.050 -2.234) 8.474 4.833 ( -1.261 -1.998 11.017) 11.267 5.059 ( 3.918 -1.832 -6.548) 7.847 5.120 ( 0.765 -2.860 -0.884) 3.089 5.273 ( 1.524 -4.808 -1.277) 5.203 5.317 ( 0.201 -1.961 3.903) 4.373 5.385 ( 4.153 -2.072 -0.917) 4.731 5.756 ( -18.925 -14.254 1.930) 23.771 6.556 ( -6.241 -21.078 -3.994) 22.342 7.982 ( 0.398 9.326 8.955) 12.935 8.480 ( -0.783 6.520 -0.808) 6.616 8.690 ( 12.295 -0.698 3.353) 12.763 9.145 ( 8.151 -4.881 -10.328) 14.033 26.821 ( -1.749 48.657 -1.614) 48.716 26.915 ( -0.724 49.007 1.798) 49.045 28.092 ( -1.375 15.148 4.318) 15.812 28.182 ( 2.119 16.312 -4.232) 16.985 29.575 ( -3.261 -11.035 6.757) 13.344 29.730 ( 2.033 -11.398 -6.545) 13.300 32.466 ( -1.482 -54.227 -3.320) 54.349 32.501 ( -2.057 -52.702 3.032) 52.829 95.219 ( -3.051 19.110 -4.655) 19.904 95.313 ( -4.161 18.047 5.617) 19.354 96.683 ( 0.523 -11.007 1.961) 11.193 96.879 ( 4.271 -15.350 -2.898) 16.195 ======================= Grid point 446 (226/252) ======================= q-point: ( 0.30 0.31 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.174 ( 1.717 14.847 -9.753) 17.846 2.433 ( 7.582 2.752 10.782) 13.465 2.842 ( 12.488 14.033 0.895) 18.806 2.911 ( -8.349 -1.342 -2.738) 8.889 3.092 ( 0.039 7.010 4.634) 8.403 3.332 ( -4.611 -4.120 2.238) 6.576 3.549 ( -5.237 0.115 12.381) 13.443 3.804 ( -9.986 -3.001 -0.927) 10.468 3.978 ( -0.986 6.442 1.417) 6.669 4.150 ( -1.293 9.105 -6.795) 11.434 4.215 ( -2.633 9.693 -4.271) 10.915 4.409 ( 1.049 6.923 -4.987) 8.596 4.869 ( -2.907 -4.809 8.765) 10.412 5.041 ( 0.826 -4.603 -8.599) 9.788 5.182 ( 4.678 0.362 1.803) 5.027 5.273 ( -1.267 -0.161 0.306) 1.313 5.334 ( 0.541 -1.937 3.213) 3.791 5.460 ( 1.842 -1.020 -1.606) 2.648 5.522 ( -9.034 -12.891 8.812) 18.040 6.337 ( -11.148 -21.485 -10.046) 26.207 8.091 ( 3.234 9.291 10.470) 14.366 8.520 ( 5.495 6.808 -1.903) 8.954 8.882 ( 5.725 -1.019 3.463) 6.768 9.196 ( 5.720 -3.810 -9.375) 11.624 26.790 ( -0.687 48.518 -0.591) 48.527 26.902 ( -1.713 48.757 1.021) 48.798 28.098 ( -1.339 15.029 4.301) 15.689 28.190 ( 2.058 16.301 -4.254) 16.972 29.565 ( -3.042 -11.135 6.687) 13.340 29.717 ( 1.789 -11.429 -6.768) 13.402 32.424 ( -0.720 -54.364 -2.681) 54.435 32.475 ( -2.846 -52.767 2.360) 52.896 95.150 ( -1.501 19.457 -3.062) 19.753 95.257 ( -5.341 18.437 3.707) 19.550 96.722 ( 1.518 -12.280 3.361) 12.821 96.923 ( 3.042 -16.591 -3.506) 17.228 ======================= Grid point 447 (227/252) ======================= q-point: ( 0.40 0.31 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( 11.113 9.348 -7.681) 16.428 2.557 ( -4.846 -0.816 5.886) 7.668 2.795 ( 0.175 0.692 0.453) 0.846 3.012 ( 2.546 7.488 2.623) 8.332 3.154 ( 6.453 7.780 -1.613) 10.236 3.221 ( -8.077 -4.514 1.027) 9.310 3.541 ( -5.919 -0.767 15.309) 16.432 3.672 ( -4.026 -0.913 0.978) 4.243 3.988 ( -1.311 3.654 2.504) 4.620 4.099 ( 1.844 11.835 -4.946) 12.958 4.145 ( -0.174 6.890 -5.258) 8.669 4.359 ( -2.649 6.586 -4.845) 8.594 4.860 ( -4.153 -8.173 9.149) 12.952 5.029 ( 4.698 -2.910 -9.925) 11.360 5.180 ( -4.106 0.674 2.346) 4.777 5.324 ( 0.989 3.483 -4.398) 5.696 5.352 ( 2.556 0.121 4.268) 4.976 5.445 ( -1.735 -9.622 12.210) 15.642 5.520 ( -0.775 -6.273 1.290) 6.451 6.064 ( -8.248 -19.798 -14.590) 25.940 8.223 ( 2.448 9.188 11.467) 14.897 8.601 ( 5.181 5.158 -7.136) 10.216 8.961 ( 0.293 0.329 6.802) 6.816 9.228 ( 4.484 -3.312 -8.678) 10.315 26.790 ( 0.759 48.399 0.271) 48.405 26.870 ( -2.104 48.546 0.020) 48.592 28.104 ( -1.386 14.909 4.335) 15.588 28.195 ( 1.812 16.218 -4.374) 16.895 29.559 ( -2.831 -11.261 6.806) 13.459 29.703 ( 1.877 -11.429 -6.759) 13.410 32.407 ( 0.762 -54.331 -1.954) 54.371 32.435 ( -2.969 -52.923 1.684) 53.033 95.124 ( 0.682 19.471 -1.906) 19.575 95.183 ( -4.714 18.919 2.036) 19.603 96.777 ( 1.335 -13.787 4.419) 14.539 96.938 ( 1.514 -17.145 -4.156) 17.706 ======================= Grid point 448 (228/252) ======================= q-point: (-0.50 0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.362 ( -15.224 4.145 2.369) 15.955 2.440 ( 15.573 4.183 -5.623) 17.077 2.905 ( 5.272 0.312 3.862) 6.542 2.960 ( -5.105 -2.504 -1.800) 5.965 3.121 ( -5.109 3.191 5.806) 8.366 3.243 ( 4.386 4.749 -6.060) 8.861 3.561 ( -3.296 0.858 12.930) 13.371 3.662 ( 1.926 -2.876 2.027) 4.011 3.985 ( 1.160 4.916 0.698) 5.099 4.070 ( 0.797 10.759 -6.826) 12.766 4.197 ( 2.080 9.218 1.935) 9.646 4.253 ( -3.925 6.184 -4.273) 8.480 4.852 ( -4.408 -6.941 8.941) 12.147 5.029 ( 2.568 -5.445 -8.387) 10.324 5.184 ( 2.352 1.106 3.704) 4.524 5.242 ( -3.714 2.825 -2.313) 5.208 5.454 ( 0.073 -2.309 2.150) 3.156 5.496 ( 2.051 -2.922 -1.565) 3.898 5.548 ( 2.748 -11.975 13.466) 18.229 5.860 ( -2.245 -16.357 -16.154) 23.099 8.333 ( 0.130 7.711 12.581) 14.756 8.575 ( -0.218 6.269 -12.044) 13.580 9.008 ( -2.892 -0.228 11.398) 11.761 9.233 ( 3.886 -2.820 -11.145) 12.135 26.817 ( 0.922 48.340 0.851) 48.356 26.834 ( -0.593 48.500 -0.964) 48.513 28.108 ( -1.534 14.879 4.379) 15.586 28.195 ( 1.569 16.081 -4.454) 16.760 29.558 ( -2.643 -11.364 7.067) 13.640 29.692 ( 2.141 -11.415 -6.581) 13.349 32.395 ( -2.359 -53.059 1.394) 53.130 32.425 ( 2.364 -54.208 -1.569) 54.282 95.122 ( -3.068 19.251 1.252) 19.534 95.148 ( 3.211 19.267 -1.374) 19.581 96.826 ( 0.228 -14.910 4.795) 15.663 96.920 ( 0.125 -16.901 -4.850) 17.584 ======================= Grid point 449 (229/252) ======================= q-point: (-0.40 0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.121 ( -12.053 10.505 3.670) 16.405 2.670 ( 12.071 0.755 -5.866) 13.442 2.815 ( -5.354 -0.717 -1.136) 5.520 2.985 ( -6.520 9.718 5.434) 12.903 3.121 ( 2.594 1.092 1.052) 3.005 3.266 ( 5.029 -2.796 -3.509) 6.739 3.599 ( 0.679 0.045 7.691) 7.721 3.749 ( 4.597 -6.777 -0.248) 8.193 4.020 ( 0.673 