----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 23:56:34]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) Number of symmetry operations in supercell: 72 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.366226530778581 1.366141524508645 4.970316156666660 b -2.366226530778576 1.366141524508645 4.970316156666660 c 0.000000000000003 -2.732283049017294 4.970316156666660 Atomic positions (fractional): *1 B 0.75220231762795 0.75220231762795 0.75220231762795 10.811 2 B 0.24779768237205 0.24779768237205 0.24779768237205 10.811 *3 O 0.04421578875604 0.75026149685673 0.45991955448120 15.999 4 O 0.45991955448120 0.04421578875604 0.75026149685673 15.999 5 O 0.24973850314327 0.54008044551880 0.95578421124396 15.999 6 O 0.95578421124396 0.24973850314327 0.54008044551880 15.999 7 O 0.54008044551880 0.95578421124397 0.24973850314327 15.999 8 O 0.75026149685673 0.45991955448120 0.04421578875604 15.999 *9 Mg 0.00000000000000 0.00000000000000 0.00000000000000 24.305 *10 Sn 0.50000000000000 0.50000000000000 0.50000000000000 118.710 -------------------------------- unit cell --------------------------------- Lattice vectors: a 4.732453061557157 0.000000000000000 0.000000000000000 b -2.366226530778579 4.098424573525939 0.000000000000000 c 0.000000000000000 0.000000000000000 14.910948469999997 Atomic positions (fractional): *1 B 0.00000000000000 0.00000000000000 0.75220231762795 10.811 > 1 2 B 0.33333333333333 0.66666666666667 0.91446434903872 10.811 > 2 3 B 0.66666666666667 0.33333333333333 0.08553565096128 10.811 > 1 4 B 0.00000000000000 0.00000000000000 0.24779768237205 10.811 > 2 5 B 0.33333333333333 0.66666666666667 0.41886898429461 10.811 > 1 6 B 0.66666666666667 0.33333333333333 0.58113101570539 10.811 > 2 *7 O 0.29275017539138 0.29154605888345 0.75146561336466 15.999 > 3 8 O 0.70845394111655 0.00120411650793 0.75146561336466 15.999 > 4 9 O 0.33453744984126 0.95941684205805 0.91520105330201 15.999 > 5 10 O 0.04058315794195 0.37512060778321 0.91520105330201 15.999 > 6 11 O 0.62487939221679 0.66546255015874 0.91520105330201 15.999 > 7 12 O 0.99879588349208 0.70724982460862 0.75146561336466 15.999 > 8 13 O 0.95941684205805 0.62487939221679 0.08479894669799 15.999 > 3 14 O 0.37512060778321 0.33453744984126 0.08479894669799 15.999 > 4 15 O 0.00120411650793 0.29275017539138 0.24853438663534 15.999 > 5 16 O 0.70724982460862 0.70845394111655 0.24853438663534 15.999 > 6 17 O 0.29154605888345 0.99879588349208 0.24853438663534 15.999 > 7 18 O 0.66546255015874 0.04058315794195 0.08479894669799 15.999 > 8 19 O 0.62608350872471 0.95821272555012 0.41813228003132 15.999 > 3 20 O 0.04178727444988 0.66787078317459 0.41813228003132 15.999 > 4 21 O 0.66787078317459 0.62608350872471 0.58186771996868 15.999 > 5 22 O 0.37391649127529 0.04178727444988 0.58186771996868 15.999 > 6 23 O 0.95821272555012 0.33212921682541 0.58186771996868 15.999 > 7 24 O 0.33212921682541 0.37391649127529 0.41813228003132 15.999 > 8 *25 Mg 0.00000000000000 0.00000000000000 0.00000000000000 24.305 > 9 26 Mg 0.66666666666667 0.33333333333333 0.33333333333333 24.305 > 9 27 Mg 0.33333333333333 0.66666666666667 0.66666666666667 24.305 > 9 *28 Sn 0.66666666666667 0.33333333333333 0.83333333333333 118.710 > 10 29 Sn 0.33333333333333 0.66666666666667 0.16666666666667 118.710 > 10 30 Sn 0.00000000000000 0.00000000000000 0.50000000000000 118.710 > 10 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.464906123114314 0.000000000000000 0.000000000000000 b -4.732453061557158 8.196849147051879 0.000000000000000 c 0.000000000000000 0.000000000000000 14.910948469999997 Atomic positions (fractional): *1 B 0.00000000000000 0.00000000000000 0.75220231762795 10.811 > 1 2 B 0.50000000000000 0.00000000000000 0.75220231762795 10.811 > 1 3 B 0.00000000000000 0.50000000000000 0.75220231762795 10.811 > 1 4 B 0.50000000000000 0.50000000000000 0.75220231762795 10.811 > 1 5 B 0.16666666666667 0.33333333333333 0.91446434903872 10.811 > 2 6 B 0.66666666666667 0.33333333333333 0.91446434903872 10.811 > 2 7 B 0.16666666666667 0.83333333333333 0.91446434903872 10.811 > 2 8 B 0.66666666666667 0.83333333333333 0.91446434903872 10.811 > 2 9 B 0.33333333333333 0.16666666666667 0.08553565096128 10.811 > 1 10 B 0.83333333333333 0.16666666666667 0.08553565096128 10.811 > 1 11 B 0.33333333333333 0.66666666666667 0.08553565096128 10.811 > 1 12 B 0.83333333333333 0.66666666666667 0.08553565096128 10.811 > 1 13 B 0.00000000000000 0.00000000000000 0.24779768237205 10.811 > 2 14 B 0.50000000000000 0.00000000000000 0.24779768237205 10.811 > 2 15 B 0.00000000000000 0.50000000000000 0.24779768237205 10.811 > 2 16 B 0.50000000000000 0.50000000000000 0.24779768237205 10.811 > 2 17 B 0.16666666666667 0.33333333333333 0.41886898429461 10.811 > 1 18 B 0.66666666666667 0.33333333333333 0.41886898429461 10.811 > 1 19 B 0.16666666666667 0.83333333333333 0.41886898429461 10.811 > 1 20 B 0.66666666666667 0.83333333333333 0.41886898429461 10.811 > 1 21 B 0.33333333333333 0.16666666666667 0.58113101570539 10.811 > 2 22 B 0.83333333333333 0.16666666666667 0.58113101570539 10.811 > 2 23 B 0.33333333333333 0.66666666666667 0.58113101570539 10.811 > 2 24 B 0.83333333333333 0.66666666666667 0.58113101570539 10.811 > 2 *25 O 0.14637508769569 0.14577302944173 0.75146561336466 15.999 > 3 26 O 0.64637508769569 0.14577302944173 0.75146561336466 15.999 > 3 27 O 0.14637508769569 0.64577302944173 0.75146561336466 15.999 > 3 28 O 0.64637508769569 0.64577302944173 0.75146561336466 15.999 > 3 29 O 0.35422697055827 0.00060205825396 0.75146561336466 15.999 > 4 30 O 0.85422697055827 0.00060205825396 0.75146561336466 15.999 > 4 31 O 0.35422697055827 0.50060205825396 0.75146561336466 15.999 > 4 32 O 0.85422697055827 0.50060205825396 0.75146561336466 15.999 > 4 33 O 0.16726872492063 0.47970842102902 0.91520105330201 15.999 > 5 34 O 0.66726872492063 0.47970842102902 0.91520105330201 15.999 > 5 35 O 0.16726872492063 0.97970842102902 0.91520105330201 15.999 > 5 36 O 0.66726872492063 0.97970842102902 0.91520105330201 15.999 > 5 37 O 0.02029157897098 0.18756030389161 0.91520105330201 15.999 > 6 38 O 0.52029157897098 0.18756030389161 0.91520105330201 15.999 > 6 39 O 0.02029157897098 0.68756030389161 0.91520105330201 15.999 > 6 40 O 0.52029157897098 0.68756030389161 0.91520105330201 15.999 > 6 41 O 0.31243969610839 0.33273127507937 0.91520105330201 15.999 > 7 42 O 0.81243969610839 0.33273127507937 0.91520105330201 15.999 > 7 43 O 0.31243969610839 0.83273127507937 0.91520105330201 15.999 > 7 44 O 0.81243969610839 0.83273127507937 0.91520105330201 15.999 > 7 45 O 0.49939794174604 0.35362491230431 0.75146561336466 15.999 > 8 46 O 0.99939794174604 0.35362491230431 0.75146561336466 15.999 > 8 47 O 0.49939794174604 0.85362491230431 0.75146561336466 15.999 > 8 48 O 0.99939794174604 0.85362491230431 0.75146561336466 15.999 > 8 49 O 0.47970842102902 0.31243969610839 0.08479894669799 15.999 > 3 50 O 0.97970842102902 0.31243969610839 0.08479894669799 15.999 > 3 51 O 0.47970842102902 0.81243969610839 0.08479894669799 15.999 > 3 52 O 0.97970842102902 0.81243969610839 0.08479894669799 15.999 > 3 53 O 0.18756030389161 0.16726872492063 0.08479894669799 15.999 > 4 54 O 0.68756030389161 0.16726872492063 0.08479894669799 15.999 > 4 55 O 0.18756030389161 0.66726872492063 0.08479894669799 15.999 > 4 56 O 0.68756030389161 0.66726872492063 0.08479894669799 15.999 > 4 57 O 0.00060205825396 0.14637508769569 0.24853438663534 15.999 > 5 58 O 0.50060205825396 0.14637508769569 0.24853438663534 15.999 > 5 59 O 0.00060205825396 0.64637508769569 0.24853438663534 15.999 > 5 60 O 0.50060205825396 0.64637508769569 0.24853438663534 15.999 > 5 61 O 0.35362491230431 0.35422697055827 0.24853438663534 15.999 > 6 62 O 0.85362491230431 0.35422697055827 0.24853438663534 15.999 > 6 63 O 0.35362491230431 0.85422697055827 0.24853438663534 15.999 > 6 64 O 0.85362491230431 0.85422697055827 0.24853438663534 15.999 > 6 65 O 0.14577302944173 0.49939794174604 0.24853438663534 15.999 > 7 66 O 0.64577302944173 0.49939794174604 0.24853438663534 15.999 > 7 67 O 0.14577302944173 0.99939794174604 0.24853438663534 15.999 > 7 68 O 0.64577302944173 0.99939794174604 0.24853438663534 15.999 > 7 69 O 0.33273127507937 0.02029157897098 0.08479894669799 15.999 > 8 70 O 0.83273127507937 0.02029157897098 0.08479894669799 15.999 > 8 71 O 0.33273127507937 0.52029157897098 0.08479894669799 15.999 > 8 72 O 0.83273127507937 0.52029157897098 0.08479894669799 15.999 > 8 73 O 0.31304175436236 0.47910636277506 0.41813228003132 15.999 > 3 74 O 0.81304175436236 0.47910636277506 0.41813228003132 15.999 > 3 75 O 0.31304175436236 0.97910636277506 0.41813228003132 15.999 > 3 76 O 0.81304175436236 0.97910636277506 0.41813228003132 15.999 > 3 77 O 0.02089363722494 0.33393539158730 0.41813228003132 15.999 > 4 78 O 0.52089363722494 0.33393539158730 0.41813228003132 15.999 > 4 79 O 0.02089363722494 0.83393539158730 0.41813228003132 15.999 > 4 80 O 0.52089363722494 0.83393539158730 0.41813228003132 15.999 > 4 81 O 0.33393539158730 0.31304175436236 0.58186771996868 15.999 > 5 82 O 0.83393539158730 0.31304175436236 0.58186771996868 15.999 > 5 83 O 0.33393539158730 0.81304175436236 0.58186771996868 15.999 > 5 84 O 0.83393539158730 0.81304175436236 0.58186771996868 15.999 > 5 85 O 0.18695824563764 0.02089363722494 0.58186771996868 15.999 > 6 86 O 0.68695824563764 0.02089363722494 0.58186771996868 15.999 > 6 87 O 0.18695824563764 0.52089363722494 0.58186771996868 15.999 > 6 88 O 0.68695824563764 0.52089363722494 0.58186771996868 15.999 > 6 89 O 0.47910636277506 0.16606460841270 0.58186771996868 15.999 > 7 90 O 0.97910636277506 0.16606460841270 0.58186771996868 15.999 > 7 91 O 0.47910636277506 0.66606460841270 0.58186771996868 15.999 > 7 92 O 0.97910636277506 0.66606460841270 0.58186771996868 15.999 > 7 93 O 0.16606460841270 0.18695824563764 0.41813228003132 15.999 > 8 94 O 0.66606460841270 0.18695824563764 0.41813228003132 15.999 > 8 95 O 0.16606460841270 0.68695824563764 0.41813228003132 15.999 > 8 96 O 0.66606460841270 0.68695824563764 