11.317 0.257) 11.340 4.056 ( 1.142 8.741 -5.033) 10.151 4.108 ( -2.246 7.606 -1.707) 8.113 4.272 ( 0.326 10.436 3.301) 10.950 4.819 ( -6.222 -2.692 10.462) 12.466 5.021 ( 2.605 -5.297 -6.681) 8.915 5.210 ( 1.266 0.796 -0.620) 1.619 5.247 ( -0.095 0.196 3.711) 3.717 5.411 ( -1.485 -3.991 -1.286) 4.449 5.535 ( 1.089 -3.491 -2.765) 4.585 5.720 ( 3.428 -12.367 -4.842) 13.717 5.801 ( 10.361 -16.399 3.282) 19.674 8.380 ( -4.832 5.671 8.031) 10.955 8.467 ( -1.723 8.307 -7.515) 11.333 8.992 ( -6.166 0.024 8.347) 10.377 9.214 ( 1.797 -3.788 -10.374) 11.189 26.797 ( -1.052 48.534 -0.470) 48.548 26.873 ( 3.066 48.443 -0.211) 48.541 28.109 ( -1.761 14.954 4.333) 15.669 28.191 ( 1.448 15.995 -4.425) 16.659 29.563 ( -2.443 -11.440 7.426) 13.856 29.688 ( 2.399 -11.391 -6.319) 13.245 32.373 ( -1.149 -53.197 1.526) 53.232 32.467 ( 3.362 -53.965 -1.580) 54.093 95.093 ( -1.168 19.432 1.323) 19.512 95.220 ( 5.738 18.754 -1.681) 19.684 96.842 ( -1.765 -15.299 2.441) 15.593 96.883 ( -0.618 -15.853 -3.131) 16.171 ======================= Grid point 450 (230/252) ======================= q-point: (-0.30 0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.020 ( -2.185 17.572 5.931) 18.674 2.646 ( -4.808 1.366 -10.469) 11.601 2.812 ( -7.695 8.819 2.533) 11.975 2.873 ( 1.432 4.457 2.145) 5.149 3.163 ( 3.639 4.270 -2.345) 6.080 3.369 ( 5.422 -4.059 -1.496) 6.936 3.716 ( 1.224 -6.310 0.403) 6.440 3.751 ( 3.984 -1.920 1.623) 4.711 3.981 ( -4.468 14.832 1.695) 15.583 4.111 ( 6.758 6.831 -3.046) 10.080 4.131 ( 2.871 11.802 2.041) 12.316 4.302 ( 0.553 7.802 5.265) 9.429 4.789 ( -5.187 -1.037 11.141) 12.332 5.052 ( 4.924 -5.197 -4.254) 8.328 5.193 ( -4.401 1.051 0.599) 4.565 5.262 ( 1.097 -2.266 1.102) 2.749 5.395 ( -0.072 -3.899 -1.649) 4.234 5.480 ( -3.820 -5.167 -4.198) 7.675 5.732 ( 7.975 -12.807 -11.825) 19.169 6.138 ( 16.809 -17.313 9.556) 25.953 8.258 ( -7.037 7.499 -4.160) 11.093 8.438 ( -1.983 6.580 3.428) 7.679 8.925 ( -6.179 -0.093 4.579) 7.691 9.129 ( -4.485 -4.528 -7.136) 9.568 26.786 ( 0.060 48.694 -0.129) 48.694 26.924 ( 2.991 48.540 -1.175) 48.646 28.105 ( -1.963 15.058 4.201) 15.756 28.186 ( 1.416 16.040 -4.378) 16.687 29.573 ( -2.301 -11.506 7.775) 14.076 29.690 ( 2.618 -11.348 -6.019) 13.110 32.377 ( 0.171 -53.246 2.085) 53.287 32.518 ( 3.406 -53.705 -2.008) 53.850 95.099 ( 0.528 19.517 2.095) 19.637 95.325 ( 7.447 17.760 -3.188) 19.520 96.794 ( -2.401 -13.930 -3.149) 14.482 96.859 ( -2.303 -15.045 2.233) 15.383 ======================= Grid point 451 (231/252) ======================= q-point: (-0.20 0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.119 ( 7.012 21.086 7.326) 23.398 2.457 ( -5.503 4.529 -12.887) 14.726 2.607 ( -12.373 20.918 -0.105) 24.304 3.009 ( 8.133 -4.263 5.192) 10.549 3.188 ( 1.028 7.660 -6.490) 10.092 3.423 ( 2.293 -2.192 -1.815) 3.655 3.645 ( -2.455 -2.772 -0.415) 3.726 3.869 ( -4.784 14.841 8.657) 17.835 4.001 ( 7.554 0.222 3.394) 8.285 4.141 ( 4.254 9.462 -2.956) 10.787 4.257 ( 2.671 10.547 4.633) 11.825 4.362 ( 3.541 2.549 0.065) 4.364 4.788 ( -3.245 -1.283 10.045) 10.634 5.100 ( -3.580 -0.443 0.532) 3.647 5.115 ( 2.889 -3.171 -5.920) 7.311 5.267 ( -1.089 -4.419 0.335) 4.563 5.359 ( -6.343 -4.749 1.126) 8.004 5.381 ( -0.324 -3.582 -4.303) 5.608 5.866 ( 14.662 -15.864 -8.194) 23.103 6.468 ( 12.339 -16.560 4.691) 21.177 8.114 ( -5.242 8.103 -3.222) 10.174 8.452 ( 2.867 5.197 1.243) 6.064 8.791 ( -10.349 -1.999 -4.360) 11.407 8.987 ( -7.969 -2.871 2.869) 8.943 26.798 ( 0.989 48.856 0.703) 48.871 26.958 ( 1.998 48.632 -2.478) 48.736 28.097 ( -2.029 15.118 4.116) 15.799 28.181 ( 1.422 16.176 -4.429) 16.832 29.586 ( -2.380 -11.533 7.942) 14.203 29.699 ( 2.843 -11.284 -5.756) 12.982 32.406 ( 1.001 -53.187 2.821) 53.271 32.557 ( 2.591 -53.513 -2.638) 53.640 95.139 ( 1.693 19.476 3.423) 19.847 95.428 ( 6.859 16.507 -5.928) 18.832 96.732 ( -1.685 -11.842 -2.918) 12.312 96.822 ( -3.597 -14.103 2.700) 14.803 ======================= Grid point 452 (232/252) ======================= q-point: (-0.10 0.31 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.244 ( -0.151 12.179 -3.615) 12.705 2.328 ( -6.384 16.923 -2.665) 18.283 2.463 ( 5.538 25.608 1.472) 26.242 3.084 ( -6.309 11.890 -8.837) 16.102 3.211 ( 8.062 -5.540 6.842) 11.937 3.437 ( 0.822 -1.541 -2.085) 2.720 3.658 ( 3.177 -1.310 3.485) 4.894 3.859 ( -3.719 15.647 14.470) 21.634 4.096 ( 3.506 10.840 -2.022) 11.571 4.200 ( -4.201 -0.067 -4.043) 5.831 4.293 ( 3.421 7.856 4.200) 9.542 4.413 ( 3.235 2.756 -4.519) 6.203 4.805 ( -3.148 -1.640 10.306) 10.900 5.033 ( 0.128 -0.105 -4.996) 4.999 5.120 ( 0.629 -2.315 -3.349) 4.119 5.219 ( -5.459 -3.371 0.306) 6.423 5.283 ( -0.669 -6.010 1.255) 6.176 5.357 ( -0.860 -4.486 -1.346) 4.762 6.129 ( 17.513 -18.370 -2.748) 25.529 6.600 ( -0.087 -14.979 -0.766) 14.999 8.050 ( -0.089 8.282 0.349) 8.290 8.506 ( -13.644 0.002 -8.472) 16.060 8.587 ( 10.978 1.041 -0.828) 11.058 8.873 ( -9.360 -2.381 6.691) 11.750 26.829 ( 1.357 49.015 1.726) 49.064 26.959 ( 0.469 48.703 -3.531) 48.833 28.090 ( -1.921 15.142 4.151) 15.818 28.176 ( 1.492 16.290 -4.508) 16.968 29.596 ( -2.736 -11.438 7.826) 14.127 29.712 ( 3.002 -11.232 -5.670) 12.935 32.447 ( 1.001 -53.040 3.432) 53.160 32.571 ( 1.265 -53.497 -3.245) 53.610 95.204 ( 1.958 19.202 5.113) 19.967 95.471 ( 3.125 15.997 -8.534) 18.398 96.707 ( 0.937 -10.773 -1.544) 10.923 96.770 ( -3.917 -12.834 2.173) 13.593 ======================= Grid point 453 (233/252) ======================= q-point: ( 0.00 0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.525 ( 2.173 16.637 -0.382) 16.783 2.555 ( -2.995 17.580 -3.328) 18.141 3.072 ( 5.990 17.875 3.575) 19.188 3.143 ( -6.855 10.224 -3.000) 12.670 3.252 ( 2.534 -2.910 3.852) 5.452 3.349 ( -1.938 -5.229 -5.187) 7.616 3.745 ( 5.545 -4.498 6.095) 9.387 3.865 ( -10.172 -7.168 -6.323) 13.958 4.219 ( 4.416 11.561 8.214) 14.853 4.334 ( 0.187 8.187 -3.258) 8.813 4.551 ( 1.845 10.472 2.979) 11.043 4.579 ( -1.051 10.186 2.386) 10.515 4.773 ( -5.746 -0.831 9.300) 10.964 4.982 ( 2.541 -4.579 -5.518) 7.608 5.091 ( -0.178 -0.678 -0.310) 0.766 5.111 ( 1.100 1.432 -2.318) 2.938 5.185 ( -3.286 -7.027 1.427) 7.888 5.226 ( 2.875 -2.300 -2.073) 4.225 6.013 ( 11.571 -21.998 2.812) 25.014 6.116 ( -11.147 -20.171 -7.353) 24.190 8.236 ( -4.730 8.702 8.129) 12.813 8.390 ( 1.542 6.615 -7.123) 9.843 8.697 ( -6.747 -1.996 1.071) 7.117 8.741 ( 10.816 -3.911 -3.317) 11.970 27.880 ( 1.051 54.920 2.205) 54.974 27.933 ( -0.957 54.304 -3.276) 54.411 28.396 ( -2.055 16.511 5.375) 17.485 28.502 ( 1.997 17.488 -5.460) 18.429 29.363 ( -2.972 -12.529 7.270) 14.787 29.489 ( 2.889 -12.945 -5.661) 14.421 31.399 ( 0.709 -58.607 2.971) 58.686 31.457 ( -0.700 -59.214 -2.949) 59.291 95.619 ( 0.474 16.949 5.211) 17.738 95.730 ( -0.659 14.837 -6.175) 16.084 96.480 ( -1.981 -12.811 1.560) 13.057 96.510 ( 2.223 -12.354 -1.510) 12.643 ======================= Grid point 454 (234/252) ======================= q-point: ( 0.10 0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.420 ( -4.619 16.707 0.524) 17.341 2.666 ( 6.719 14.390 -0.524) 15.890 2.961 ( -8.354 18.412 -2.508) 20.373 3.181 ( 1.545 9.549 3.997) 10.466 3.220 ( -6.842 -3.176 -4.423) 8.744 3.306 ( -0.419 -4.381 3.815) 5.824 3.657 ( -7.990 -2.543 -0.914) 8.434 3.878 ( 1.513 -8.728 7.406) 11.547 4.288 ( -0.105 10.082 -6.088) 11.778 4.369 ( 5.020 6.768 1.902) 8.639 4.497 ( -5.239 11.624 -3.289) 13.167 4.565 ( -2.510 10.217 2.064) 10.722 4.759 ( -3.182 -0.991 12.038) 12.491 5.007 ( 2.739 -4.964 -3.454) 6.639 5.100 ( 2.161 3.324 -4.201) 5.776 5.148 ( 3.428 -2.447 1.619) 4.512 5.166 ( 0.151 -4.939 1.032) 5.048 5.282 ( 3.858 -3.654 -1.072) 5.421 5.802 ( -16.366 -17.529 -6.169) 24.763 6.168 ( 2.036 -23.341 3.391) 23.674 8.170 ( -5.097 10.017 6.273) 12.871 8.492 ( 8.517 2.694 0.065) 8.933 8.610 ( -1.315 2.828 -1.989) 3.699 8.912 ( 10.967 -5.944 -6.158) 13.912 27.876 ( -2.021 54.527 -1.586) 54.587 27.918 ( 0.444 54.797 1.137) 54.811 28.398 ( -1.901 16.669 5.413) 17.629 28.503 ( 2.307 17.345 -5.339) 18.294 29.355 ( -3.274 -12.663 6.741) 14.714 29.497 ( 2.441 -12.893 -6.157) 14.495 31.412 ( -1.829 -59.496 -2.865) 59.593 31.421 ( -0.546 -58.437 2.853) 58.509 95.643 ( -1.977 16.265 2.479) 16.571 95.666 ( -1.673 16.462 -2.417) 16.723 96.459 ( -1.286 -12.091 1.385) 12.238 96.544 ( 2.605 -14.090 -1.776) 14.439 ======================= Grid point 455 (235/252) ======================= q-point: ( 0.20 0.38 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.402 ( 0.520 10.559 4.538) 11.504 2.636 ( -6.588 15.441 -5.577) 17.690 2.921 ( 0.206 6.257 -1.200) 6.374 3.032 ( -3.411 4.242 -0.929) 5.522 3.249 ( -0.657 10.445 5.603) 11.871 3.299 ( -2.537 -3.969 2.825) 5.492 3.563 ( -3.770 -1.536 2.512) 4.783 3.861 ( -6.569 -8.211 2.534) 10.817 4.206 ( -5.795 9.254 -1.858) 11.076 4.356 ( -3.579 5.069 -2.044) 6.533 4.477 ( 2.045 9.410 -3.763) 10.338 4.534 ( -0.370 8.534 0.580) 8.562 4.795 ( -3.536 -2.266 11.495) 12.238 5.020 ( 3.006 -1.386 -7.493) 8.192 5.123 ( 2.044 2.998 0.501) 3.663 5.183 ( 0.340 -5.104 1.961) 5.478 5.235 ( 4.122 -4.905 1.625) 6.610 5.317 ( -0.633 -4.717 0.617) 4.800 5.523 ( -7.624 -8.724 -4.382) 12.387 6.120 ( -7.969 -23.563 -0.689) 24.884 8.178 ( 0.685 10.310 7.422) 12.722 8.574 ( 2.113 1.185 0.731) 2.530 8.704 ( 10.128 3.451 -1.082) 10.755 9.037 ( 8.250 -5.773 -7.981) 12.849 27.828 ( -1.810 54.739 -1.347) 54.786 27.925 ( -0.832 54.654 1.455) 54.680 28.402 ( -1.908 16.611 5.322) 17.547 28.511 ( 2.585 17.462 -5.246) 18.415 29.341 ( -3.271 -12.927 6.418) 14.798 29.491 ( 1.946 -13.037 -6.635) 14.757 31.356 ( -2.040 -59.719 -2.442) 59.804 31.419 ( -1.794 -58.375 2.399) 58.452 95.580 ( -2.394 18.063 -3.588) 18.571 95.645 ( -3.229 16.259 4.093) 17.074 96.455 ( -0.311 -12.426 1.737) 12.551 96.575 ( 2.207 -15.932 -2.071) 16.217 ======================= Grid point 456 (236/252) ======================= q-point: ( 0.30 0.38 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.455 ( -0.287 10.318 -1.589) 10.444 2.517 ( -0.492 8.937 2.671) 9.341 2.804 ( -5.505 -6.058 -2.287) 8.499 3.126 ( 5.291 12.575 3.168) 14.006 3.207 ( -6.179 -4.783 1.396) 7.938 3.294 ( 0.804 8.460 0.510) 8.514 3.526 ( -3.855 -2.387 5.178) 6.883 3.740 ( -5.872 -3.688 -0.436) 6.948 4.100 ( -5.357 5.984 3.795) 8.883 4.260 ( -5.065 3.183 -3.362) 6.862 4.440 ( -2.285 11.992 -2.460) 12.453 4.538 ( -0.677 6.408 -1.655) 6.653 4.782 ( -5.769 -3.067 11.477) 13.207 5.014 ( 3.590 1.304 -10.857) 11.509 5.141 ( -1.936 -5.656 4.873) 7.712 5.221 ( -1.290 -7.977 8.368) 11.633 5.293 ( 1.578 -1.247 2.424) 3.150 5.330 ( 3.768 -3.078 -1.979) 5.252 5.454 ( 1.124 0.104 -5.575) 5.688 5.910 ( -10.715 -22.153 -6.965) 25.575 8.282 ( 3.734 9.986 8.883) 13.877 8.639 ( 4.735 4.112 -0.806) 6.322 8.861 ( 6.717 -0.451 0.431) 6.746 9.105 ( 5.725 -5.049 -8.105) 11.134 27.798 ( -0.795 55.012 -0.358) 55.019 27.908 ( -1.837 54.386 0.766) 54.423 28.404 ( -1.920 16.333 5.231) 17.258 28.521 ( 2.477 17.674 -5.357) 18.633 29.328 ( -3.066 -13.146 6.401) 14.940 29.477 ( 1.726 -13.268 -6.869) 15.040 31.311 ( -1.156 -59.844 -1.682) 59.878 31.392 ( -2.653 -58.386 1.625) 58.469 95.524 ( -1.251 19.042 -2.624) 19.263 95.600 ( -4.207 17.025 2.944) 17.783 96.471 ( 0.309 -13.617 2.405) 13.832 96.594 ( 1.510 -17.347 -2.330) 17.568 ======================= Grid point 457 (237/252) ======================= q-point: ( 0.40 0.38 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.438 ( 4.215 10.975 -5.553) 13.002 