0.41813228003132 15.999 > 8 *97 Mg 0.00000000000000 0.00000000000000 0.00000000000000 24.305 > 9 98 Mg 0.50000000000000 0.00000000000000 0.00000000000000 24.305 > 9 99 Mg 0.00000000000000 0.50000000000000 0.00000000000000 24.305 > 9 100 Mg 0.50000000000000 0.50000000000000 0.00000000000000 24.305 > 9 101 Mg 0.33333333333333 0.16666666666667 0.33333333333333 24.305 > 9 102 Mg 0.83333333333333 0.16666666666667 0.33333333333333 24.305 > 9 103 Mg 0.33333333333333 0.66666666666667 0.33333333333333 24.305 > 9 104 Mg 0.83333333333333 0.66666666666667 0.33333333333333 24.305 > 9 105 Mg 0.16666666666667 0.33333333333333 0.66666666666667 24.305 > 9 106 Mg 0.66666666666667 0.33333333333333 0.66666666666667 24.305 > 9 107 Mg 0.16666666666667 0.83333333333333 0.66666666666667 24.305 > 9 108 Mg 0.66666666666667 0.83333333333333 0.66666666666667 24.305 > 9 *109 Sn 0.33333333333333 0.16666666666667 0.83333333333333 118.710 > 10 110 Sn 0.83333333333333 0.16666666666667 0.83333333333333 118.710 > 10 111 Sn 0.33333333333333 0.66666666666667 0.83333333333333 118.710 > 10 112 Sn 0.83333333333333 0.66666666666667 0.83333333333333 118.710 > 10 113 Sn 0.16666666666667 0.33333333333333 0.16666666666667 118.710 > 10 114 Sn 0.66666666666667 0.33333333333333 0.16666666666667 118.710 > 10 115 Sn 0.16666666666667 0.83333333333333 0.16666666666667 118.710 > 10 116 Sn 0.66666666666667 0.83333333333333 0.16666666666667 118.710 > 10 117 Sn 0.00000000000000 0.00000000000000 0.50000000000000 118.710 > 10 118 Sn 0.50000000000000 0.00000000000000 0.50000000000000 118.710 > 10 119 Sn 0.00000000000000 0.50000000000000 0.50000000000000 118.710 > 10 120 Sn 0.50000000000000 0.50000000000000 0.50000000000000 118.710 > 10 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5876589 0.0000002 0.0000000 -0.0000002 3.5876589 0.0000000 0.0000000 0.0000000 3.0522994 -------------------------- Born effective charges -------------------------- 1 B 2.8207941 0.4452906 -0.0000000 -0.4452906 2.8207941 -0.0000000 0.0000000 0.0000000 0.8804916 2 B 2.8207941 0.4452906 -0.0000000 -0.4452906 2.8207941 -0.0000000 0.0000000 0.0000000 0.8804916 3 O -1.9060767 -0.5974866 -0.2891966 -0.4234399 -2.1541463 0.0246628 -0.2214173 0.0178965 -1.3044612 4 O -2.5342030 0.0607910 0.1232397 0.2348377 -1.5260200 -0.2627830 0.0952098 -0.2007012 -1.3044612 5 O -1.6500548 0.2756255 0.1659569 0.4496723 -2.4101682 0.2381202 0.1262075 0.1828047 -1.3044612 6 O -1.9060767 -0.5974866 -0.2891966 -0.4234399 -2.1541463 0.0246628 -0.2214173 0.0178965 -1.3044612 7 O -2.5342030 0.0607910 0.1232397 0.2348377 -1.5260200 -0.2627830 0.0952098 -0.2007012 -1.3044612 8 O -1.6500548 0.2756255 0.1659569 0.4496723 -2.4101682 0.2381202 0.1262075 0.1828047 -1.3044612 9 Mg 2.2364407 -0.0040668 -0.0000000 0.0040668 2.2364407 -0.0000000 0.0000000 0.0000000 2.4520527 10 Sn 4.3026401 -0.3643742 -0.0000000 0.3643742 4.3026401 -0.0000000 0.0000000 0.0000000 3.6137312 ---------------------------------------------------------------------------- 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: 360/360 Permutation basis: 7032/7032 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 952 Number of blocks in projector: 476 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 438 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 388 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 126 Use standard eigh solver. Tree of FC basis block matrices: - (952, 935), data: False |-- (126, 122), data: True |-- (388, 384), data: True |-- (438, 429), data: True ----- Solver_atoms: 1 -- 120 / 120 Time (Solver_compr_matrix_reshape): 0.015 Solver_block: 100 / 240 - Time: 1.100 Solver_block: 200 / 240 - Time: 1.063 Solver_block: 240 / 240 - Time: 0.488 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 2.680 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 360/360 Permutation basis: 7032/7032 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 952 Number of blocks in projector: 476 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 438 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 388 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 126 Use standard eigh solver. Tree of FC basis block matrices: - (952, 935), data: False |-- (126, 122), data: True |-- (388, 384), data: True |-- (438, 429), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 23:56:48]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 23:56:48]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.366226530778581 1.366141524508645 4.970316156666660 b -2.366226530778576 1.366141524508645 4.970316156666660 c 0.000000000000003 -2.732283049017294 4.970316156666660 Atomic positions (fractional): 1 B 0.75220231762795 0.75220231762795 0.75220231762795 10.811 2 B 0.24779768237205 0.24779768237205 0.24779768237205 10.811 3 O 0.04421578875604 0.75026149685673 0.45991955448120 15.999 4 O 0.45991955448120 0.04421578875604 0.75026149685673 15.999 5 O 0.24973850314327 0.54008044551880 0.95578421124396 15.999 6 O 0.95578421124396 0.24973850314327 0.54008044551880 15.999 7 O 0.54008044551880 0.95578421124397 0.24973850314327 15.999 8 O 0.75026149685673 0.45991955448120 0.04421578875604 15.999 9 Mg 0.00000000000000 0.00000000000000 0.00000000000000 24.305 10 Sn 0.50000000000000 0.50000000000000 0.50000000000000 118.710 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.464906123114314 0.000000000000000 0.000000000000000 b -4.732453061557158 8.196849147051879 0.000000000000000 c 0.000000000000000 0.000000000000000 14.910948469999997 Atomic positions (fractional): 1 B 0.00000000000000 0.00000000000000 0.75220231762795 10.811 > 1 2 B 0.50000000000000 0.00000000000000 0.75220231762795 10.811 > 1 3 B 0.00000000000000 0.50000000000000 0.75220231762795 10.811 > 1 4 B 0.50000000000000 0.50000000000000 0.75220231762795 10.811 > 1 5 B 0.16666666666667 0.33333333333333 0.91446434903872 10.811 > 5 6 B 0.66666666666667 0.33333333333333 0.91446434903872 10.811 > 5 7 B 0.16666666666667 0.83333333333333 0.91446434903872 10.811 > 5 8 B 0.66666666666667 0.83333333333333 0.91446434903872 10.811 > 5 9 B 0.33333333333333 0.16666666666667 0.08553565096128 10.811 > 1 10 B 0.83333333333333 0.16666666666667 0.08553565096128 10.811 > 1 11 B 0.33333333333333 0.66666666666667 0.08553565096128 10.811 > 1 12 B 0.83333333333333 0.66666666666667 0.08553565096128 10.811 > 1 13 B 0.00000000000000 0.00000000000000 0.24779768237205 10.811 > 5 14 B 0.50000000000000 0.00000000000000 0.24779768237205 10.811 > 5 15 B 0.00000000000000 0.50000000000000 0.24779768237205 10.811 > 5 16 B 0.50000000000000 0.50000000000000 0.24779768237205 10.811 > 5 17 B 0.16666666666667 0.33333333333333 0.41886898429461 10.811 > 1 18 B 0.66666666666667 0.33333333333333 0.41886898429461 10.811 > 1 19 B 0.16666666666667 0.83333333333333 0.41886898429461 10.811 > 1 20 B 0.66666666666667 0.83333333333333 0.41886898429461 10.811 > 1 21 B 0.33333333333333 0.16666666666667 0.58113101570539 10.811 > 5 22 B 0.83333333333333 0.16666666666667 0.58113101570539 10.811 > 5 23 B 0.33333333333333 0.66666666666667 0.58113101570539 10.811 > 5 24 B 0.83333333333333 0.66666666666667 0.58113101570539 10.811 > 5 25 O 0.14637508769569 0.14577302944173 0.75146561336466 15.999 > 25 26 O 0.64637508769569 0.14577302944173 0.75146561336466 15.999 > 25 27 O 0.14637508769569 0.64577302944173 0.75146561336466 15.999 > 25 28 O 0.64637508769569 0.64577302944173 0.75146561336466 15.999 > 25 29 O 0.35422697055827 0.00060205825396 0.75146561336466 15.999 > 29 30 O 0.85422697055827 0.00060205825396 0.75146561336466 15.999 > 29 31 O 0.35422697055827 0.50060205825396 0.75146561336466 15.999 > 29 32 O 0.85422697055827 0.50060205825396 0.75146561336466 15.999 > 29 33 O 0.16726872492063 0.47970842102902 0.91520105330201 15.999 > 33 34 O 0.66726872492063 0.47970842102902 0.91520105330201 15.999 > 33 35 O 0.16726872492063 0.97970842102902 0.91520105330201 15.999 > 33 36 O 0.66726872492063 0.97970842102902 0.91520105330201 15.999 > 33 37 O 0.02029157897098 0.18756030389161 0.91520105330201 15.999 > 37 38 O 0.52029157897098 0.18756030389161 0.91520105330201 15.999 > 37 39 O 0.02029157897098 0.68756030389161 0.91520105330201 15.999 > 37 40 O 0.52029157897098 0.68756030389161 0.91520105330201 15.999 > 37 41 O 0.31243969610839 0.33273127507937 0.91520105330201 15.999 > 41 42 O 0.81243969610839 0.33273127507937 0.91520105330201 15.999 > 41 43 O 0.31243969610839 0.83273127507937 0.91520105330201 15.999 > 41 44 O 0.81243969610839 0.83273127507937 0.91520105330201 15.999 > 41 45 O 0.49939794174604 0.35362491230431 0.75146561336466 15.999 > 45 46 O 0.99939794174604 0.35362491230431 0.75146561336466 15.999 > 45 47 O 0.49939794174604 0.85362491230431 0.75146561336466 15.999 > 45 48 O 0.99939794174604 0.85362491230431 0.75146561336466 15.999 > 45 49 O 0.47970842102902 0.31243969610839 0.08479894669799 15.999 > 25 50 O 0.97970842102902 0.31243969610839 0.08479894669799 15.999 > 25 51 O 0.47970842102902 0.81243969610839 0.08479894669799 15.999 > 25 52 O 0.97970842102902 0.81243969610839 0.08479894669799 15.999 > 25 53 O 0.18756030389161 0.16726872492063 0.08479894669799 15.999 > 29 54 O 0.68756030389161 0.16726872492063 0.08479894669799 15.999 > 29 55 O 0.18756030389161 0.66726872492063 0.08479894669799 15.999 > 29 56 O 0.68756030389161 0.66726872492063 0.08479894669799 15.999 > 29 57 O 0.00060205825396 0.14637508769569 0.24853438663534 15.999 > 33 58 O 0.50060205825396 0.14637508769569 0.24853438663534 15.999 > 33 59 O 0.00060205825396 0.64637508769569 0.24853438663534 15.999 > 33 60 O 0.50060205825396 0.64637508769569 0.24853438663534 15.999 > 33 61 O 0.35362491230431 0.35422697055827 0.24853438663534 15.999 > 37 62 O 0.85362491230431 0.35422697055827 0.24853438663534 15.999 > 37 63 O 0.35362491230431 0.85422697055827 0.24853438663534 15.999 > 37 64 O 0.85362491230431 0.85422697055827 0.24853438663534 15.999 > 37 65 O 0.14577302944173 0.49939794174604 0.24853438663534 15.999 > 41 66 O 0.64577302944173 0.49939794174604 0.24853438663534 15.999 > 41 67 O 0.14577302944173 