2.552 ( -3.518 0.716 5.700) 6.737 2.744 ( 0.103 -4.599 0.973) 4.702 3.058 ( -8.732 -5.772 -1.735) 10.610 3.212 ( 1.651 7.153 2.839) 7.871 3.337 ( 4.258 9.231 -3.377) 10.712 3.506 ( -2.319 -2.382 7.321) 8.041 3.661 ( -3.460 -1.004 0.775) 3.685 4.061 ( -2.954 4.006 3.891) 6.318 4.195 ( 1.549 1.121 -0.830) 2.085 4.359 ( -3.835 11.853 -2.912) 12.794 4.488 ( -4.469 6.438 0.994) 7.900 4.764 ( -4.484 -1.722 9.339) 10.502 5.001 ( 2.857 0.026 -10.312) 10.701 5.141 ( -3.639 -6.845 8.792) 11.722 5.233 ( -2.182 -7.245 8.020) 11.025 5.339 ( -0.272 -2.676 3.986) 4.808 5.391 ( 5.843 1.393 -6.365) 8.752 5.442 ( 0.987 -1.535 -4.042) 4.434 5.691 ( -5.162 -17.482 -11.563) 21.587 8.411 ( 2.658 9.856 9.940) 14.248 8.709 ( 4.233 5.042 -4.655) 8.063 8.946 ( 1.627 -1.512 3.123) 3.833 9.140 ( 4.333 -5.142 -7.824) 10.317 27.796 ( 0.590 55.065 0.426) 55.070 27.873 ( -2.070 54.401 -0.083) 54.440 28.406 ( -1.870 16.095 5.291) 17.045 28.524 ( 2.077 17.585 -5.568) 18.562 29.320 ( -2.834 -13.249 6.585) 15.064 29.461 ( 1.858 -13.436 -6.811) 15.178 31.295 ( 0.491 -59.800 -0.911) 59.809 31.349 ( -2.830 -58.491 0.861) 58.566 95.501 ( 0.525 19.305 -1.751) 19.391 95.542 ( -3.823 18.073 1.800) 18.561 96.497 ( 0.394 -15.076 2.973) 15.371 96.597 ( 0.767 -17.986 -2.701) 18.204 ======================= Grid point 458 (238/252) ======================= q-point: (-0.50 0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.452 ( -8.526 4.981 3.479) 10.469 2.539 ( 9.873 5.586 -5.405) 12.566 2.828 ( 6.955 -5.973 3.018) 9.652 2.891 ( -7.011 -4.493 -3.219) 8.928 3.246 ( -1.164 7.949 4.970) 9.447 3.345 ( -0.545 5.433 -5.014) 7.413 3.554 ( 0.974 -1.513 7.275) 7.495 3.614 ( -2.212 -2.410 0.733) 3.352 4.077 ( 2.487 4.794 4.527) 7.047 4.202 ( -0.100 3.465 -7.326) 8.105 4.368 ( 4.635 7.942 2.186) 9.452 4.388 ( -5.637 6.798 1.079) 8.897 4.753 ( -3.414 -2.936 9.838) 10.820 4.969 ( 2.596 -0.489 -10.535) 10.862 5.163 ( -1.704 -6.351 11.867) 13.567 5.269 ( 0.160 -5.455 5.567) 7.796 5.312 ( -3.865 1.669 -0.407) 4.230 5.425 ( 0.242 -3.752 1.687) 4.121 5.460 ( 5.380 -4.765 -7.376) 10.298 5.565 ( -0.326 -11.567 -12.048) 16.705 8.503 ( -0.752 9.391 10.739) 14.286 8.706 ( 0.778 6.587 -9.284) 11.410 8.980 ( -1.965 -2.446 7.249) 7.899 9.147 ( 2.798 -5.546 -9.038) 10.967 27.821 ( 0.922 54.856 0.892) 54.871 27.839 ( -0.563 54.706 -0.979) 54.718 28.410 ( -1.861 16.147 5.462) 17.147 28.519 ( 1.785 17.221 -5.617) 18.202 29.318 ( -2.618 -13.278 6.877) 15.181 29.450 ( 2.148 -13.483 -6.577) 15.154 31.307 ( -2.169 -58.717 0.444) 58.759 31.316 ( 2.161 -59.568 -0.468) 59.609 95.493 ( -2.553 18.892 1.297) 19.107 95.519 ( 2.596 18.944 -1.350) 19.168 96.522 ( -0.098 -16.281 3.210) 16.594 96.585 ( 0.271 -17.645 -3.142) 17.925 ======================= Grid point 459 (239/252) ======================= q-point: (-0.40 0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.349 ( -4.117 12.436 3.364) 13.525 2.679 ( 8.095 0.051 -7.136) 10.791 2.780 ( -2.246 -2.148 -2.601) 4.053 3.012 ( 10.037 -6.449 2.885) 12.274 3.230 ( -4.824 9.469 5.309) 11.879 3.281 ( -1.659 4.145 -2.495) 5.115 3.570 ( -0.847 -3.569 1.014) 3.806 3.636 ( 1.336 -4.379 4.017) 6.091 4.145 ( 2.624 4.556 -4.624) 7.002 4.212 ( 5.253 4.600 -1.399) 7.121 4.295 ( -1.385 11.653 2.332) 11.965 4.472 ( 1.645 9.449 2.188) 9.838 4.783 ( -2.087 -1.295 9.787) 10.091 4.965 ( 4.238 -0.407 -9.056) 10.006 5.209 ( -4.505 -5.932 8.456) 11.269 5.236 ( -0.442 0.811 1.023) 1.378 5.319 ( 0.316 -3.408 5.055) 6.105 5.434 ( -1.044 -5.604 0.004) 5.700 5.479 ( 2.729 -13.491 -14.329) 19.869 5.548 ( 8.123 -7.880 -0.247) 11.320 8.519 ( -5.413 8.291 7.566) 12.461 8.631 ( -1.333 8.037 -7.125) 10.823 8.969 ( -4.697 -2.225 6.838) 8.589 9.111 ( 0.067 -6.407 -9.001) 11.049 27.806 ( -0.794 55.168 -0.552) 55.177 27.874 ( 2.927 54.363 -0.164) 54.442 28.414 ( -2.024 16.466 5.531) 17.487 28.512 ( 1.801 16.971 -5.443) 17.913 29.322 ( -2.383 -13.248 7.262) 15.294 29.446 ( 2.395 -13.475 -6.267) 15.053 31.281 ( -0.907 -58.881 0.540) 58.891 31.363 ( 3.232 -59.345 -0.531) 59.436 95.470 ( -0.977 19.377 1.388) 19.452 95.575 ( 4.500 17.880 -1.511) 18.499 96.532 ( -1.075 -16.687 1.957) 16.836 96.568 ( 0.128 -16.545 -2.267) 16.700 ======================= Grid point 460 (240/252) ======================= q-point: (-0.30 0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.371 ( 3.695 17.831 3.748) 18.592 2.668 ( -1.155 1.005 -9.369) 9.494 2.788 ( 3.013 -2.644 -0.815) 4.091 3.132 ( -4.232 12.693 2.938) 13.699 3.221 ( 6.412 -3.292 0.420) 7.220 3.295 ( 3.918 2.142 -0.726) 4.524 3.581 ( 0.808 -6.674 0.105) 6.724 3.699 ( 4.265 -3.690 4.033) 6.933 4.200 ( 4.115 5.323 -5.719) 8.831 4.227 ( 3.731 6.449 -0.917) 7.507 4.378 ( 1.320 14.395 4.836) 15.243 4.482 ( -0.488 9.815 3.114) 10.309 4.788 ( -4.470 0.863 9.846) 10.847 4.996 ( 5.846 -0.528 -7.442) 9.478 5.154 ( -4.867 -5.440 3.483) 8.088 5.236 ( -2.968 0.067 3.069) 4.270 5.344 ( -1.266 -1.617 2.967) 3.609 5.365 ( -3.837 -5.742 -2.792) 7.449 5.472 ( 6.521 -13.408 -12.272) 19.310 5.803 ( 16.718 -17.129 3.457) 24.184 8.413 ( -7.258 8.476 -1.188) 11.222 8.580 ( -2.508 7.139 0.802) 7.609 8.905 ( -6.349 -1.977 2.729) 7.189 9.022 ( -4.101 -6.059 -5.068) 8.901 27.798 ( 0.249 55.323 -0.335) 55.324 27.925 ( 2.890 54.026 -0.936) 54.111 28.413 ( -2.311 16.722 5.390) 17.720 28.509 ( 1.950 17.099 -5.263) 17.996 29.333 ( -2.195 -13.106 7.652) 15.334 29.449 ( 2.605 -13.465 -5.890) 14.926 31.284 ( 0.533 -58.978 1.116) 58.991 31.418 ( 3.270 -59.127 -1.075) 59.227 95.478 ( 0.460 19.407 2.026) 19.518 95.654 ( 5.521 16.273 -2.473) 17.361 96.513 ( -1.076 -15.176 -0.837) 15.238 96.557 ( -0.847 -15.904 0.366) 15.931 ======================= Grid point 461 (241/252) ======================= q-point: (-0.20 