0.99939794174604 0.24853438663534 15.999 > 41 68 O 0.64577302944173 0.99939794174604 0.24853438663534 15.999 > 41 69 O 0.33273127507937 0.02029157897098 0.08479894669799 15.999 > 45 70 O 0.83273127507937 0.02029157897098 0.08479894669799 15.999 > 45 71 O 0.33273127507937 0.52029157897098 0.08479894669799 15.999 > 45 72 O 0.83273127507937 0.52029157897098 0.08479894669799 15.999 > 45 73 O 0.31304175436236 0.47910636277506 0.41813228003132 15.999 > 25 74 O 0.81304175436236 0.47910636277506 0.41813228003132 15.999 > 25 75 O 0.31304175436236 0.97910636277506 0.41813228003132 15.999 > 25 76 O 0.81304175436236 0.97910636277506 0.41813228003132 15.999 > 25 77 O 0.02089363722494 0.33393539158730 0.41813228003132 15.999 > 29 78 O 0.52089363722494 0.33393539158730 0.41813228003132 15.999 > 29 79 O 0.02089363722494 0.83393539158730 0.41813228003132 15.999 > 29 80 O 0.52089363722494 0.83393539158730 0.41813228003132 15.999 > 29 81 O 0.33393539158730 0.31304175436236 0.58186771996868 15.999 > 33 82 O 0.83393539158730 0.31304175436236 0.58186771996868 15.999 > 33 83 O 0.33393539158730 0.81304175436236 0.58186771996868 15.999 > 33 84 O 0.83393539158730 0.81304175436236 0.58186771996868 15.999 > 33 85 O 0.18695824563764 0.02089363722494 0.58186771996868 15.999 > 37 86 O 0.68695824563764 0.02089363722494 0.58186771996868 15.999 > 37 87 O 0.18695824563764 0.52089363722494 0.58186771996868 15.999 > 37 88 O 0.68695824563764 0.52089363722494 0.58186771996868 15.999 > 37 89 O 0.47910636277506 0.16606460841270 0.58186771996868 15.999 > 41 90 O 0.97910636277506 0.16606460841270 0.58186771996868 15.999 > 41 91 O 0.47910636277506 0.66606460841270 0.58186771996868 15.999 > 41 92 O 0.97910636277506 0.66606460841270 0.58186771996868 15.999 > 41 93 O 0.16606460841270 0.18695824563764 0.41813228003132 15.999 > 45 94 O 0.66606460841270 0.18695824563764 0.41813228003132 15.999 > 45 95 O 0.16606460841270 0.68695824563764 0.41813228003132 15.999 > 45 96 O 0.66606460841270 0.68695824563764 0.41813228003132 15.999 > 45 97 Mg 0.00000000000000 0.00000000000000 0.00000000000000 24.305 > 97 98 Mg 0.50000000000000 0.00000000000000 0.00000000000000 24.305 > 97 99 Mg 0.00000000000000 0.50000000000000 0.00000000000000 24.305 > 97 100 Mg 0.50000000000000 0.50000000000000 0.00000000000000 24.305 > 97 101 Mg 0.33333333333333 0.16666666666667 0.33333333333333 24.305 > 97 102 Mg 0.83333333333333 0.16666666666667 0.33333333333333 24.305 > 97 103 Mg 0.33333333333333 0.66666666666667 0.33333333333333 24.305 > 97 104 Mg 0.83333333333333 0.66666666666667 0.33333333333333 24.305 > 97 105 Mg 0.16666666666667 0.33333333333333 0.66666666666667 24.305 > 97 106 Mg 0.66666666666667 0.33333333333333 0.66666666666667 24.305 > 97 107 Mg 0.16666666666667 0.83333333333333 0.66666666666667 24.305 > 97 108 Mg 0.66666666666667 0.83333333333333 0.66666666666667 24.305 > 97 109 Sn 0.33333333333333 0.16666666666667 0.83333333333333 118.710 > 109 110 Sn 0.83333333333333 0.16666666666667 0.83333333333333 118.710 > 109 111 Sn 0.33333333333333 0.66666666666667 0.83333333333333 118.710 > 109 112 Sn 0.83333333333333 0.66666666666667 0.83333333333333 118.710 > 109 113 Sn 0.16666666666667 0.33333333333333 0.16666666666667 118.710 > 109 114 Sn 0.66666666666667 0.33333333333333 0.16666666666667 118.710 > 109 115 Sn 0.16666666666667 0.83333333333333 0.16666666666667 118.710 > 109 116 Sn 0.66666666666667 0.83333333333333 0.16666666666667 118.710 > 109 117 Sn 0.00000000000000 0.00000000000000 0.50000000000000 118.710 > 109 118 Sn 0.50000000000000 0.00000000000000 0.50000000000000 118.710 > 109 119 Sn 0.00000000000000 0.50000000000000 0.50000000000000 118.710 > 109 120 Sn 0.50000000000000 0.50000000000000 0.50000000000000 118.710 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5876589 0.0000002 0.0000000 -0.0000002 3.5876589 0.0000000 0.0000000 0.0000000 3.0522994 -------------------------- Born effective charges -------------------------- 1 B 2.8207941 0.4452906 -0.0000000 -0.4452906 2.8207941 -0.0000000 0.0000000 0.0000000 0.8804916 2 B 2.8207941 0.4452906 -0.0000000 -0.4452906 2.8207941 -0.0000000 0.0000000 0.0000000 0.8804916 3 O -1.9060767 -0.5974866 -0.2891966 -0.4234399 -2.1541463 0.0246628 -0.2214173 0.0178965 -1.3044612 4 O -2.5342030 0.0607910 0.1232397 0.2348377 -1.5260200 -0.2627830 0.0952098 -0.2007012 -1.3044612 5 O -1.6500548 0.2756255 0.1659569 0.4496723 -2.4101682 0.2381202 0.1262075 0.1828047 -1.3044612 6 O -1.9060767 -0.5974866 -0.2891966 -0.4234399 -2.1541463 0.0246628 -0.2214173 0.0178965 -1.3044612 7 O -2.5342030 0.0607910 0.1232397 0.2348377 -1.5260200 -0.2627830 0.0952098 -0.2007012 -1.3044612 8 O -1.6500548 0.2756255 0.1659569 0.4496723 -2.4101682 0.2381202 0.1262075 0.1828047 -1.3044612 9 Mg 2.2364407 -0.0040668 -0.0000000 0.0040668 2.2364407 -0.0000000 0.0000000 0.0000000 2.4520527 10 Sn 4.3026401 -0.3643742 -0.0000000 0.3643742 4.3026401 -0.0000000 0.0000000 0.0000000 3.6137312 ---------------------------------------------------------------------------- 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 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [-0.0050 0.0087 0.0000] [ 0.0050 -0.0087 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] 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 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 109, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000015 (xyy) -0.00000015 (xyy) -0.00000015 (xyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000005 (yx) -0.00000005 (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 2026-01-07 23:57:01]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 23:57:01]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.366226530778581 1.366141524508645 4.970316156666660 b -2.366226530778576 1.366141524508645 4.970316156666660 c 0.000000000000003 -2.732283049017294 4.970316156666660 Atomic positions (fractional): 1 B 0.75220231762795 0.75220231762795 0.75220231762795 10.811 2 B 0.24779768237205 0.24779768237205 0.24779768237205 10.811 3 O 0.04421578875604 0.75026149685673 0.45991955448120 15.999 4 O 0.45991955448120 0.04421578875604 0.75026149685673 15.999 5 O 0.24973850314327 0.54008044551880 0.95578421124396 15.999 6 O 0.95578421124396 0.24973850314327 0.54008044551880 15.999 7 O 0.54008044551880 0.95578421124397 0.24973850314327 15.999 8 O 0.75026149685673 0.45991955448120 0.04421578875604 15.999 9 Mg 0.00000000000000 0.00000000000000 0.00000000000000 24.305 10 Sn 0.50000000000000 0.50000000000000 0.50000000000000 118.710 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.464906123114314 0.000000000000000 0.000000000000000 b -4.732453061557158 8.196849147051879 0.000000000000000 c 0.000000000000000 0.000000000000000 14.910948469999997 Atomic positions (fractional): 1 B 0.00000000000000 0.00000000000000 0.75220231762795 10.811 > 1 2 B 0.50000000000000 0.00000000000000 0.75220231762795 10.811 > 1 3 B 0.00000000000000 0.50000000000000 0.75220231762795 10.811 > 1 4 B 0.50000000000000 0.50000000000000 0.75220231762795 10.811 > 1 5 B 0.16666666666667 0.33333333333333 0.91446434903872 10.811 > 5 6 B 0.66666666666667 0.33333333333333 0.91446434903872 10.811 > 5 7 B 0.16666666666667 0.83333333333333 0.91446434903872 10.811 > 5 8 B 0.66666666666667 0.83333333333333 0.91446434903872 10.811 > 5 9 B 0.33333333333333 0.16666666666667 0.08553565096128 10.811 > 1 10 B 0.83333333333333 0.16666666666667 0.08553565096128 10.811 > 1 11 B 0.33333333333333 0.66666666666667 0.08553565096128 10.811 > 1 12 B 0.83333333333333 0.66666666666667 0.08553565096128 10.811 > 1 13 B 0.00000000000000 0.00000000000000 0.24779768237205 10.811 > 5 14 B 0.50000000000000 0.00000000000000 0.24779768237205 10.811 > 5 15 B 0.00000000000000 0.50000000000000 0.24779768237205 10.811 > 5 16 B 0.50000000000000 0.50000000000000 0.24779768237205 10.811 > 5 17 B 0.16666666666667 0.33333333333333 0.41886898429461 10.811 > 1 18 B 0.66666666666667 0.33333333333333 0.41886898429461 10.811 > 1 19 B 0.16666666666667 0.83333333333333 0.41886898429461 10.811 > 1 20 B 0.66666666666667 0.83333333333333 0.41886898429461 10.811 > 1 21 B 0.33333333333333 0.16666666666667 0.58113101570539 10.811 > 5 22 B 0.83333333333333 0.16666666666667 0.58113101570539 10.811 > 5 23 B 0.33333333333333 0.66666666666667 0.58113101570539 10.811 > 5 24 B 0.83333333333333 0.66666666666667 0.58113101570539 10.811 > 5 25 O 0.14637508769569 0.14577302944173 0.75146561336466 15.999 > 25 26 O 0.64637508769569 0.14577302944173 0.75146561336466 15.999 > 25 27 O 0.14637508769569 0.64577302944173 0.75146561336466 15.999 > 25 28 O 0.64637508769569 0.64577302944173 0.75146561336466 15.999 > 25 29 O 0.35422697055827 0.00060205825396 0.75146561336466 15.999 > 29 30 O 0.85422697055827 0.00060205825396 0.75146561336466 15.999 > 29 31 O 0.35422697055827 0.50060205825396 0.75146561336466 15.999 > 29 32 O 0.85422697055827 0.50060205825396 0.75146561336466 15.999 > 29 33 O 0.16726872492063 0.47970842102902 0.91520105330201 15.999 > 33 34 O 0.66726872492063 0.47970842102902 0.91520105330201 15.999 > 33 35 O 0.16726872492063 0.97970842102902 0.91520105330201 15.999 > 33 36 O 0.66726872492063 0.97970842102902 0.91520105330201 15.999 > 33 37 O 0.02029157897098 0.18756030389161 0.91520105330201 15.999 > 37 38 O 0.52029157897098 0.18756030389161 0.91520105330201 15.999 > 37 39 O 0.02029157897098 0.68756030389161 0.91520105330201 15.999 > 37 40 O 0.52029157897098 0.68756030389161 0.91520105330201 15.999 > 37 41 O 0.31243969610839 0.33273127507937 0.91520105330201 15.999 > 41 42 O 0.81243969610839 0.33273127507937 0.91520105330201 15.999 > 41 43 O 0.31243969610839 0.83273127507937 0.91520105330201 15.999 > 41 44 O 0.81243969610839 0.83273127507937 0.91520105330201 15.999 > 41 45 O 0.49939794174604 0.35362491230431 0.75146561336466 15.999 > 45 46 O 0.99939794174604 0.35362491230431 0.75146561336466 15.999 > 45 47 O 0.49939794174604 0.85362491230431 0.75146561336466 15.999 > 45 48 O 0.99939794174604 0.85362491230431 0.75146561336466 15.999 > 45 49 O 0.47970842102902 