0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.483 ( 3.012 13.494 -1.038) 13.865 2.596 ( 3.260 11.900 -4.214) 13.038 2.867 ( 4.123 -1.301 2.785) 5.143 3.054 ( -2.923 15.601 -0.777) 15.892 3.320 ( 3.691 2.663 -1.800) 4.894 3.356 ( 3.352 -1.730 -3.141) 4.909 3.587 ( 0.483 -3.240 0.331) 3.293 3.868 ( 10.358 -7.900 1.932) 13.170 4.165 ( -4.319 11.565 2.445) 12.585 4.339 ( 5.584 7.359 -1.280) 9.326 4.413 ( 1.706 6.051 2.905) 6.926 4.499 ( -1.857 11.354 4.829) 12.477 4.779 ( -3.548 0.429 8.984) 9.669 5.063 ( 6.252 -1.058 -7.506) 9.825 5.082 ( -5.101 -3.482 2.954) 6.846 5.190 ( -3.418 -2.656 1.789) 4.684 5.271 ( -3.489 -2.600 -2.926) 5.244 5.319 ( -3.638 -2.386 1.917) 4.755 5.556 ( 11.032 -15.546 -8.036) 20.687 6.114 ( 14.057 -19.964 0.100) 24.417 8.283 ( -5.118 9.032 -1.589) 10.502 8.552 ( -0.591 4.458 0.926) 4.592 8.756 ( -9.322 -1.586 -4.276) 10.378 8.918 ( -6.257 -3.971 2.475) 7.813 27.811 ( 1.115 55.189 0.415) 55.202 27.959 ( 1.896 54.018 -1.966) 54.087 28.406 ( -2.484 16.648 5.240) 17.629 28.508 ( 1.984 17.427 -5.306) 18.325 29.348 ( -2.216 -12.859 7.847) 15.226 29.458 ( 2.854 -13.377 -5.521) 14.750 31.313 ( 1.469 -58.931 1.903) 58.980 31.460 ( 2.372 -59.011 -1.847) 59.087 95.513 ( 1.380 18.959 3.048) 19.252 95.728 ( 4.838 14.618 -4.153) 15.948 96.490 ( -0.381 -13.188 -1.407) 13.268 96.538 ( -1.786 -14.975 1.245) 15.132 ======================= Grid point 462 (242/252) ======================= q-point: (-0.10 0.38 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.471 ( 2.093 11.821 -4.441) 12.800 2.664 ( -1.337 17.146 -0.340) 17.201 2.938 ( 5.161 18.603 0.468) 19.312 3.099 ( 5.636 -2.752 3.992) 7.434 3.301 ( -2.785 9.777 -4.888) 11.280 3.379 ( 1.539 -4.524 -3.480) 5.912 3.630 ( 3.597 -1.602 1.947) 4.392 4.006 ( 2.790 -10.474 -5.190) 12.017 4.132 ( -2.489 11.827 9.115) 15.138 4.367 ( -4.584 7.940 1.776) 9.339 4.448 ( 5.854 8.145 1.626) 10.161 4.548 ( 1.486 9.796 4.907) 11.057 4.787 ( -2.628 0.158 8.303) 8.711 5.008 ( -1.569 -3.161 -4.089) 5.401 5.108 ( 2.119 0.288 -3.160) 3.816 5.132 ( -4.058 -5.349 1.327) 6.844 5.216 ( -0.080 1.025 -3.010) 3.181 5.253 ( -4.537 -4.144 1.371) 6.296 5.760 ( 14.604 -19.235 -1.981) 24.232 6.252 ( 1.883 -20.753 -4.754) 21.374 8.226 ( -1.077 9.328 1.797) 9.560 8.539 ( -9.560 2.041 -5.391) 11.163 8.597 ( 5.668 0.693 -0.984) 5.794 8.816 ( -7.449 -3.372 3.284) 8.811 27.842 ( 1.514 54.986 1.388) 55.024 27.963 ( 0.314 54.208 -2.876) 54.285 28.399 ( -2.349 16.453 5.260) 17.432 28.506 ( 1.925 17.594 -5.444) 18.518 29.360 ( -2.523 -12.618 7.711) 15.001 29.474 ( 3.021 -13.160 -5.402) 14.543 31.358 ( 1.507 -58.781 2.598) 58.858 31.475 ( 0.884 -59.040 -2.550) 59.102 95.566 ( 1.473 18.064 4.238) 18.613 95.759 ( 2.248 13.937 -5.768) 15.250 96.485 ( 0.767 -12.244 -0.903) 12.301 96.512 ( -1.971 -13.575 1.148) 13.766 ======================= Grid point 463 (243/252) ======================= q-point: ( 0.00 0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.812 ( 6.226 13.532 2.580) 15.117 2.888 ( -5.834 15.638 -4.824) 17.374 3.048 ( 5.039 -10.258 4.582) 12.313 3.150 ( -3.699 -10.489 -5.631) 12.466 3.407 ( 0.357 11.568 0.656) 11.592 3.427 ( -1.981 9.682 -1.222) 9.958 3.646 ( 0.870 -4.917 2.398) 5.540 3.705 ( -5.394 -9.020 -3.509) 11.080 4.384 ( 3.680 5.401 4.009) 7.667 4.426 ( 1.385 1.185 -0.157) 1.829 4.703 ( 0.112 4.368 6.343) 7.702 4.743 ( 0.467 2.239 1.545) 2.760 4.794 ( -6.413 5.226 9.494) 12.592 4.897 ( -1.533 -4.215 2.992) 5.392 5.046 ( 1.142 -1.984 -2.205) 3.179 5.067 ( 1.554 -3.934 -2.322) 4.825 5.240 ( 4.506 11.692 -0.383) 12.536 5.331 ( -2.943 12.004 -7.097) 14.252 5.598 ( 8.109 -18.940 2.019) 20.701 5.710 ( -7.955 -20.540 -8.312) 23.543 8.396 ( -3.787 7.051 6.085) 10.054 8.472 ( -0.864 0.407 -0.357) 1.020 8.657 ( 0.855 -0.904 -2.801) 3.065 8.681 ( 4.926 -2.411 -3.979) 6.776 28.710 ( -2.546 15.931 5.798) 17.143 28.816 ( 2.916 19.134 -4.789) 19.939 28.877 ( -1.626 19.654 1.934) 19.816 28.919 ( 1.024 31.230 -2.616) 31.356 29.255 ( -2.122 24.488 2.652) 24.723 29.307 ( 2.375 9.454 -2.452) 10.052 30.242 ( 1.030 -59.766 2.545) 59.829 30.291 ( -1.070 -60.200 -2.442) 60.259 95.930 ( -0.142 15.111 3.514) 15.515 96.002 ( 0.069 13.022 -3.823) 13.571 96.223 ( -0.959 -13.420 2.218) 13.635 96.267 ( 1.019 -12.656 -2.268) 12.898 ======================= Grid point 464 (244/252) ======================= q-point: ( 0.10 0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.729 ( -7.182 14.885 -3.579) 16.910 2.928 ( 3.295 12.373 2.232) 12.997 2.987 ( -8.579 -11.346 -5.871) 15.388 3.130 ( 0.590 -7.603 3.315) 8.315 3.368 ( -3.556 12.367 0.833) 12.895 3.434 ( 0.806 10.497 2.458) 10.811 3.579 ( -6.148 -5.088 1.001) 8.043 3.684 ( -0.565 -10.995 4.827) 12.021 4.423 ( 0.471 4.038 -4.576) 6.121 4.447 ( 1.451 1.434 -1.037) 2.289 4.677 ( -5.818 5.770 -0.262) 8.198 4.734 ( -2.285 1.252 -0.411) 2.638 4.778 ( -3.939 6.711 12.821) 14.998 4.899 ( 0.129 -5.506 5.773) 7.979 5.086 ( 4.374 -0.836 -4.085) 6.043 5.095 ( 2.323 -1.789 -2.550) 3.886 5.260 ( 1.765 3.582 -4.972) 6.377 5.307 ( 0.758 12.904 1.395) 13.001 5.483 ( -8.187 -12.548 -6.428) 16.303 5.714 ( 1.049 -22.492 3.584) 22.800 8.349 ( -3.481 8.138 4.736) 10.039 8.473 ( -0.553 -4.274 2.737) 5.105 8.698 ( 7.338 5.531 -4.735) 10.337 8.803 ( 9.561 -5.334 -4.960) 12.020 28.704 ( -2.330 16.835 5.397) 17.832 28.831 ( 2.653 16.359 -5.856) 17.577 28.865 ( -1.350 22.338 2.276) 22.495 28.927 ( 1.473 33.148 -1.309) 33.207 29.219 ( -3.617 20.800 2.472) 21.257 29.321 ( 1.184 10.487 -2.882) 10.940 30.240 ( -2.340 -60.492 -2.093) 60.574 30.269 ( -0.266 -59.586 2.196) 59.627 95.940 ( -1.392 14.357 2.670) 14.669 95.971 ( -0.587 14.959 -2.619) 15.198 96.215 ( -1.386 -12.871 1.968) 13.094 96.268 ( 0.703 -14.403 -2.080) 