0.31243969610839 0.08479894669799 15.999 > 25 50 O 0.97970842102902 0.31243969610839 0.08479894669799 15.999 > 25 51 O 0.47970842102902 0.81243969610839 0.08479894669799 15.999 > 25 52 O 0.97970842102902 0.81243969610839 0.08479894669799 15.999 > 25 53 O 0.18756030389161 0.16726872492063 0.08479894669799 15.999 > 29 54 O 0.68756030389161 0.16726872492063 0.08479894669799 15.999 > 29 55 O 0.18756030389161 0.66726872492063 0.08479894669799 15.999 > 29 56 O 0.68756030389161 0.66726872492063 0.08479894669799 15.999 > 29 57 O 0.00060205825396 0.14637508769569 0.24853438663534 15.999 > 33 58 O 0.50060205825396 0.14637508769569 0.24853438663534 15.999 > 33 59 O 0.00060205825396 0.64637508769569 0.24853438663534 15.999 > 33 60 O 0.50060205825396 0.64637508769569 0.24853438663534 15.999 > 33 61 O 0.35362491230431 0.35422697055827 0.24853438663534 15.999 > 37 62 O 0.85362491230431 0.35422697055827 0.24853438663534 15.999 > 37 63 O 0.35362491230431 0.85422697055827 0.24853438663534 15.999 > 37 64 O 0.85362491230431 0.85422697055827 0.24853438663534 15.999 > 37 65 O 0.14577302944173 0.49939794174604 0.24853438663534 15.999 > 41 66 O 0.64577302944173 0.49939794174604 0.24853438663534 15.999 > 41 67 O 0.14577302944173 0.99939794174604 0.24853438663534 15.999 > 41 68 O 0.64577302944173 0.99939794174604 0.24853438663534 15.999 > 41 69 O 0.33273127507937 0.02029157897098 0.08479894669799 15.999 > 45 70 O 0.83273127507937 0.02029157897098 0.08479894669799 15.999 > 45 71 O 0.33273127507937 0.52029157897098 0.08479894669799 15.999 > 45 72 O 0.83273127507937 0.52029157897098 0.08479894669799 15.999 > 45 73 O 0.31304175436236 0.47910636277506 0.41813228003132 15.999 > 25 74 O 0.81304175436236 0.47910636277506 0.41813228003132 15.999 > 25 75 O 0.31304175436236 0.97910636277506 0.41813228003132 15.999 > 25 76 O 0.81304175436236 0.97910636277506 0.41813228003132 15.999 > 25 77 O 0.02089363722494 0.33393539158730 0.41813228003132 15.999 > 29 78 O 0.52089363722494 0.33393539158730 0.41813228003132 15.999 > 29 79 O 0.02089363722494 0.83393539158730 0.41813228003132 15.999 > 29 80 O 0.52089363722494 0.83393539158730 0.41813228003132 15.999 > 29 81 O 0.33393539158730 0.31304175436236 0.58186771996868 15.999 > 33 82 O 0.83393539158730 0.31304175436236 0.58186771996868 15.999 > 33 83 O 0.33393539158730 0.81304175436236 0.58186771996868 15.999 > 33 84 O 0.83393539158730 0.81304175436236 0.58186771996868 15.999 > 33 85 O 0.18695824563764 0.02089363722494 0.58186771996868 15.999 > 37 86 O 0.68695824563764 0.02089363722494 0.58186771996868 15.999 > 37 87 O 0.18695824563764 0.52089363722494 0.58186771996868 15.999 > 37 88 O 0.68695824563764 0.52089363722494 0.58186771996868 15.999 > 37 89 O 0.47910636277506 0.16606460841270 0.58186771996868 15.999 > 41 90 O 0.97910636277506 0.16606460841270 0.58186771996868 15.999 > 41 91 O 0.47910636277506 0.66606460841270 0.58186771996868 15.999 > 41 92 O 0.97910636277506 0.66606460841270 0.58186771996868 15.999 > 41 93 O 0.16606460841270 0.18695824563764 0.41813228003132 15.999 > 45 94 O 0.66606460841270 0.18695824563764 0.41813228003132 15.999 > 45 95 O 0.16606460841270 0.68695824563764 0.41813228003132 15.999 > 45 96 O 0.66606460841270 0.68695824563764 0.41813228003132 15.999 > 45 97 Mg 0.00000000000000 0.00000000000000 0.00000000000000 24.305 > 97 98 Mg 0.50000000000000 0.00000000000000 0.00000000000000 24.305 > 97 99 Mg 0.00000000000000 0.50000000000000 0.00000000000000 24.305 > 97 100 Mg 0.50000000000000 0.50000000000000 0.00000000000000 24.305 > 97 101 Mg 0.33333333333333 0.16666666666667 0.33333333333333 24.305 > 97 102 Mg 0.83333333333333 0.16666666666667 0.33333333333333 24.305 > 97 103 Mg 0.33333333333333 0.66666666666667 0.33333333333333 24.305 > 97 104 Mg 0.83333333333333 0.66666666666667 0.33333333333333 24.305 > 97 105 Mg 0.16666666666667 0.33333333333333 0.66666666666667 24.305 > 97 106 Mg 0.66666666666667 0.33333333333333 0.66666666666667 24.305 > 97 107 Mg 0.16666666666667 0.83333333333333 0.66666666666667 24.305 > 97 108 Mg 0.66666666666667 0.83333333333333 0.66666666666667 24.305 > 97 109 Sn 0.33333333333333 0.16666666666667 0.83333333333333 118.710 > 109 110 Sn 0.83333333333333 0.16666666666667 0.83333333333333 118.710 > 109 111 Sn 0.33333333333333 0.66666666666667 0.83333333333333 118.710 > 109 112 Sn 0.83333333333333 0.66666666666667 0.83333333333333 118.710 > 109 113 Sn 0.16666666666667 0.33333333333333 0.16666666666667 118.710 > 109 114 Sn 0.66666666666667 0.33333333333333 0.16666666666667 118.710 > 109 115 Sn 0.16666666666667 0.83333333333333 0.16666666666667 118.710 > 109 116 Sn 0.66666666666667 0.83333333333333 0.16666666666667 118.710 > 109 117 Sn 0.00000000000000 0.00000000000000 0.50000000000000 118.710 > 109 118 Sn 0.50000000000000 0.00000000000000 0.50000000000000 118.710 > 109 119 Sn 0.00000000000000 0.50000000000000 0.50000000000000 118.710 > 109 120 Sn 0.50000000000000 0.50000000000000 0.50000000000000 118.710 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.5876589 0.0000002 0.0000000 -0.0000002 3.5876589 0.0000000 0.0000000 0.0000000 3.0522994 -------------------------- Born effective charges -------------------------- 1 B 2.8207941 0.4452906 -0.0000000 -0.4452906 2.8207941 -0.0000000 0.0000000 0.0000000 0.8804916 2 B 2.8207941 0.4452906 -0.0000000 -0.4452906 2.8207941 -0.0000000 0.0000000 0.0000000 0.8804916 3 O -1.9060767 -0.5974866 -0.2891966 -0.4234399 -2.1541463 0.0246628 -0.2214173 0.0178965 -1.3044612 4 O -2.5342030 0.0607910 0.1232397 0.2348377 -1.5260200 -0.2627830 0.0952098 -0.2007012 -1.3044612 5 O -1.6500548 0.2756255 0.1659569 0.4496723 -2.4101682 0.2381202 0.1262075 0.1828047 -1.3044612 6 O -1.9060767 -0.5974866 -0.2891966 -0.4234399 -2.1541463 0.0246628 -0.2214173 0.0178965 -1.3044612 7 O -2.5342030 0.0607910 0.1232397 0.2348377 -1.5260200 -0.2627830 0.0952098 -0.2007012 -1.3044612 8 O -1.6500548 0.2756255 0.1659569 0.4496723 -2.4101682 0.2381202 0.1262075 0.1828047 -1.3044612 9 Mg 2.2364407 -0.0040668 -0.0000000 0.0040668 2.2364407 -0.0000000 0.0000000 0.0000000 2.4520527 10 Sn 4.3026401 -0.3643742 -0.0000000 0.3643742 4.3026401 -0.0000000 0.0000000 0.0000000 3.6137312 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000015 (xyy) -0.00000015 (xyy) -0.00000015 (xyy) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 13 13 13 ] 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: 0.91, Number of G-points: 297, Lambda: 0.17 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/371) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 371 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 6.169 ( 0.000 0.000 0.000) 0.000 6.169 ( 0.000 0.000 0.000) 0.000 6.876 ( 0.000 0.000 0.000) 0.000 7.504 ( 0.000 0.000 0.000) 0.000 7.504 ( 0.000 0.000 0.000) 0.000 8.622 ( 0.000 0.000 0.000) 0.000 8.622 ( 0.000 0.000 0.000) 0.000 9.793 ( 0.000 0.000 0.000) 0.000 9.969 ( 0.000 0.000 0.000) 0.000 11.391 ( 0.000 0.000 0.000) 0.000 11.391 ( 0.000 0.000 0.000) 0.000 11.577 ( 0.000 0.000 0.000) 0.000 11.577 ( 0.000 0.000 0.000) 0.000 12.879 ( 0.000 0.000 0.000) 0.000 13.758 ( 0.000 0.000 0.000) 0.000 18.969 ( 0.000 0.000 0.000) 0.000 18.969 ( 0.000 0.000 0.000) 0.000 19.646 ( 0.000 0.000 0.000) 0.000 19.646 ( 0.000 0.000 0.000) 0.000 20.300 ( 0.000 0.000 0.000) 0.000 21.092 ( 0.000 0.000 0.000) 0.000 27.413 ( 0.000 0.000 0.000) 0.000 27.749 ( 0.000 0.000 0.000) 0.000 36.927 ( 0.000 0.000 0.000) 0.000 36.927 ( 0.000 0.000 0.000) 0.000 36.937 ( 0.000 0.000 0.000) 0.000 36.937 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/371) ======================= q-point: ( 0.08 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.696 ( 30.722 16.428 8.927) 35.963 0.872 ( 40.210 24.850 -3.635) 47.409 1.639 ( 69.015 39.510 18.788) 81.714 6.147 ( -0.217 -2.365 -2.729) 3.618 6.578 ( 5.300 5.505 -28.894) 29.887 7.066 ( -12.724 -6.756 48.568) 50.659 7.542 ( 0.824 4.036 2.954) 5.069 7.597 ( 11.880 -0.750 -4.252) 12.640 8.618 ( -2.941 4.955 -0.823) 5.820 8.895 ( 5.279 -1.233 4.761) 7.215 9.764 ( -2.038 -1.145 -2.860) 3.694 9.885 ( -10.603 -4.454 6.846) 13.384 11.346 ( -2.774 -2.523 4.525) 5.877 11.585 ( 1.166 1.871 -4.177) 4.723 11.711 ( 10.678 5.617 -1.569) 12.167 12.792 ( -1.268 0.040 -11.625) 11.694 13.725 ( -4.165 -2.306 -3.443) 5.876 13.791 ( -8.196 -6.343 -12.321) 16.100 18.921 ( -3.869 -2.996 -0.381) 4.908 19.008 ( 2.621 2.587 0.619) 3.734 19.612 ( -2.514 -1.937 -1.604) 3.556 19.896 ( 2.735 2.416 -26.821) 27.068 20.531 ( -14.529 -8.781 64.358) 66.560 21.089 ( -0.632 -0.372 1.354) 1.540 27.436 ( 2.071 1.221 -0.232) 2.415 27.740 ( -0.877 -0.613 0.195) 1.088 36.848 ( -1.521 -2.445 3.501) 4.533 36.984 ( 2.242 9.002 -2.135) 9.520 37.135 ( 14.807 2.140 0.967) 14.992 41.226 ( 17.311 10.248 -91.612) 93.795 ======================= Grid point 2 (3/371) ======================= q-point: ( 0.15 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.400 ( 31.007 16.495 9.314) 36.336 1.730 ( 38.390 25.241 -3.198) 46.056 3.120 ( 59.208 32.839 12.816) 68.907 6.113 ( 1.199 -0.483 -4.467) 4.650 6.590 ( 3.206 3.216 -8.054) 9.246 7.031 ( -6.409 -4.821 18.922) 20.551 7.605 ( -1.965 5.056 4.477) 7.033 7.785 ( 15.648 -4.680 -2.411) 16.510 8.624 ( -3.560 12.296 -6.340) 14.285 9.045 ( 9.816 -2.944 10.803) 14.891 9.621 ( -12.254 -4.380 0.195) 13.015 9.728 ( -5.515 -1.766 3.513) 6.773 11.327 ( -0.901 -0.972 5.365) 5.526 11.599 ( 1.413 2.813 -8.412) 8.982 11.965 ( 12.937 7.206 -0.482) 14.816 12.646 ( -11.731 -7.449 5.085) 14.797 13.371 ( -14.658 -10.012 -18.842) 25.887 13.675 ( -3.896 -2.863 -1.251) 4.994 18.796 ( -6.237 -4.815 -0.604) 7.903 19.082 ( 1.638 3.011 1.070) 3.591 19.518 ( -4.200 -3.288 -2.919) 6.081 19.802 ( -2.559 -0.336 -12.239) 12.509 20.551 ( -5.607 -3.895 29.818) 30.589 21.077 ( -1.373 -0.835 2.220) 2.740 27.496 ( 3.381 2.139 -0.523) 4.035 27.716 ( -1.051 -0.885 -0.158) 1.383 36.863 ( 3.116 -1.870 4.189) 5.546 37.133 ( 3.846 14.572 -3.735) 15.527 37.457 ( 20.263 2.165 4.278) 20.822 41.090 ( 3.006 2.517 -47.681) 47.842 ======================= Grid point 3 (4/371) ======================= q-point: ( 0.23 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.105 ( 30.543 16.044 9.840) 35.877 2.550 ( 34.937 24.937 -2.513) 42.997 4.230 ( 40.033 20.045 2.593) 44.846 6.157 ( 4.490 4.262 -4.933) 7.915 6.636 ( -0.852 0.517 1.875) 2.124 7.014 ( 5.046 -3.137 8.543) 10.406 7.586 ( -6.429 0.051 5.250) 8.300 7.990 ( 14.016 -3.577 3.573) 14.900 8.674 ( -2.017 17.337 -12.179) 21.283 9.143 ( -0.652 -13.589 7.902) 15.733 9.478 ( -2.391 5.058 8.266) 9.981 9.667 ( -2.476 0.068 2.902) 3.815 11.341 ( -2.847 3.880 4.430) 6.541 11.571 ( -0.411 -2.219 -11.174) 11.399 12.176 ( -6.372 1.392 3.130) 7.234 12.364 ( -0.497 -9.865 4.966) 11.056 13.024 ( -7.630 -4.166 -15.251) 17.555 13.552 ( -5.943 -4.249 -2.847) 7.841 18.638 ( -6.425 -5.156 -0.746) 8.272 19.093 ( -3.857 0.558 1.081) 4.044 19.400 ( -3.988 -3.052 -3.625) 6.194 19.705 ( -2.303 -0.589 -6.263) 6.699 20.582 ( -2.073 -1.956 16.772) 17.012 21.050 ( -2.174 -1.337 2.380) 3.490 27.572 ( 3.445 2.601 -0.923) 4.414 27.693 ( -0.533 -0.945 -0.157) 1.097 36.945 ( 5.625 -1.078 4.176) 7.088 37.327 ( 4.479 15.942 -4.413) 17.137 37.861 ( 22.569 2.115 7.263) 23.803 40.889 ( -3.117 -0.078 -33.136) 33.282 ======================= Grid point 4 (5/371) ======================= q-point: ( 0.31 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.783 ( 28.279 14.643 10.129) 33.417 3.291 ( 29.287 22.773 -1.658) 37.136 4.845 ( 22.636 9.009 -3.732) 24.647 6.205 ( -0.803 0.491 -8.926) 8.975 6.541 ( -5.856 -2.310 0.304) 6.302 7.250 ( 6.978 -2.165 10.619) 12.890 7.554 ( 6.571 3.863 9.650) 12.298 8.188 ( 6.001 2.086 7.269) 9.654 8.723 ( -0.233 8.083 -10.786) 13.481 8.968 ( -4.246 -9.272 -0.919) 10.239 9.536 ( -3.747 4.265 2.910) 6.380 9.731 ( 2.382 1.166 9.859) 10.209 11.259 ( -18.414 9.422 -1.789) 20.762 11.471 ( 8.725 -16.902 1.656) 19.093 11.934 ( -8.992 -1.106 -1.376) 9.164 12.518 ( 8.452 1.369 -2.567) 8.939 12.868 ( -2.750 -0.610 -4.192) 5.050 13.373 ( -7.718 -5.670 -4.727) 10.680 18.498 ( -4.308 -4.267 -0.942) 6.136 18.976 ( -9.300 -2.594 0.743) 9.684 19.316 ( -1.368 -0.851 -3.339) 3.708 19.652 ( -1.442 -0.569 -2.428) 2.881 20.620 ( 0.068 -0.665 9.264) 9.288 21.006 ( -2.862 -1.736 1.933) 3.866 27.638 ( 2.017 2.788 -1.556) 3.776 27.684 ( 0.726 -1.155 0.361) 1.411 37.055 ( 5.972 -0.462 3.586) 6.981 37.517 ( 4.058 13.886 -4.092) 15.035 38.282 ( 21.202 1.495 9.149) 23.140 40.658 ( -6.087 -0.632 -24.905) 25.645 ======================= Grid point 5 (6/371) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.377 ( 22.488 11.580 9.148) 26.898 3.885 ( 20.517 17.217 -0.804) 26.796 5.204 ( 16.389 6.067 -2.669) 17.679 6.006 ( -10.592 -6.847 -9.585) 15.841 6.517 ( 1.862 2.054 -1.418) 3.114 7.164 ( -7.951 -7.146 5.130) 11.858 7.979 ( 19.941 5.391 15.414) 25.774 8.237 ( -9.213 5.425 10.300) 14.846 8.743 ( 7.297 -6.308 -4.088) 10.477 8.855 ( -2.205 2.950 -15.643) 16.071 9.499 ( -6.632 2.817 0.223) 7.209 9.681 ( -9.264 -5.987 4.413) 11.881 11.195 ( 2.934 7.937 10.595) 13.559 11.530 ( 9.868 -9.224 5.082) 14.432 11.831 ( -5.784 5.869 -7.413) 11.084 12.509 ( -4.135 -4.026 -8.430) 10.216 12.883 ( 1.951 2.271 2.478) 3.886 13.167 ( -6.768 -5.855 -4.550) 10.039 18.423 ( -0.215 -2.361 -1.046) 2.591 18.782 ( -10.519 -3.453 0.631) 11.089 19.313 ( 2.299 1.730 -2.192) 3.617 19.600 ( -3.133 -1.835 -0.458) 3.660 20.668 ( 1.557 0.383 4.506) 4.783 20.947 ( -3.124 -1.835 1.133) 3.796 27.668 ( 0.331 1.846 -1.337) 2.303 27.700 ( 1.571 -0.674 0.396) 1.755 37.155 ( 4.442 -0.137 2.448) 5.074 37.666 ( 2.775 9.355 -2.882) 10.174 38.647 ( 16.032 0.571 8.753) 18.275 40.439 ( -6.394 -0.265 -17.333) 18.476 ======================= Grid point 6 (7/371) ======================= q-point: ( 0.46 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.769 ( 9.603 4.972 4.327) 11.647 4.234 ( 7.645 6.745 -0.191) 10.196 5.455 ( 8.523 3.286 -0.848) 9.174 5.751 ( -7.084 -4.178 -4.262) 9.263 6.567 ( 1.909 1.346 -1.023) 2.549 7.021 ( -4.115 -3.584 2.135) 5.860 8.112 ( -4.143 -1.527 3.496) 5.632 8.417 ( 11.184 5.442 17.009) 21.071 8.681 ( -5.710 -1.885 -12.751) 14.098 8.813 ( 1.259 0.703 -7.132) 7.276 9.356 ( -5.137 -4.040 -0.060) 6.535 9.568 ( -2.676 0.262 1.407) 3.035 11.459 ( 7.390 3.934 9.420) 12.603 11.664 ( 8.544 -3.897 3.698) 10.093 11.779 ( -2.023 8.672 -2.462) 9.239 12.271 ( -9.969 -6.776 -9.386) 15.277 12.930 ( 0.168 1.544 0.585) 1.660 13.039 ( -1.675 -2.817 -0.951) 3.413 18.437 ( 3.318 -0.128 -0.769) 3.408 18.604 ( -7.266 -2.092 0.578) 7.583 19.389 ( 4.555 3.084 -1.057) 5.601 19.510 ( -4.694 -2.982 0.349) 5.572 20.716 ( 1.410 0.599 1.393) 2.070 20.891 ( -1.891 -1.070 0.287) 2.192 27.679 ( 0.183 0.651 -0.419) 0.795 27.714 ( 0.489 -0.229 0.061) 0.544 37.214 ( 1.632 -0.022 0.873) 1.851 37.747 ( 0.979 3.292 -1.039) 3.588 38.873 ( 6.348 0.043 4.030) 7.519 40.291 ( -3.033 0.024 -6.758) 7.407 ======================= Grid point 14 (8/371) ======================= q-point: ( 0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.863 ( 2.411 33.998 21.371) 40.229 1.100 ( -2.337 44.736 23.271) 50.481 1.593 ( 0.324 73.659 16.383) 75.460 6.198 ( -5.857 1.176 3.104) 6.733 6.430 ( 5.494 11.137 -23.198) 26.313 7.236 ( 6.243 -26.054 30.920) 40.913 7.497 ( -9.265 -6.908 8.912) 14.594 7.666 ( -1.533 14.846 1.757) 15.028 8.636 ( 10.797 -0.660 2.334) 11.067 8.859 ( -6.924 2.429 -0.071) 7.338 9.740 ( 0.210 -3.900 -4.582) 6.021 9.920 ( 1.934 -13.728 8.956) 16.505 11.280 ( 0.846 -4.904 -3.903) 6.324 11.614 ( -2.811 3.902 0.087) 4.810 11.745 ( 1.245 11.638 2.505) 11.970 12.614 ( 1.451 5.844 -27.187) 27.846 13.729 ( 0.214 -2.507 -1.181) 2.780 13.877 ( -2.404 -0.201 -4.544) 5.145 18.936 ( 1.166 -4.275 1.546) 4.693 18.989 ( -0.721 2.700 -1.223) 3.051 19.628 ( -1.165 -2.200 0.280) 2.505 19.758 ( 1.399 4.207 -19.441) 19.940 20.868 ( -0.222 -40.915 69.992) 81.074 21.100 ( -0.017 -1.101 3.134) 3.321 27.434 ( 0.043 2.341 -0.316) 2.363 27.742 ( -0.179 -1.279 0.299) 1.326 36.797 ( 3.354 -3.301 -3.025) 5.594 36.997 ( -0.036 7.521 -0.493) 7.537 37.136 ( -3.736 11.627 1.058) 12.258 40.660 ( 0.411 69.941 -130.398) 147.972 ======================= Grid point 15 (9/371) ======================= q-point: ( 0.15 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.368 ( 7.837 30.452 24.614) 39.933 1.656 ( 13.081 45.999 6.778) 48.300 2.766 ( 41.301 54.170 15.835) 69.934 6.105 ( -3.796 2.216 -3.516) 5.629 6.533 ( 4.833 5.619 -7.898) 10.831 7.169 ( -7.786 -17.293 23.798) 30.431 7.438 ( 12.103 -5.202 -10.609) 16.914 7.793 ( -3.469 17.305 3.519) 17.996 8.778 ( -4.383 8.327 -0.027) 9.410 8.878 ( 12.491 -4.441 6.416) 14.728 9.649 ( -1.698 -7.814 -4.094) 8.984 9.821 ( -4.066 -9.392 7.287) 12.564 11.234 ( 1.017 -6.242 0.124) 6.325 11.703 ( 2.957 9.256 -4.666) 10.780 11.859 ( 3.153 10.685 1.512) 11.243 12.623 ( 7.328 -5.882 -9.950) 13.685 13.540 ( -25.801 -6.698 -4.335) 27.007 13.690 ( -3.102 -3.889 -1.241) 5.127 18.907 ( -6.993 0.395 -0.533) 7.025 19.007 ( 6.165 -2.284 1.581) 6.761 19.537 ( -4.250 -3.456 -3.614) 6.563 19.734 ( 1.694 -1.366 -11.561) 11.764 20.760 ( -7.822 -18.227 37.898) 42.774 21.098 ( -0.778 -1.602 3.532) 3.955 27.475 ( 1.891 3.280 -0.471) 3.815 27.720 ( -0.797 -1.224 -0.334) 1.498 36.843 ( 2.634 -0.294 1.079) 2.862 37.145 ( 11.363 6.283 3.238) 13.382 37.267 ( 4.436 14.640 -5.045) 16.108 40.755 ( 10.377 26.382 -71.411) 76.833 ======================= Grid point 16 (10/371) ======================= q-point: ( 0.23 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.955 ( 17.165 25.873 19.608) 36.722 2.386 ( 22.586 39.307 2.769) 45.418 3.879 ( 34.458 33.390 5.948) 48.349 6.117 ( 2.943 5.747 -4.134) 7.667 6.644 ( 4.770 5.054 3.383) 7.729 6.983 ( -4.990 -11.528 5.719) 13.802 7.553 ( 11.413 -8.069 -5.623) 15.066 7.912 ( -2.041 13.022 7.922) 15.378 8.792 ( -1.862 12.601 -11.159) 16.935 9.035 ( 4.970 -9.707 10.032) 14.818 9.554 ( 0.983 -4.528 5.029) 6.838 9.729 ( -3.341 -3.494 5.251) 7.137 11.209 ( 3.978 -9.326 2.752) 10.506 11.760 ( -6.003 16.773 -9.377) 20.132 12.101 ( 13.584 6.690 1.358) 15.203 12.559 ( -11.382 -6.924 6.265) 14.722 12.972 ( -18.724 -14.108 -11.736) 26.218 13.580 ( -4.635 -4.808 -3.041) 7.338 18.760 ( -10.455 0.147 0.163) 10.457 19.089 ( 4.135 -2.971 1.697) 5.367 19.410 ( -3.854 -3.915 -4.930) 7.382 19.666 ( -0.466 -3.343 -7.679) 8.388 20.691 ( -4.265 -8.837 21.529) 23.659 21.079 ( -1.586 -2.227 3.390) 4.355 27.545 ( 2.805 3.653 -0.580) 4.642 27.694 ( -0.759 -0.818 -0.628) 1.280 36.905 ( 2.819 2.649 2.683) 4.708 37.408 ( 4.287 15.089 -0.067) 15.687 37.539 ( 20.746 5.065 -0.357) 21.359 40.721 ( 2.478 9.377 -44.447) 45.493 ======================= Grid point 17 (11/371) ======================= q-point: ( 0.31 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( 21.644 21.466 15.372) 34.140 3.118 ( 23.632 32.487 1.924) 40.219 4.542 ( 21.983 12.821 -3.688) 25.714 6.191 ( 0.525 4.420 -7.574) 8.785 6.628 ( -8.370 -6.182 3.372) 10.939 7.124 ( 18.007 8.498 11.087) 22.790 7.557 ( 1.257 -4.991 -1.379) 5.328 8.092 ( 8.225 6.178 7.253) 12.587 8.804 ( -5.183 9.952 -11.661) 16.183 8.929 ( -3.364 -12.550 0.673) 13.011 9.649 ( 0.158 0.924 9.211) 9.258 9.733 ( 4.298 0.501 9.014) 9.999 11.215 ( 6.404 -10.336 2.759) 12.468 11.697 ( -18.112 16.144 -9.599) 26.092 12.123 ( -23.213 -10.105 7.856) 26.508 12.377 ( 10.916 5.445 -0.941) 12.235 12.758 ( 6.009 -9.680 -6.277) 13.008 13.416 ( -6.947 -5.434 -5.240) 10.259 18.592 ( -9.634 -0.528 0.453) 9.659 19.066 ( -4.080 -3.852 0.859) 5.676 19.307 ( -1.835 -2.145 -4.308) 5.151 19.604 ( 1.493 -4.245 -4.589) 6.427 20.669 ( -1.646 -4.464 12.280) 13.170 21.040 ( -2.355 -2.721 2.717) 4.509 27.621 ( 2.550 3.306 -0.575) 4.214 27.678 ( -0.315 -0.051 -0.698) 0.767 37.007 ( 3.944 3.866 2.831) 6.206 37.591 ( 2.170 14.724 -2.690) 15.125 37.962 ( 24.018 2.798 4.294) 24.558 40.582 ( -1.982 2.970 -30.894) 31.099 ======================= Grid point 18 (12/371) ======================= q-point: ( 0.38 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.194 ( 21.206 16.764 11.521) 29.385 3.751 ( 19.378 24.174 1.267) 31.008 4.907 ( 19.461 2.185 -4.315) 20.053 6.071 ( -9.373 -3.916 -9.100) 13.638 6.513 ( -1.040 -1.560 0.988) 2.119 7.310 ( -8.046 2.128 2.321) 8.640 7.790 ( 