14.569 ======================= Grid point 465 (245/252) ======================= q-point: ( 0.20 0.46 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.606 ( -4.680 10.333 0.301) 11.348 2.792 ( -8.383 -8.014 -3.288) 12.055 2.924 ( -4.253 11.743 -1.069) 12.535 3.128 ( -2.930 -7.746 1.927) 8.503 3.327 ( -2.038 11.380 2.845) 11.906 3.466 ( 1.031 9.704 1.443) 9.865 3.498 ( -4.133 -4.363 2.367) 6.459 3.681 ( -2.404 -10.358 2.125) 10.844 4.355 ( -6.669 5.783 -2.084) 9.070 4.412 ( -4.263 0.276 -1.929) 4.687 4.606 ( 0.065 4.532 -1.852) 4.897 4.664 ( -2.229 0.556 -0.550) 2.362 4.786 ( -5.891 5.574 14.894) 16.959 4.961 ( -1.341 -8.591 8.938) 12.470 5.085 ( 0.673 -0.404 -6.128) 6.178 5.133 ( 4.389 -3.872 -4.466) 7.363 5.275 ( -3.208 10.438 -0.100) 10.920 5.297 ( 3.982 2.646 -3.071) 5.682 5.412 ( 3.249 -2.082 -4.470) 5.905 5.670 ( -7.154 -21.857 0.682) 23.008 8.366 ( 1.510 8.927 5.532) 10.610 8.515 ( 2.909 -6.034 3.727) 7.666 8.813 ( 8.181 6.342 -4.870) 11.440 8.929 ( 8.205 -5.590 -6.207) 11.709 28.703 ( -1.875 17.635 5.361) 18.527 28.828 ( 1.657 18.549 -5.740) 19.487 28.859 ( -1.125 27.597 2.220) 27.709 28.952 ( 2.051 31.073 -1.313) 31.169 29.166 ( -4.050 14.839 2.813) 15.637 29.309 ( -0.057 10.499 -3.618) 11.105 30.180 ( -2.551 -60.824 -1.775) 60.903 30.266 ( -1.573 -59.649 1.861) 59.698 95.915 ( -1.560 16.195 -0.983) 16.300 95.949 ( -1.683 15.501 1.225) 15.640 96.203 ( -1.256 -13.581 1.675) 13.742 96.263 ( 0.247 -16.238 -1.726) 16.332 ======================= Grid point 466 (246/252) ======================= q-point: ( 0.30 0.46 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.563 ( -2.081 4.710 3.610) 6.289 2.657 ( -4.916 -3.977 -0.343) 6.332 2.808 ( -5.896 12.072 -1.859) 13.563 3.041 ( -6.878 -10.651 -0.279) 12.682 3.329 ( 0.116 8.263 1.885) 8.476 3.455 ( -2.226 -4.949 1.749) 5.701 3.491 ( 1.545 9.757 -1.060) 9.935 3.647 ( -1.401 -6.272 -0.808) 6.477 4.208 ( -7.559 5.024 2.049) 9.305 4.277 ( -7.760 -1.577 -1.080) 7.992 4.609 ( -1.193 5.325 2.888) 6.175 4.656 ( -1.636 2.584 1.260) 3.308 4.787 ( -4.932 5.052 13.753) 15.460 4.947 ( -6.365 -10.548 11.524) 16.869 5.095 ( 5.301 6.641 -13.191) 15.691 5.162 ( 0.803 0.078 -1.685) 1.868 5.215 ( -1.179 -1.741 4.331) 4.815 5.336 ( 0.301 -3.394 -5.601) 6.556 5.450 ( 3.633 -0.281 -5.389) 6.505 5.530 ( -3.217 -13.290 -4.763) 14.480 8.468 ( 4.254 9.068 6.950) 12.191 8.619 ( 4.700 -5.742 4.757) 8.815 8.909 ( 6.136 4.906 -5.460) 9.567 9.009 ( 5.733 -4.993 -6.895) 10.264 28.710 ( -1.717 16.988 5.723) 18.008 28.816 ( 1.249 21.531 -5.068) 22.155 28.856 ( -0.713 35.184 1.862) 35.240 28.974 ( 1.489 29.860 -2.264) 29.983 29.121 ( -3.289 8.638 3.701) 9.957 29.272 ( -0.670 8.156 -4.419) 9.301 30.132 ( -1.528 -61.128 -0.955) 61.155 30.239 ( -2.489 -59.753 1.022) 59.814 95.883 ( -0.916 17.742 -1.306) 17.813 95.921 ( -2.444 16.402 1.467) 16.648 96.196 ( -0.862 -14.849 1.672) 14.967 96.253 ( 0.024 -17.672 -1.532) 17.739 ======================= Grid point 467 (247/252) ======================= q-point: ( 0.40 0.46 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.558 ( -1.928 2.442 4.224) 5.246 2.608 ( -0.816 -0.969 0.609) 1.405 2.720 ( -2.169 7.499 -0.931) 7.862 2.904 ( -6.337 -9.280 -2.383) 11.487 3.355 ( 1.627 6.365 0.890) 6.629 3.449 ( 0.151 -3.484 2.271) 4.162 3.501 ( 0.618 7.226 -2.496) 7.670 3.613 ( -1.822 -4.127 -1.499) 4.754 4.136 ( -2.879 3.396 3.726) 5.806 4.186 ( -1.387 -1.678 2.426) 3.260 4.551 ( -6.977 6.984 0.480) 9.884 4.593 ( -5.871 3.197 2.456) 7.122 4.782 ( -5.675 3.631 11.343) 13.193 4.925 ( -5.237 -10.378 12.698) 17.216 5.060 ( 2.542 5.852 -11.560) 13.204 5.200 ( -0.266 0.964 5.073) 5.171 5.248 ( 0.823 -7.881 0.844) 7.969 5.274 ( 4.037 -8.857 -8.446) 12.887 5.465 ( 1.899 1.841 -6.944) 7.430 5.498 ( 1.702 -2.555 -6.306) 7.014 8.593 ( 3.190 8.707 7.878) 12.168 8.729 ( 3.299 -4.136 4.376) 6.866 8.954 ( 3.036 3.402 -5.426) 7.088 9.043 ( 3.458 -4.932 -7.137) 9.339 28.716 ( -2.241 15.993 5.848) 17.175 28.807 ( 1.553 23.727 -4.520) 24.204 28.864 ( 0.366 39.326 1.780) 39.368 28.970 ( 0.065 31.909 -2.769) 32.029 29.101 ( -1.965 6.914 4.207) 8.328 29.229 ( -0.249 2.462 -4.952) 5.536 30.116 ( 0.310 -61.158 -0.086) 61.159 30.195 ( -2.738 -59.919 0.160) 59.982 95.866 ( -0.273 17.956 -0.449) 17.963 95.886 ( -1.875 17.781 0.470) 17.886 96.195 ( -0.602 -15.988 1.947) 16.118 96.244 ( 0.203 -18.362 -1.710) 18.443 ======================= Grid point 468 (248/252) ======================= q-point: (-0.50 0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.552 ( -1.569 5.247 3.801) 6.666 2.623 ( 3.203 0.724 -2.629) 4.206 2.734 ( 3.504 -1.217 1.624) 4.049 2.797 ( -2.744 -4.929 -3.945) 6.884 3.391 ( 0.670 6.408 2.614) 6.953 3.443 ( -2.527 3.743 -2.644) 5.233 3.509 ( 0.938 -2.298 4.008) 4.714 3.554 ( -3.748 -3.900 -0.714) 5.456 4.169 ( 3.541 4.353 3.486) 6.606 4.226 ( 2.578 -1.006 -1.719) 3.257 4.472 ( 0.749 2.795 0.708) 2.979 4.485 ( -4.394 2.235 0.278) 4.938 4.764 ( -5.136 4.950 12.950) 14.785 4.931 ( -4.242 -10.425 12.914) 17.130 5.043 ( 3.814 5.378 -10.143) 12.097 5.212 ( 2.539 -8.147 -5.487) 10.146 5.288 ( 3.049 -2.278 -1.569) 4.116 5.319 ( -0.064 -2.400 5.329) 5.844 5.415 ( -1.426 2.687 -6.580) 7.249 5.472 ( 0.356 -2.735 -7.255) 7.762 8.677 ( -0.427 8.099 8.131) 11.484 8.782 ( 0.158 -0.900 0.824) 1.230 8.951 ( -0.079 1.471 -2.372) 2.793 9.034 ( 1.282 -5.705 -7.539) 9.541 28.712 ( -2.528 16.924 5.527) 17.982 28.811 ( 2.364 24.011 -4.353) 24.517 28.891 ( 0.578 33.377 2.348) 33.464 28.942 ( -0.556 39.441 -3.086) 39.566 29.105 ( -1.017 10.547 4.514) 11.517 29.200 ( 0.976 -4.023 -5.056) 6.534 30.139 ( 1.276 -60.897 0.559) 60.913 30.149 ( -1.333 -60.235 -0.457) 60.251 95.851 ( -1.673 17.964 1.497) 18.103 95.881 ( 1.664 