20.505 6.594 13.379) 25.356 8.343 ( 12.395 3.551 4.578) 13.682 8.626 ( -9.830 -8.148 3.650) 13.279 8.834 ( -1.863 5.107 -17.649) 18.468 9.656 ( -4.038 2.517 5.222) 7.065 9.794 ( -6.372 -4.468 6.917) 10.412 11.269 ( 7.561 -2.803 4.276) 9.127 11.437 ( -13.364 1.764 6.714) 15.060 11.908 ( -4.440 -0.035 -3.635) 5.738 12.472 ( 0.207 -1.350 -6.148) 6.298 12.823 ( 7.797 -0.925 1.449) 7.984 13.212 ( -7.818 -4.754 -6.055) 10.972 18.460 ( -5.897 -0.012 0.337) 5.907 18.916 ( -9.231 -3.680 0.119) 9.938 19.274 ( 1.481 -0.109 -2.963) 3.314 19.572 ( 1.467 -5.341 -2.186) 5.955 20.678 ( 0.259 -1.587 6.433) 6.631 20.981 ( -2.883 -2.945 1.762) 4.483 27.677 ( 0.048 1.420 -1.188) 1.852 27.679 ( 1.588 1.761 0.188) 2.379 37.123 ( 3.495 4.399 2.150) 6.016 37.722 ( 0.771 10.477 -2.083) 10.710 38.385 ( 21.483 2.092 4.910) 22.136 40.413 ( -3.412 0.139 -21.355) 21.627 ======================= Grid point 19 (13/371) ======================= q-point: ( 0.46 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.666 ( 14.061 9.909 6.049) 18.234 4.174 ( 9.807 12.692 -0.092) 16.039 5.198 ( 18.490 -3.916 -1.730) 18.979 5.823 ( -9.090 -4.075 -4.396) 10.889 6.531 ( 2.464 -0.129 0.015) 2.467 7.190 ( -10.371 7.862 -0.732) 13.034 8.078 ( 3.797 -9.357 8.564) 13.240 8.504 ( -1.661 6.182 15.266) 16.553 8.620 ( 15.165 -0.625 -6.801) 16.632 8.741 ( -5.547 7.814 -16.372) 18.971 9.496 ( -16.865 -6.025 2.193) 18.043 9.659 ( -4.253 0.347 4.487) 6.192 11.409 ( 6.465 -9.187 8.793) 14.266 11.501 ( 9.300 8.379 8.666) 15.225 11.846 ( -1.188 1.587 -3.647) 4.151 12.323 ( -8.847 -4.502 -9.285) 13.592 12.926 ( 2.649 1.298 -0.128) 2.952 13.057 ( -3.563 -1.471 -2.067) 4.374 18.418 ( -0.438 2.053 0.217) 2.110 18.728 ( -9.650 -2.570 0.211) 9.989 19.320 ( 4.797 0.986 -1.838) 5.231 19.514 ( -0.982 -6.230 -0.967) 6.380 20.710 ( 1.257 0.219 2.734) 3.017 20.914 ( -2.653 -2.738 0.792) 3.894 27.686 ( -0.025 1.261 -0.574) 1.386 27.711 ( 0.520 1.395 0.134) 1.495 37.215 ( 1.460 4.585 0.759) 4.872 37.785 ( -1.141 4.672 -0.252) 4.816 38.723 ( 14.678 1.850 1.837) 14.907 40.275 ( -1.711 -1.422 -11.297) 11.514 ======================= Grid point 20 (14/371) ======================= q-point: (-0.46 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.829 ( -2.504 0.094 -1.923) 3.158 4.279 ( -3.228 -0.957 -1.373) 3.636 5.364 ( 9.174 -10.901 -0.819) 14.271 5.739 ( 1.530 3.318 3.915) 5.355 6.561 ( 1.360 -1.847 0.839) 2.442 7.147 ( -7.487 16.396 -3.228) 18.311 7.989 ( 1.386 -11.446 -0.758) 11.554 8.531 ( -10.324 -0.039 -10.226) 14.531 8.732 ( 2.198 10.852 6.284) 12.731 8.778 ( 4.708 -0.100 2.479) 5.322 9.320 ( 1.595 -2.189 3.548) 4.463 9.614 ( -5.415 1.879 3.711) 6.828 11.479 ( 1.924 -6.825 3.672) 7.985 11.593 ( 1.702 -4.446 -5.859) 7.550 11.811 ( -6.950 -4.315 -3.998) 9.105 12.239 ( 6.714 7.417 6.686) 12.033 12.923 ( -1.607 -0.455 -1.580) 2.299 13.055 ( 1.289 3.077 0.806) 3.432 18.482 ( 3.181 4.923 0.546) 5.887 18.579 ( -5.568 -1.063 0.220) 5.673 19.394 ( 1.610 -3.448 -0.149) 3.808 19.442 ( 2.295 -1.983 -1.192) 3.259 20.728 ( -0.833 -0.109 -0.053) 0.842 20.872 ( 0.339 -1.119 0.225) 1.191 27.686 ( -0.719 0.329 -0.019) 0.791 27.728 ( -0.152 1.499 0.259) 1.529 37.257 ( -1.535 4.561 -1.170) 4.952 37.769 ( -3.283 -1.471 2.284) 4.262 38.881 ( 3.121 1.586 -5.379) 6.418 40.245 ( 3.927 -1.996 1.327) 4.600 ======================= Grid point 21 (15/371) ======================= q-point: (-0.38 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.583 ( -18.720 -7.633 -6.674) 21.290 4.061 ( -15.645 -9.830 -0.736) 18.492 5.275 ( -3.147 -14.059 -0.586) 14.419 5.956 ( 10.684 9.001 9.216) 16.736 6.542 ( -1.812 -2.903 2.408) 4.184 7.208 ( -2.977 18.279 -5.097) 19.208 7.958 ( 7.462 -8.783 -11.171) 16.050 8.206 ( -18.150 -0.907 -9.766) 20.631 8.815 ( 0.998 -9.585 8.699) 12.982 8.906 ( 1.386 8.808 9.092) 12.735 9.461 ( 4.937 4.455 3.307) 7.426 9.588 ( 1.950 3.197 -0.027) 3.745 11.199 ( -13.539 -7.188 -14.453) 21.067 11.662 ( 6.436 -6.601 4.816) 10.401 11.697 ( 0.743 1.773 -1.862) 2.676 12.498 ( 6.900 4.688 9.541) 12.674 12.869 ( -2.204 -2.688 -1.905) 3.964 13.150 ( 4.651 5.847 2.176) 7.782 18.493 ( -3.615 3.499 1.737) 5.323 18.653 ( 8.697 4.291 -0.545) 9.713 19.327 ( -1.507 -4.314 1.210) 4.727 19.522 ( 6.051 -1.006 -1.109) 6.233 20.679 ( -2.911 -1.213 -2.532) 4.044 20.905 ( 3.026 0.683 -0.331) 3.119 27.671 ( -0.990 -0.920 0.820) 1.580 27.734 ( -1.213 1.804 -0.027) 2.174 37.237 ( -4.567 4.240 -3.255) 7.030 37.678 ( -5.435 -6.593 5.004) 9.902 38.795 ( -8.724 0.084 -11.254) 14.240 40.381 ( 9.586 -0.804 11.811) 15.233 ======================= Grid point 22 (16/371) ======================= q-point: (-0.31 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.072 ( -27.421 -11.601 -6.485) 30.472 3.611 ( -26.773 -11.229 0.994) 29.049 5.045 ( -10.328 -11.579 0.869) 15.540 6.246 ( 5.352 7.235 10.216) 13.615 6.495 ( -0.244 -2.100 1.906) 2.847 7.317 ( -0.564 14.572 -7.183) 16.256 7.654 ( -18.256 -9.240 -17.050) 26.634 8.119 ( 5.546 1.057 -4.823) 7.425 8.700 ( -3.682 -18.060 9.412) 20.695 9.035 ( -0.259 10.645 3.945) 11.355 9.493 ( -1.028 0.255 4.315) 4.443 9.692 ( 1.555 0.772 -7.262) 7.467 11.003 ( 4.332 -4.232 -4.555) 7.578 11.715 ( -0.758 16.004 -3.880) 16.485 11.807 ( 8.193 -3.600 6.075) 10.816 12.611 ( 0.335 -2.729 7.617) 8.098 12.784 ( -0.418 -5.088 -2.988) 5.915 13.325 ( 7.332 5.683 3.287) 9.842 18.524 ( 0.804 5.903 2.035) 6.295 18.841 ( 9.203 3.663 -0.415) 9.914 19.307 ( 1.379 -1.310 2.285) 2.973 19.590 ( 5.136 -2.841 -0.290) 5.876 20.601 ( -2.632 -1.191 -5.319) 6.053 20.961 ( 3.170 0.920 -0.977) 3.443 27.647 ( -1.152 -1.845 1.573) 2.684 27.722 ( -2.097 1.905 -0.566) 2.889 37.159 ( -6.612 3.227 -4.862) 8.819 37.528 ( -7.453 -9.119 7.199) 13.803 38.515 ( -16.178 -1.999 -12.179) 20.349 40.633 ( 11.340 1.127 16.901) 20.384 ======================= Grid point 23 (17/371) ======================= q-point: (-0.23 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.442 ( -31.717 -12.816 -4.401) 34.490 3.015 ( -36.051 -7.930 2.600) 37.004 4.663 ( -27.769 -11.173 -0.004) 29.932 6.255 ( -8.546 -1.099 6.282) 10.663 6.586 ( 6.094 1.950 0.875) 6.458 7.124 ( -15.461 -4.199 -11.478) 19.708 7.494 ( 3.482 8.126 -9.506) 12.981 8.146 ( -3.224 2.333 -6.181) 7.351 8.542 ( 1.341 -19.180 14.583) 24.131 9.172 ( 4.359 11.863 -1.877) 12.777 9.453 ( -7.774 -3.519 -3.201) 9.114 9.612 ( 1.053 -1.590 -3.713) 4.174 11.094 ( 10.203 -8.238 1.768) 13.232 11.822 ( -6.168 12.973 4.912) 15.181 12.025 ( 12.143 12.698 -5.500) 18.410 12.506 ( -9.553 -1.418 1.041) 9.713 12.849 ( 15.917 -9.305 6.382) 19.511 13.499 ( 6.601 3.786 1.697) 7.797 18.641 ( 3.728 8.012 2.234) 9.115 18.987 ( 6.226 -0.445 -0.402) 6.255 19.369 ( 4.337 1.313 2.349) 5.104 19.650 ( 5.750 -2.764 1.907) 6.659 20.516 ( -1.999 -1.045 -8.820) 9.104 21.011 ( 2.657 0.683 -1.260) 3.019 27.609 ( -2.585 -1.923 1.593) 3.594 27.706 ( -1.137 1.518 -0.765) 2.045 37.041 ( -6.803 0.899 -5.082) 8.539 37.351 ( -9.134 -7.364 7.937) 14.165 38.133 ( -19.707 -3.589 -10.428) 22.583 40.924 ( 10.581 2.383 18.650) 21.575 ======================= Grid point 24 (18/371) ======================= q-point: (-0.15 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.777 ( -34.017 -10.662 -1.823) 35.695 2.335 ( -43.054 -2.370 3.202) 43.238 3.843 ( -57.014 -12.874 -4.538) 58.625 6.164 ( -3.415 0.620 2.130) 4.072 6.658 ( -0.056 0.520 7.758) 7.776 6.898 ( -1.397 -3.983 -13.374) 14.025 7.563 ( 0.795 7.791 -8.770) 11.758 7.993 ( -8.737 -6.862 -1.397) 11.197 8.552 ( 1.906 -3.680 14.856) 15.423 9.170 ( -12.296 -2.306 -9.805) 15.895 9.420 ( 13.337 4.791 -0.847) 14.197 9.664 ( 4.163 0.237 1.068) 4.304 11.161 ( 7.123 -7.578 1.053) 10.453 11.828 ( -9.772 12.384 3.367) 16.130 12.076 ( -8.869 -5.219 -2.765) 10.655 12.514 ( 8.305 5.286 -1.892) 10.025 13.184 ( 24.485 0.116 7.757) 25.685 13.625 ( 5.260 1.892 -0.050) 5.590 18.800 ( 4.427 7.919 2.227) 9.341 19.018 ( 1.542 -4.833 -0.876) 5.148 19.476 ( 5.362 1.787 1.078) 5.754 19.761 ( 7.716 -0.853 5.425) 9.471 20.424 ( -1.764 -0.886 -11.604) 11.771 21.047 ( 1.967 0.338 -0.963) 2.216 27.546 ( -3.944 -1.077 0.817) 4.170 27.709 ( 0.500 0.675 -0.448) 0.952 36.914 ( -4.862 -2.409 -3.000) 6.200 37.191 ( -9.974 -0.829 6.448) 11.906 37.723 ( -19.833 -4.322 -7.745) 21.726 41.200 ( 8.952 2.248 16.772) 19.144 ======================= Grid point 25 (19/371) ======================= q-point: (-0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.144 ( -35.241 -1.699 1.173) 35.301 1.608 ( -47.589 2.125 -0.097) 47.637 2.645 ( -75.297 -0.661 -0.496) 75.301 6.153 ( 0.093 0.919 -3.272) 3.400 6.731 ( -0.455 -0.584 11.991) 12.014 6.804 ( 3.356 -1.202 -8.570) 9.282 7.578 ( -3.125 6.957 -3.708) 8.481 7.757 ( -10.013 -7.425 -2.451) 12.704 8.636 ( -1.693 3.517 12.108) 12.721 8.934 ( -6.117 -2.790 -7.369) 9.975 9.690 ( 14.328 1.148 0.439) 14.381 9.734 ( 3.489 -0.277 1.874) 3.970 11.224 ( 6.108 -1.497 1.139) 6.391 11.773 ( -10.916 8.059 -3.543) 14.024 11.826 ( -10.402 -5.851 2.087) 12.116 12.690 ( 10.365 -1.742 2.282) 10.755 13.598 ( 19.404 0.541 -1.738) 19.489 13.712 ( 5.231 0.398 -1.721) 5.522 18.913 ( 3.746 -4.030 0.265) 5.509 18.990 ( -1.099 4.021 0.474) 4.195 19.568 ( 4.465 0.030 -0.890) 4.553 19.917 ( 7.703 -0.065 2.075) 7.978 20.338 ( -2.273 -0.043 -1.344) 2.641 21.072 ( 1.274 -0.001 -0.028) 1.274 27.479 ( -3.668 -0.018 0.158) 3.672 27.725 ( 1.151 0.026 -0.273) 1.183 36.827 ( -1.197 -3.098 0.905) 3.442 37.088 ( -9.242 6.568 3.742) 11.940 37.348 ( -16.848 -3.596 -5.146) 17.980 41.402 ( 7.159 0.101 0.473) 7.175 ======================= Grid point 27 (20/371) ======================= q-point: ( 0.08 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.333 ( -10.182 28.475 22.461) 37.669 1.665 ( -9.202 46.796 8.110) 48.377 2.779 ( -42.667 54.674 16.298) 71.242 6.202 ( 8.646 4.273 1.434) 9.750 6.455 ( -9.605 3.752 -10.113) 14.443 7.074 ( 1.648 -13.569 8.070) 15.873 7.632 ( -4.667 -1.085 10.123) 11.199 7.854 ( -3.020 13.750 5.884) 15.258 8.469 ( 5.167 -3.292 -8.052) 10.118 9.044 ( -9.983 2.866 6.122) 12.056 9.629 ( 3.294 -8.512 -5.319) 10.564 9.777 ( 5.009 -8.988 5.209) 11.533 11.197 ( -0.923 -8.470 -2.341) 8.835 11.766 ( 1.907 11.520 -2.612) 11.965 11.841 ( -6.634 10.962 2.306) 13.019 12.574 ( -7.153 -8.886 -10.974) 15.829 13.579 ( 18.909 -5.412 -3.471) 19.972 13.733 ( 7.691 -1.760 0.624) 7.915 18.898 ( 2.957 -2.783 -1.135) 4.216 18.996 ( -1.530 -0.074 1.201) 1.946 19.570 ( 4.805 -2.124 -0.910) 5.331 19.696 ( -2.329 -3.037 -13.524) 14.056 20.769 ( 7.473 -17.540 37.386) 41.966 21.099 ( 0.744 -1.560 3.645) 4.034 27.471 ( -1.700 2.887 -0.687) 3.420 27.728 ( 0.611 -0.811 0.050) 1.017 36.813 ( -8.630 -2.890 -0.981) 9.154 37.036 ( 3.044 10.389 -2.851) 11.195 37.423 ( -13.469 13.549 4.421) 19.610 40.739 ( -9.818 25.985 -72.695) 77.822 ======================= Grid point 28 (21/371) ======================= q-point: ( 0.15 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.710 ( 3.106 32.811 20.857) 39.003 2.137 ( -2.212 41.057 20.444) 45.919 3.051 ( -0.051 64.250 12.026) 65.365 6.250 ( -11.683 3.913 -4.457) 13.103 6.432 ( 10.087 5.782 -4.122) 12.336 7.048 ( 7.781 -13.934 6.595) 17.268 7.407 ( -14.530 -8.513 2.101) 16.971 8.028 ( -0.349 17.290 4.830) 17.955 8.638 ( 15.474 0.669 -0.520) 15.498 8.927 ( -7.750 3.009 2.117) 8.578 9.539 ( 0.360 -10.392 -3.958) 11.126 9.761 ( 1.795 -9.860 3.471) 10.607 11.180 ( 2.976 -1.520 -3.198) 4.626 11.719 ( -3.663 6.646 0.089) 7.589 12.007 ( -1.090 13.403 1.664) 13.550 12.377 ( 3.921 -10.524 -8.480) 14.073 13.640 ( 1.302 -5.317 -1.690) 5.729 13.798 ( -5.650 -6.848 1.798) 9.058 18.849 ( 2.597 -7.104 2.768) 8.054 19.037 ( -1.318 3.615 -1.564) 4.153 19.541 ( -3.980 -4.815 -8.234) 10.336 19.618 ( 4.194 -3.077 -4.693) 7.005 20.813 ( -0.450 -19.913 30.361) 36.312 21.107 ( -0.078 -2.448 4.228) 4.886 27.488 ( 0.372 3.774 -0.715) 3.859 27.718 ( -0.543 -1.095 -0.173) 1.234 36.746 ( 3.505 1.018 -2.879) 4.649 37.183 ( 1.206 13.081 -2.098) 13.303 37.382 ( -5.614 13.484 0.956) 14.637 40.607 ( 0.886 30.024 -61.854) 68.761 ======================= Grid point 29 (22/371) ======================= q-point: ( 0.23 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.197 ( 5.180 30.704 22.615) 38.484 2.587 ( 3.652 40.417 12.540) 42.475 3.845 ( 18.469 45.485 6.279) 49.491 6.141 ( -2.517 6.419 -6.624) 9.561 6.614 ( 7.560 7.555 1.436) 10.784 7.002 ( -6.647 -17.152 8.666) 20.334 7.247 ( 8.881 -4.074 -7.076) 12.064 8.163 ( -4.802 12.945 6.019) 15.062 8.816 ( 3.881 4.765 -11.231) 12.802 8.942 ( 4.063 -0.412 9.190) 10.056 9.456 ( 3.093 -7.836 3.051) 8.959 9.712 ( 1.230 -7.624 2.268) 8.048 11.162 ( -1.834 -1.922 0.371) 2.682 11.827 ( 6.705 7.308 -2.931) 10.342 12.065 ( -1.287 7.754 1.330) 7.971 12.403 ( 10.810 -7.026 -3.972) 13.491 13.382 ( -32.236 -9.885 2.843) 33.837 13.578 ( -2.939 -5.675 -2.927) 7.029 18.870 ( 1.665 -5.326 2.108) 5.965 19.007 ( -1.538 0.853 0.401) 1.803 19.387 ( -3.024 -5.380 -9.135) 11.025 19.602 ( 0.314 -4.103 -3.417) 5.349 20.754 ( -2.730 -13.165 20.562) 24.567 21.094 ( -0.921 -3.142 3.907) 5.097 27.542 ( 1.886 4.332 -0.756) 4.785 27.695 ( -0.762 -0.825 -0.438) 1.206 36.862 ( 7.807 2.064 -0.430) 8.086 37.343 ( 6.924 12.575 0.387) 14.360 37.504 ( 2.820 14.479 -3.171) 15.088 40.583 ( 1.168 17.030 -44.652) 47.804 ======================= Grid point 30 (23/371) ======================= q-point: ( 0.31 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.686 ( 7.812 27.704 20.981) 35.619 3.148 ( 14.261 34.383 7.128) 37.899 4.402 ( 11.127 20.469 -3.403) 23.545 6.183 ( 1.587 6.090 -8.133) 10.284 6.724 ( -10.055 -11.244 5.069) 15.913 6.963 ( 19.801 13.460 6.789) 24.886 7.358 ( 10.299 -5.249 -4.025) 12.240 8.184 ( -4.942 3.778 6.519) 9.011 8.821 ( 1.637 -1.701 -12.079) 12.307 8.963 ( -6.043 5.320 0.640) 8.076 9.582 ( 10.462 -2.860 11.054) 15.486 9.706 ( 3.316 -2.897 4.244) 6.115 11.125 ( -0.201 -3.272 4.287) 5.397 11.892 ( -2.066 3.642 -7.375) 8.481 12.236 ( 10.611 5.987 3.344) 12.634 12.504 ( 9.470 -4.355 -3.151) 10.889 12.680 ( -41.281 -8.296 4.954) 42.397 13.439 ( -5.333 -5.652 -4.817) 9.143 18.759 ( -9.496 -2.097 1.253) 9.805 19.041 ( 2.946 -3.223 1.582) 4.644 19.268 ( -0.162 -3.853 -7.865) 8.760 19.527 ( -1.303 -5.250 -3.021) 6.195 20.705 ( -1.708 -7.611 12.877) 15.055 21.058 ( -1.727 -3.623 3.073) 5.055 27.615 ( 2.238 4.237 -0.627) 4.833 27.678 ( -0.319 -0.106 -0.623) 0.708 37.001 ( 5.073 4.554 1.954) 7.092 37.650 ( 12.897 11.428 -8.508) 19.218 37.681 ( 8.229 10.972 5.754) 14.873 40.493 ( -1.630 7.514 -32.236) 33.140 ======================= Grid point 31 (24/371) ======================= q-point: ( 0.38 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.180 ( 11.372 22.811 15.546) 29.855 3.719 ( 16.023 25.775 5.386) 30.823 4.653 ( 11.031 5.186 -5.523) 13.382 6.135 ( -6.408 -0.113 -9.477) 11.440 6.529 ( -4.138 -6.733 3.896) 8.811 7.407 ( 2.889 -1.488 -5.331) 6.244 7.547 ( 23.585 16.163 10.941) 30.614 8.185 ( 3.630 -5.014 2.611) 6.718 8.702 ( -3.027 -8.365 -3.802) 9.674 8.932 ( -8.233 15.154 -5.986) 18.255 9.684 ( 3.226 -3.420 4.100) 6.238 9.833 ( 3.266 -0.847 8.832) 9.455 11.166 ( 4.602 -1.659 8.263) 9.603 11.761 ( -13.300 -2.565 -5.146) 14.490 12.032 ( -21.862 -8.708 8.791) 25.121 12.434 ( 2.871 5.257 -4.947) 7.769 12.664 ( 10.656 2.401 1.187) 10.987 13.258 ( -6.910 -4.458 -6.263) 10.337 18.591 ( -8.971 -1.193 1.282) 9.140 18.998 ( -4.720 -2.942 -0.362) 5.574 19.231 ( 1.795 -1.443 -4.133) 4.732 19.456 ( 1.952 -7.207 -2.503) 7.875 20.689 ( -0.198 -3.593 7.401) 8.229 21.003 ( -2.395 -3.784 2.024) 4.914 27.676 ( 0.551 1.100 0.788) 1.461 27.683 ( 1.238 3.208 -1.798) 3.880 37.135 ( 3.575 6.260 2.474) 7.622 37.790 ( 1.642 9.983 -4.745) 11.175 38.079 ( 21.230 6.287 3.220) 22.374 40.354 ( -2.825 1.853 -22.998) 23.245 ======================= Grid point 32 (25/371) ======================= q-point: ( 0.46 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.609 ( 10.579 15.300 8.177) 20.319 4.163 ( 9.940 16.388 2.989) 19.399 4.857 ( 15.742 -3.590 -1.715) 16.237 5.925 ( -10.275 -2.737 -4.743) 11.643 6.490 ( 1.380 -2.812 2.354) 3.918 7.394 ( -3.824 8.610 -5.474) 10.896 7.961 ( 7.172 -2.770 6.512) 10.075 8.275 ( 16.647 -3.170 -7.884) 18.690 8.613 ( -0.017 -1.182 4.316) 4.475 8.911 ( -8.538 15.028 -2.720) 17.496 9.712 ( -2.439 -3.813 3.581) 5.771 9.732 ( -12.041 -3.122 2.265) 12.644 11.259 ( 3.687 -10.305 9.395) 14.424 11.582 ( -2.096 6.544 7.925) 10.489 11.842 ( -3.020 -4.578 2.958) 6.231 12.389 ( -7.245 0.999 -8.744) 11.400 12.857 ( 8.069 2.869 0.233) 8.567 13.098 ( -5.019 -1.219 -4.550) 6.883 18.485 ( -4.535 1.365 1.155) 4.875 18.855 ( -8.612 -2.378 -0.524) 8.949 19.249 ( 3.133 0.307 -2.263) 3.877 19.416 ( 2.946 -8.632 -1.908) 9.318 20.706 ( 1.039 -0.729 3.726) 3.936 20.933 ( -2.746 -3.657 1.028) 4.687 27.694 ( 0.454 1.489 -0.244) 1.575 27.722 ( 0.411 2.465 -0.286) 2.515 37.253 ( 1.766 7.074 1.537) 7.451 37.849 ( -0.990 4.957 -1.770) 5.356 38.477 ( 18.972 4.972 0.804) 19.629 40.217 ( -1.615 -1.701 -14.292) 14.484 ======================= Grid point 33 (26/371) ======================= q-point: ( 0.54 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.844 ( 2.259 5.540 -0.083) 5.984 4.335 ( -2.309 4.800 -0.198) 5.331 5.052 ( 14.659 -10.116 0.613) 17.821 5.788 ( -2.779 1.667 2.201) 3.918 6.512 ( 2.459 -2.611 2.138) 4.175 7.416 ( -4.929 18.319 -6.604) 20.087 7.884 ( -3.369 -11.111 -2.162) 11.810 8.462 ( 11.619 -4.071 -9.331) 15.448 8.724 ( 4.305 5.266 5.823) 8.954 8.930 ( -5.351 13.450 3.410) 14.871 9.379 ( -14.415 -9.039 3.304) 17.333 9.733 ( -2.434 1.795 4.596) 5.502 11.282 ( 8.762 -11.336 7.848) 16.336 11.609 ( -4.684 -0.551 -5.782) 7.461 11.838 ( -4.312 -5.016 3.167) 7.334 12.266 ( 0.813 6.887 1.202) 7.038 12.956 ( -0.705 3.418 -2.145) 4.097 13.044 ( 1.756 0.473 -0.835) 2.001 18.488 ( 0.919 4.141 0.726) 4.303 18.697 ( -8.168 -0.767 0.286) 8.209 19.304 ( 4.233 -1.716 -1.083) 4.694 19.368 ( 2.129 -6.652 -1.683) 7.185 20.737 ( 0.546 0.576 1.160) 1.406 20.864 ( -1.601 -3.007 0.388) 3.428 27.706 ( -0.711 1.304 -0.297) 1.515 27.746 ( 0.212 1.841 0.350) 1.886 37.331 ( -1.027 7.190 -0.613) 7.289 37.834 ( -3.548 -0.199 2.092) 4.123 38.761 ( 10.805 4.010 -4.841) 12.500 40.151 ( 3.256 -3.497 -3.896) 6.165 ======================= Grid point 34 (27/371) ======================= q-point: (-0.38 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.764 ( -12.353 -2.336 -4.368) 13.309 4.205 ( -11.783 -3.641 -1.685) 12.447 5.097 ( 5.514 -15.043 -0.744) 16.039 5.917 ( 8.936 7.759 6.576) 13.539 6.533 ( 1.125 -2.445 3.092) 4.100 7.493 ( -7.134 24.031 -7.206) 26.083 7.732 ( 1.700 -9.950 -7.679) 12.683 8.409 ( -9.611 -3.165 -5.856) 11.691 8.770 ( -3.289 -5.377 5.987) 8.693 9.029 ( -0.319 9.490 9.343) 13.321 9.322 ( 12.169 -0.727 1.987) 12.351 9.711 ( -6.099 3.052 4.394) 8.113 11.326 ( -16.318 -5.065 -12.918) 21.420 11.420 ( 11.627 -7.668 2.909) 14.228 11.680 ( -0.731 -5.786 -0.757) 5.881 12.500 ( 6.649 8.142 9.684) 14.292 12.902 ( -4.438 -0.377 -1.147) 4.600 13.128 ( 4.915 3.983 -0.489) 6.345 18.550 ( 0.360 -0.681 -0.452) 0.893 18.635 ( -0.126 7.971 1.849) 8.184 19.285 ( 0.983 -6.606 0.408) 6.691 19.401 ( 5.525 -1.621 -1.930) 6.073 20.711 ( -3.354 -0.983 -1.128) 3.672 20.860 ( 2.551 -0.433 0.324) 2.608 27.692 ( -1.658 0.088 0.374) 1.702 27.766 ( -0.299 1.974 0.156) 2.003 37.341 ( -4.238 5.846 -3.369) 7.968 37.760 ( -5.977 -3.235 6.437) 9.361 38.822 ( -1.411 1.320 -11.350) 11.513 40.243 ( 10.801 -2.330 6.019) 12.583 ======================= Grid point 35 (28/371) ======================= q-point: (-0.31 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.387 ( -24.729 -6.754 -3.394) 25.859 3.915 ( -18.737 -3.260 -0.813) 19.036 4.990 ( 0.164 -13.727 -1.395) 13.799 6.214 ( 12.564 7.704 5.572) 15.756 6.529 ( -2.394 -0.951 4.815) 5.461 7.523 ( -8.644 18.518 -5.622) 21.195 7.646 ( -0.938 -6.703 -16.074) 17.441 8.162 ( -10.983 1.792 -0.911) 11.166 8.626 ( -4.696 -19.523 10.001) 22.433 9.163 ( 0.392 8.571 7.471) 11.377 9.557 ( 6.256 2.675 0.369) 6.813 9.649 ( -4.094 1.726 0.815) 4.517 10.975 ( -8.449 -2.034 -10.041) 13.280 11.607 ( 14.365 -5.907 5.343) 16.425 11.718 ( 8.169 4.001 -3.200) 9.643 12.609 ( -2.516 -0.611 5.759) 6.314 12.816 ( -4.887 -1.001 -1.431) 5.190 13.269 ( 7.043 4.478 0.902) 8.395 18.545 ( 1.593 -0.264 0.928) 1.862 18.785 ( 4.999 