18.257 -1.502) 18.395 96.198 ( -0.745 -17.025 2.141) 17.175 96.239 ( 0.828 -17.937 -2.034) 18.071 ======================= Grid point 469 (249/252) ======================= q-point: (-0.40 0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.574 ( 2.059 9.651 2.089) 10.087 2.670 ( 3.980 -1.286 -5.466) 6.883 2.757 ( 1.736 0.771 -4.063) 4.485 2.857 ( 8.076 -8.373 2.198) 11.839 3.366 ( -3.404 5.406 -0.490) 6.407 3.413 ( -0.739 6.564 4.335) 7.900 3.482 ( -3.536 -3.835 0.790) 5.276 3.554 ( 0.361 -5.081 4.655) 6.901 4.223 ( 2.803 3.196 -4.871) 6.465 4.256 ( 3.599 0.113 -4.180) 5.517 4.506 ( 6.575 9.324 4.055) 12.108 4.601 ( 6.776 1.577 1.713) 7.165 4.780 ( -3.180 3.422 13.549) 14.332 4.948 ( -3.026 -9.376 10.856) 14.660 5.053 ( 4.381 2.520 -8.082) 9.532 5.215 ( 4.817 -11.034 -12.589) 17.419 5.285 ( -3.484 2.994 0.064) 4.594 5.326 ( -1.560 -0.345 3.820) 4.141 5.367 ( -1.498 -0.568 -0.570) 1.701 5.430 ( 1.337 -5.214 -4.811) 7.220 8.679 ( -4.958 7.461 5.115) 10.315 8.747 ( -2.680 2.285 -2.294) 4.203 8.925 ( -2.727 -0.896 1.823) 3.400 8.985 ( -1.025 -5.934 -6.653) 8.974 28.706 ( -2.254 17.613 5.472) 18.581 28.827 ( 2.749 19.414 -5.094) 20.259 28.894 ( -1.000 39.300 -0.179) 39.313 28.928 ( 0.250 31.897 0.225) 31.898 29.132 ( 0.546 17.553 4.541) 18.139 29.193 ( 1.865 -5.386 -4.649) 7.355 30.117 ( -0.869 -60.571 -0.112) 60.578 30.194 ( 3.183 -60.623 0.249) 60.707 95.839 ( -0.709 18.652 1.517) 18.728 95.913 ( 2.925 16.982 -1.515) 17.298 96.198 ( -0.772 -17.645 1.759) 17.750 96.245 ( 1.255 -16.702 -1.886) 16.855 ======================= Grid point 470 (250/252) ======================= q-point: (-0.30 0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.640 ( 3.577 6.319 -2.259) 7.605 2.683 ( 2.973 -0.122 -4.557) 5.443 2.804 ( 5.661 8.372 -1.838) 10.272 3.034 ( 9.462 -11.810 0.409) 15.138 3.339 ( 0.108 7.217 0.851) 7.267 3.435 ( -0.540 9.260 4.469) 10.296 3.461 ( 1.226 -5.823 1.317) 6.095 3.598 ( 1.611 -6.887 4.244) 8.248 4.274 ( 5.922 2.751 -4.148) 7.736 4.297 ( 4.947 0.783 -3.350) 6.026 4.633 ( -3.267 8.660 1.002) 9.310 4.660 ( 4.088 7.591 1.583) 8.766 4.816 ( -3.871 3.287 12.314) 13.320 4.972 ( -2.951 -7.775 10.432) 13.341 5.069 ( 4.077 3.108 -10.584) 11.760 5.214 ( 5.048 -9.467 -12.557) 16.516 5.252 ( -1.960 0.788 3.738) 4.294 5.294 ( -2.598 -3.228 -0.167) 4.146 5.353 ( -0.046 2.774 1.704) 3.256 5.501 ( 10.096 -12.722 -1.621) 16.322 8.576 ( -6.812 7.826 -1.265) 10.452 8.669 ( -5.033 0.192 -0.378) 5.051 8.865 ( -4.744 -0.501 0.107) 4.771 8.916 ( -3.467 -4.548 -1.073) 5.818 28.707 ( -2.030 17.332 5.736) 18.369 28.823 ( 0.951 19.419 -5.444) 20.190 28.892 ( 1.573 45.828 -1.663) 45.885 28.930 ( -1.069 16.652 2.033) 16.810 29.184 ( 2.001 19.100 2.844) 19.414 29.201 ( 2.009 2.156 -2.818) 4.078 30.117 ( 0.759 -60.684 0.529) 60.691 30.253 ( 3.168 -60.424 -0.365) 60.508 95.847 ( 0.193 18.643 1.871) 18.737 95.960 ( 3.385 15.354 -2.008) 15.851 96.198 ( -0.413 -17.345 1.490) 17.414 96.255 ( 1.173 -15.202 -1.722) 15.344 ======================= Grid point 471 (251/252) ======================= q-point: (-0.20 0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 456 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.650 ( 2.227 6.609 -4.057) 8.068 2.761 ( 6.348 -4.148 -0.085) 7.584 2.916 ( 6.145 14.089 -0.375) 15.376 3.168 ( 5.292 -10.561 -2.116) 12.001 3.362 ( 1.923 11.327 -0.217) 11.491 3.460 ( 0.629 4.742 1.598) 5.043 3.526 ( 4.467 -0.754 0.083) 4.531 3.688 ( 5.815 -10.504 1.591) 12.111 4.332 ( 0.908 5.680 -0.102) 5.753 4.392 ( 4.787 -0.509 -0.024) 4.814 4.566 ( -2.417 7.861 2.054) 8.477 4.657 ( -1.883 1.165 0.549) 2.281 4.820 ( -5.283 5.522 12.891) 14.986 4.963 ( -5.951 -7.521 9.564) 13.544 5.088 ( 7.134 4.327 -12.686) 15.184 5.181 ( -4.592 -0.203 -1.373) 4.798 5.224 ( -3.031 -2.642 1.445) 4.273 5.286 ( 4.114 -9.306 -3.738) 10.839 5.398 ( 5.238 10.606 -2.697) 12.132 5.716 ( 12.208 -20.031 -2.967) 23.645 8.451 ( -5.006 7.939 -1.591) 9.519 8.571 ( -4.507 -3.468 -1.116) 5.795 8.763 ( -5.863 2.976 -0.862) 6.631 8.839 ( -5.375 -4.146 1.617) 6.979 28.711 ( -2.116 16.590 6.034) 17.780 28.803 ( 1.091 23.743 -4.666) 24.222 28.907 ( 0.913 36.221 -1.849) 36.280 28.922 ( -0.744 15.293 1.019) 15.345 29.222 ( 2.749 1.142 -2.659) 3.992 29.239 ( 1.397 27.343 3.004) 27.543 30.149 ( 1.866 -60.439 1.389) 60.483 30.297 ( 2.197 -60.278 -1.238) 60.331 95.870 ( 0.665 17.887 2.425) 18.063 96.000 ( 2.767 13.540 -2.845) 14.110 96.205 ( -0.003 -16.259 1.612) 16.339 96.262 ( 0.908 -13.480 -1.735) 13.621 ======================= Grid point 472 (252/252) ======================= q-point: (-0.10 0.46 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 455 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.698 ( 4.928 11.290 -0.374) 12.324 2.899 ( 7.188 -9.205 3.133) 12.092 2.973 ( 0.315 14.372 -2.201) 14.543 3.201 ( 1.120 -7.750 -3.827) 8.716 3.393 ( 1.737 12.074 -1.353) 12.273 3.462 ( -0.806 5.647 -0.750) 5.753 3.603 ( 3.888 0.477 -1.250) 4.112 3.775 ( 2.500 -12.895 -4.102) 13.761 4.320 ( -1.685 7.290 5.609) 9.351 4.408 ( -1.731 -1.686 2.605) 3.553 4.625 ( 4.423 7.319 4.601) 9.711 4.693 ( 2.338 2.402 3.913) 5.153 4.816 ( -4.097 3.490 10.504) 11.803 4.915 ( -4.040 -5.323 4.568) 8.095 5.081 ( -4.167 -0.142 -0.990) 4.285 5.107 ( 0.494 -1.805 -7.134) 7.375 5.181 ( 0.200 3.990 1.272) 4.192 5.371 ( 5.747 -4.756 -4.703) 8.819 5.461 ( 5.226 5.086 -4.197) 8.414 5.824 ( 2.277 -22.315 -6.509) 23.356 8.394 ( -1.180 7.592 1.422) 7.813 8.510 ( -1.862 -4.287 -0.264) 4.682 8.660 ( -3.207 4.550 -2.214) 5.991 8.744 ( -5.577 -4.026 0.355) 6.887 28.713 ( -2.394 15.911 6.099) 17.207 28.801 ( 2.103 22.811 -4.333) 23.314 28.896 ( -1.606 19.620 1.491) 19.742 28.921 ( 1.087 28.633 -2.965) 28.806 29.254 ( 0.904 16.869 0.981) 16.921 29.277 ( 1.889 16.206 -0.445) 16.322 30.197 ( 1.931 -60.038 2.132) 60.107 30.311 ( 0.608 -60.189 -2.015) 60.226 95.902 ( 0.572 16.556 3.041) 16.843 96.016 ( 1.374 12.362 -3.573) 12.941 96.217 ( -0.134 -14.774 1.968) 14.905 96.264 ( 0.860 -12.224 -1.985) 12.414 =================== 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 3/32760 10.0 211.470 310.715 200.461 0.000 22.128 0.000 3/32760 20.0 77.979 98.135 73.786 0.000 3.332 0.000 3/32760 30.0 33.533 40.847 31.688 0.000 0.771 0.000 3/32760 40.0 18.844 23.130 18.601 0.000 0.031 0.000 3/32760 50.0 12.644 15.764 12.967 0.000 -0.205 0.000 3/32760 60.0 9.395 11.895 9.897 0.000 -0.272 0.000 3/32760 70.0 7.435 9.541 7.975 0.000 -0.281 0.000 3/32760 80.0 6.140 7.967 6.667 0.000 -0.270 0.000 3/32760 90.0 5.227 6.845 5.725 0.000 -0.252 0.000 3/32760 100.0 4.552 6.007 5.017 0.000 -0.234 0.000 3/32760 110.0 4.034 5.357 4.466 0.000 -0.217 0.000 3/32760 120.0 3.624 4.839 4.027 0.000 -0.202 0.000 3/32760 130.0 3.292 4.417 3.668 0.000 -0.188 0.000 3/32760 140.0 3.017 4.066 3.369 0.000 -0.176 0.000 3/32760 150.0 2.786 3.770 3.116 0.000 -0.165 0.000 3/32760 160.0 2.589 3.518 2.899 0.000 -0.155 0.000 3/32760 170.0 2.419 3.301 2.711 0.000 -0.147 0.000 3/32760 180.0 2.270 3.112 2.547 0.000 -0.139 0.000 3/32760 190.0 2.138 2.946 2.401 0.000 -0.132 0.000 3/32760 200.0 2.022 2.800 2.272 0.000 -0.125 0.000 3/32760 210.0 1.917 2.670 2.156 0.000 -0.119 0.000 3/32760 220.0 1.823 2.554 2.051 0.000 -0.114 0.000 3/32760 230.0 1.738 2.450 1.956 0.000 -0.109 0.000 3/32760 240.0 1.661 2.356 1.870 0.000 -0.105 0.000 3/32760 250.0 1.590 2.270 1.790 0.000 -0.100 0.000 3/32760 260.0 1.525 2.192 1.718 0.000 -0.097 0.000 3/32760 270.0 1.465 2.121 1.651 0.000 -0.093 0.000 3/32760 280.0 1.410 2.055 1.589 0.000 -0.090 0.000 3/32760 290.0 1.358 1.995 1.532 0.000 -0.087 0.000 3/32760 300.0 1.311 1.938 1.478 0.000 -0.084 0.000 3/32760 310.0 1.266 1.886 1.428 0.000 -0.081 0.000 3/32760 320.0 1.225 1.837 1.382 0.000 -0.078 0.000 3/32760 330.0 1.186 1.791 1.338 0.000 -0.076 0.000 3/32760 340.0 1.149 1.748 1.297 0.000 -0.074 0.000 3/32760 350.0 1.115 1.707 1.259 0.000 -0.072 0.000 3/32760 360.0 1.083 1.669 1.223 0.000 -0.070 0.000 3/32760 370.0 1.052 1.633 1.188 0.000 -0.068 0.000 3/32760 380.0 1.023 1.598 1.156 0.000 -0.066 0.000 3/32760 390.0 0.996 1.565 1.126 0.000 -0.064 0.000 3/32760 400.0 0.970 1.534 1.096 0.000 -0.063 0.000 3/32760 410.0 0.946 1.504 1.069 0.000 -0.061 0.000 3/32760 420.0 0.922 1.475 1.043 0.000 -0.060 0.000 3/32760 430.0 0.900 1.448 1.018 0.000 -0.058 0.000 3/32760 440.0 0.879 1.421 0.994 0.000 -0.057 0.000 3/32760 450.0 0.859 1.396 0.971 0.000 -0.056 0.000 3/32760 460.0 0.840 1.372 0.950 0.000 -0.055 0.000 3/32760 470.0 0.821 1.348 0.929 0.000 -0.054 0.000 3/32760 480.0 0.804 1.326 0.909 0.000 -0.052 0.000 3/32760 490.0 0.787 1.304 0.890 0.000 -0.051 0.000 3/32760 500.0 0.771 1.283 0.872 0.000 -0.050 0.000 3/32760 510.0 0.755 1.263 0.855 0.000 -0.049 0.000 3/32760 520.0 0.740 1.243 0.838 0.000 -0.048 0.000 3/32760 530.0 0.726 1.224 0.822 0.000 -0.047 0.000 3/32760 540.0 0.712 1.206 0.806 0.000 -0.047 0.000 3/32760 550.0 0.699 1.188 0.791 0.000 -0.046 0.000 3/32760 560.0 0.686 1.171 0.777 0.000 -0.045 0.000 3/32760 570.0 0.674 1.154 0.763 0.000 -0.044 0.000 3/32760 580.0 0.662 1.138 0.750 0.000 -0.043 0.000 3/32760 590.0 0.651 1.122 0.737 0.000 -0.043 0.000 3/32760 600.0 0.640 1.107 0.724 0.000 -0.042 0.000 3/32760 610.0 0.629 1.092 0.712 0.000 -0.041 0.000 3/32760 620.0 0.619 1.077 0.701 0.000 -0.041 0.000 3/32760 630.0 0.609 1.063 0.689 0.000 -0.040 0.000 3/32760 640.0 0.599 1.050 0.678 0.000 -0.039 0.000 3/32760 650.0 0.590 1.037 0.668 0.000 -0.039 0.000 3/32760 660.0 0.580 1.024 0.658 0.000 -0.038 0.000 3/32760 670.0 0.572 1.011 0.648 0.000 -0.038 0.000 3/32760 680.0 0.563 0.999 0.638 0.000 -0.037 0.000 3/32760 690.0 0.555 0.987 0.629 0.000 -0.037 0.000 3/32760 700.0 0.547 0.976 0.620 0.000 -0.036 0.000 3/32760 710.0 0.539 0.964 0.611 0.000 -0.036 0.000 3/32760 720.0 0.532 0.953 0.602 0.000 -0.035 0.000 3/32760 730.0 0.524 0.943 0.594 0.000 -0.035 0.000 3/32760 740.0 0.517 0.932 0.586 0.000 -0.034 0.000 3/32760 750.0 0.510 0.922 0.578 0.000 -0.034 0.000 3/32760 760.0 0.503 0.912 0.571 0.000 -0.033 0.000 3/32760 770.0 0.497 0.902 0.563 0.000 -0.033 0.000 3/32760 780.0 0.490 0.893 0.556 0.000 -0.032 0.000 3/32760 790.0 0.484 0.884 0.549 0.000 -0.032 0.000 3/32760 800.0 0.478 0.875 0.542 0.000 -0.032 0.000 3/32760 810.0 0.472 0.866 0.535 0.000 -0.031 0.000 3/32760 820.0 0.466 0.857 0.529 0.000 -0.031 0.000 3/32760 830.0 0.461 0.849 0.522 0.000 -0.030 0.000 3/32760 840.0 0.455 0.841 0.516 0.000 -0.030 0.000 3/32760 850.0 0.450 0.833 0.510 0.000 -0.030 0.000 3/32760 860.0 0.445 0.825 0.504 0.000 -0.029 0.000 3/32760 870.0 0.439 0.817 0.498 0.000 -0.029 0.000 3/32760 880.0 0.434 0.810 0.493 0.000 -0.029 0.000 3/32760 890.0 0.430 0.802 0.487 0.000 -0.028 0.000 3/32760 900.0 0.425 0.795 0.482 0.000 -0.028 0.000 3/32760 910.0 0.420 0.788 0.476 0.000 -0.028 0.000 3/32760 920.0 0.416 0.781 0.471 0.000 -0.028 0.000 3/32760 930.0 0.411 0.774 0.466 0.000 -0.027 0.000 3/32760 940.0 0.407 0.768 0.461 0.000 -0.027 0.000 3/32760 950.0 0.402 0.761 0.456 0.000 -0.027 0.000 3/32760 960.0 0.398 0.755 0.452 0.000 -0.026 0.000 3/32760 970.0 0.394 0.749 0.447 0.000 -0.026 0.000 3/32760 980.0 0.390 0.743 0.442 0.000 -0.026 0.000 3/32760 990.0 0.386 0.737 0.438 0.000 -0.026 0.000 3/32760 1000.0 0.382 0.731 0.434 0.000 -0.025 0.000 3/32760 Thermal conductivity related properties were written into "kappa-m10137.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 21:05:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|