9.219 0.875) 10.524 19.266 ( 2.270 -3.479 1.643) 4.468 19.457 ( 5.614 -3.628 -1.847) 6.935 20.626 ( -4.188 -1.319 -2.472) 5.038 20.911 ( 3.285 0.350 -0.193) 3.309 27.664 ( -1.692 -0.796 1.083) 2.161 27.769 ( -1.535 1.770 -0.381) 2.374 37.266 ( -6.670 1.927 -4.679) 8.372 37.657 ( -8.511 -1.783 9.253) 12.697 38.647 ( -10.742 -2.261 -13.178) 17.151 40.493 ( 14.859 0.263 9.868) 17.839 ======================= Grid point 36 (29/371) ======================= q-point: (-0.23 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.848 ( -31.007 -6.882 -0.877) 31.774 3.522 ( -28.378 0.655 0.921) 28.400 4.840 ( -6.488 -8.589 -1.121) 10.823 6.468 ( -1.929 -2.502 2.277) 3.894 6.478 ( 2.744 7.644 4.999) 9.537 7.302 ( -19.542 -7.711 -12.116) 24.251 7.546 ( -2.551 13.777 -7.991) 16.130 8.142 ( -0.801 3.756 -4.885) 6.214 8.420 ( 0.500 -20.170 15.799) 25.626 9.265 ( -1.416 8.379 4.410) 9.574 9.548 ( -5.735 -0.474 -0.572) 5.783 9.583 ( -2.855 -1.856 -4.321) 5.501 10.939 ( 4.598 -0.053 0.058) 4.598 11.817 ( 12.706 -3.320 6.387) 14.603 12.000 ( 15.820 16.089 -6.137) 23.384 12.530 ( -2.671 -10.068 4.985) 11.548 12.690 ( -6.818 -0.763 -3.589) 7.743 13.424 ( 7.014 2.656 -0.027) 7.500 18.613 ( 5.910 -0.332 1.603) 6.132 18.939 ( 3.396 6.676 0.394) 7.500 19.312 ( 4.230 -0.358 1.773) 4.600 19.511 ( 6.840 -3.666 -0.851) 7.807 20.531 ( -4.287 -0.947 -3.181) 5.422 20.965 ( 3.020 0.256 -0.394) 3.056 27.635 ( -1.646 -1.076 1.562) 2.512 27.746 ( -2.378 1.282 -1.067) 2.904 37.124 ( -7.483 -2.535 -2.966) 8.439 37.551 ( -10.922 3.167 8.973) 14.486 38.326 ( -15.964 -4.659 -11.656) 20.308 40.798 ( 15.029 1.556 8.328) 17.252 ======================= Grid point 37 (30/371) ======================= q-point: (-0.15 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( -33.826 -2.082 1.734) 33.935 3.014 ( -37.367 3.859 0.873) 37.576 4.503 ( -30.571 -2.402 -1.909) 30.724 6.320 ( -12.332 2.522 1.972) 12.741 6.631 ( 6.434 1.324 0.952) 6.637 6.911 ( -12.377 -5.509 -5.803) 14.739 7.612 ( 0.771 13.091 -10.382) 16.726 7.984 ( -6.621 -14.504 3.370) 16.296 8.555 ( 10.134 2.295 15.373) 18.555 9.284 ( -10.625 -5.824 -8.167) 14.612 9.360 ( -0.886 6.998 1.190) 7.153 9.610 ( 3.150 0.001 2.954) 4.318 11.032 ( 5.468 0.343 2.209) 5.907 12.005 ( 5.274 3.344 5.487) 8.313 12.192 ( -7.803 3.969 -6.770) 11.066 12.408 ( 1.043 -15.454 5.847) 16.556 12.776 ( 21.685 8.012 -7.078) 24.177 13.540 ( 6.112 0.511 -1.650) 6.352 18.719 ( 7.618 -4.457 1.288) 8.920 19.015 ( 0.192 4.466 0.134) 4.472 19.397 ( 5.267 0.340 -0.633) 5.316 19.624 ( 9.204 -0.553 1.342) 9.318 20.443 ( -4.092 -0.103 -1.168) 4.257 21.010 ( 2.530 -0.013 -0.060) 2.531 27.601 ( -2.797 -0.426 1.331) 3.127 27.715 ( -1.326 0.427 -1.321) 1.920 36.966 ( -6.628 -3.887 0.164) 7.686 37.458 ( -12.288 8.434 7.173) 16.540 37.943 ( -18.227 -5.227 -8.914) 20.953 41.069 ( 13.080 0.576 1.475) 13.175 ======================= Grid point 38 (31/371) ======================= q-point: (-0.08 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.759 ( -33.840 7.934 4.401) 35.035 2.385 ( -44.531 5.414 -2.684) 44.939 3.812 ( -55.464 11.955 2.650) 56.800 6.184 ( -6.210 1.942 -4.494) 7.908 6.684 ( -1.028 -2.850 -8.077) 8.626 6.817 ( 3.907 2.375 14.322) 15.034 7.698 ( 0.930 13.184 -11.552) 17.554 7.768 ( -7.416 -12.964 9.101) 17.490 8.813 ( 0.080 9.676 14.231) 17.209 8.971 ( -8.769 -6.669 -8.503) 13.916 9.488 ( 8.836 -0.862 3.490) 9.539 9.677 ( 3.573 -0.922 1.982) 4.188 11.161 ( 5.825 5.741 3.213) 8.787 11.891 ( -12.456 -11.032 -6.526) 17.874 12.077 ( -11.167 11.474 1.136) 16.051 12.437 ( 16.193 -15.098 8.410) 23.683 13.190 ( 22.640 3.906 -14.582) 27.211 13.620 ( 5.330 -1.132 -2.144) 5.855 18.761 ( 5.607 -8.804 -0.261) 10.441 19.067 ( 0.112 5.276 1.108) 5.392 19.470 ( 5.179 -1.218 -2.939) 6.078 19.773 ( 7.992 -0.055 -2.779) 8.461 20.413 ( -1.635 1.213 10.035) 10.239 21.047 ( 1.987 -0.329 0.862) 2.191 27.549 ( -4.118 0.783 0.226) 4.198 27.705 ( 0.640 -0.339 -0.718) 1.020 36.860 ( -3.908 -1.023 2.916) 4.982 37.373 ( -13.077 7.739 3.954) 15.701 37.580 ( -17.002 0.724 -4.304) 17.553 41.213 ( 8.344 -2.177 -15.142) 17.425 ======================= Grid point 40 (32/371) ======================= q-point: ( 0.08 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.936 ( -20.380 23.498 17.543) 35.711 2.334 ( -18.975 38.460 3.230) 43.007 3.932 ( -35.767 36.016 6.806) 51.213 6.144 ( 2.653 4.832 -0.250) 5.518 6.609 ( -5.805 2.544 1.929) 6.625 7.014 ( -4.380 -4.582 0.322) 6.347 7.703 ( 4.762 3.725 10.200) 11.857 8.087 ( -6.636 10.429 8.186) 14.826 8.322 ( -2.685 -9.772 -13.538) 16.910 9.280 ( -8.720 4.956 3.476) 10.615 9.438 ( 6.181 -9.503 1.076) 11.387 9.671 ( 1.771 -5.118 2.898) 6.142 11.127 ( -3.126 -11.037 -3.293) 11.935 11.785 ( 7.430 14.021 -1.541) 15.943 12.106 ( -10.022 8.663 0.460) 13.255 12.524 ( -0.407 -10.290 -0.340) 10.304 13.086 ( 24.635 -8.205 -4.607) 26.371 13.614 ( 5.957 -2.871 -1.452) 6.770 18.769 ( 8.911 -0.449 -1.625) 9.069 19.034 ( -3.002 -4.314 1.159) 5.382 19.450 ( 5.581 -2.709 -2.240) 6.596 19.630 ( -1.635 -4.619 -8.702) 9.986 20.707 ( 4.381 -7.846 21.119) 22.951 21.082 ( 1.617 -2.140 3.564) 4.460 27.529 ( -2.703 2.357 -1.228) 3.791 27.713 ( 0.825 0.448 0.122) 0.947 36.968 ( -10.168 -0.350 3.654) 10.810 37.093 ( -2.246 8.795 -5.856) 10.802 37.835 ( -15.757 16.216 6.661) 23.571 40.679 ( -2.233 7.638 -46.590) 47.264 ======================= Grid point 41 (33/371) ======================= q-point: ( 0.15 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.114 ( -3.563 29.256 21.634) 36.561 2.618 ( -1.318 41.723 12.098) 43.462 3.866 ( -21.503 44.727 6.956) 50.113 6.310 ( 8.543 8.079 -1.550) 11.860 6.493 ( -13.092 4.510 1.204) 13.899 6.885 ( -0.049 -8.592 -2.032) 8.829 7.615 ( -17.582 -7.426 0.987) 19.111 8.123 ( 5.620 2.187 11.609) 13.082 8.416 ( 12.629 6.602 -5.368) 15.228 9.133 ( -11.764 4.462 0.193) 12.583 9.432 ( 1.662 -5.830 -1.831) 6.333 9.649 ( 1.813 -8.560 1.334) 8.851 11.080 ( 4.877 -1.654 -1.232) 5.295 11.908 ( -7.854 8.323 -2.296) 11.672 12.085 ( 3.126 3.678 -0.886) 4.907 12.293 ( -8.713 -6.456 0.053) 10.845 13.430 ( 18.663 -8.722 -0.271) 20.602 13.692 ( 7.526 -4.266 1.642) 8.805 18.781 ( -0.541 -8.494 1.128) 8.586 19.044 ( 3.023 3.612 -0.558) 4.743 19.454 ( 0.722 -6.382 -10.600) 12.394 19.534 ( 1.404 -3.783 -0.389) 4.054 20.770 ( 1.942 -12.521 20.076) 23.740 21.097 ( 0.778 -3.154 4.108) 5.237 27.520 ( -0.708 3.105 -1.158) 3.389 27.721 ( -0.469 0.244 0.068) 0.533 36.787 ( -7.823 1.567 -1.580) 8.133 37.233 ( 4.619 13.686 -4.172) 15.034 37.727 ( -16.773 13.954 4.395) 22.257 40.545 ( 1.123 16.931 -46.457) 49.459 ======================= Grid point 42 (34/371) ======================= q-point: ( 0.23 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.510 ( 3.791 29.711 19.482) 35.730 3.031 ( -2.512 33.695 15.211) 37.054 4.160 ( 0.609 42.180 3.542) 42.333 6.267 ( -11.218 7.051 -8.774) 15.892 6.567 ( 7.766 8.754 0.772) 11.727 6.857 ( 6.054 -11.591 2.833) 13.380 7.269 ( -13.302 -4.623 0.376) 14.088 8.270 ( 3.264 -0.956 6.986) 7.770 8.652 ( 11.420 2.228 -6.139) 13.155 9.054 ( -6.396 10.871 3.697) 13.144 9.407 ( 0.230 -0.771 3.096) 3.199 9.593 ( 2.727 -9.359 -1.639) 9.885 11.157 ( 2.812 0.569 -0.319) 2.886 11.797 ( -2.374 -3.692 0.581) 4.428 12.123 ( 2.804 -4.610 -0.344) 5.406 12.278 ( -0.154 12.855 0.240) 12.858 13.497 ( 3.003 -7.680 -2.061) 8.500 13.655 ( -9.030 -10.792 2.611) 14.311 18.738 ( 4.442 -7.794 3.353) 9.577 19.067 ( -2.659 -1.115 -0.053) 2.883 19.320 ( -1.338 -3.792 -13.180) 13.779 19.541 ( 1.787 -4.139 1.032) 4.625 20.756 ( -0.676 -11.492 16.017) 19.725 21.089 ( -0.138 -3.899 3.850) 5.481 27.551 ( 1.237 3.689 -1.150) 4.057 27.707 ( -1.330 0.184 0.015) 1.343 36.767 ( 3.266 3.657 -2.156) 5.356 37.416 ( 3.696 14.921 -5.014) 16.169 37.662 ( -8.382 14.084 3.168) 16.693 40.507 ( 1.396 14.540 -38.552) 41.226 ======================= Grid point 43 (35/371) ======================= q-point: ( 0.31 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.958 ( 5.510 26.711 19.032) 33.257 3.369 ( 1.759 28.705 10.904) 30.756 4.511 ( 1.082 22.854 -3.806) 23.193 6.193 ( -1.896 7.772 -8.061) 11.357 6.754 ( -4.858 -12.368 2.407) 13.505 6.800 ( 12.868 6.349 -3.318) 14.727 7.248 ( 4.935 8.638 8.228) 12.910 8.262 ( -2.046 -7.853 3.961) 9.030 8.697 ( 2.034 -2.922 -12.402) 12.903 9.155 ( -3.305 17.382 2.430) 17.860 9.471 ( 4.523 -4.036 8.729) 10.628 9.605 ( 7.549 -0.736 1.883) 7.815 11.149 ( -1.968 -3.067 3.990) 5.404 11.794 ( 6.315 -9.649 0.143) 11.532 12.194 ( 4.683 8.267 1.184) 9.575 12.395 ( 2.273 6.704 -2.153) 7.399 13.219 ( -29.367 -11.541 4.703) 31.902 13.426 ( -2.567 -6.113 -4.556) 8.044 18.780 ( 3.744 -6.819 3.615) 8.579 18.972 ( -0.529 -7.063 -0.627) 7.110 19.218 ( -2.757 1.309 -10.619) 11.049 19.506 ( -1.568 -4.493 0.148) 4.761 20.716 ( -1.172 -8.014 11.280) 13.887 21.059 ( -1.016 -4.277 3.030) 5.340 27.612 ( 2.410 3.840 -1.254) 4.704 27.688 ( -1.144 0.505 0.127) 1.257 36.908 ( 9.685 3.243 -0.694) 10.237 37.587 ( 4.359 15.182 -6.093) 16.930 37.753 ( 0.934 12.508 3.582) 13.044 40.438 ( -1.480 8.288 -30.113) 31.268 ======================= Grid point 44 (36/371) ======================= q-point: ( 0.38 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.367 ( 4.798 22.555 16.798) 28.530 3.755 ( 10.488 20.926 7.763) 24.661 4.612 ( -0.412 9.205 -7.527) 11.898 6.183 ( -3.574 5.200 -8.961) 10.959 6.560 ( -6.028 -9.784 5.972) 12.951 7.074 ( 19.180 -2.015 -8.668) 21.144 7.583 ( 10.051 20.837 12.664) 26.373 8.137 ( -3.247 -9.980 1.209) 10.564 8.603 ( 0.261 -4.976 -12.279) 13.252 9.225 ( -8.999 17.696 0.349) 19.855 9.541 ( 8.772 -7.717 1.309) 11.756 9.812 ( 6.594 5.062 10.308) 13.242 11.137 ( 2.080 -5.415 9.054) 10.752 11.757 ( -0.029 -8.541 -0.826) 8.581 12.347 ( -13.774 -7.312 -0.234) 15.597 12.409 ( 7.767 8.218 2.508) 11.582 12.727 ( -17.406 4.041 2.088) 17.991 13.283 ( -5.059 -4.707 -5.785) 9.012 18.691 ( -5.790 -6.252 1.327) 8.624 18.988 ( 5.688 -5.851 2.143) 8.437 19.143 ( -1.087 1.478 -9.153) 9.335 19.414 ( -3.753 -4.877 -0.166) 6.157 20.692 ( -0.261 -4.423 7.108) 8.376 21.009 ( -1.770 -4.227 1.985) 4.994 27.674 ( 1.522 1.907 -1.515) 2.872 27.690 ( 0.446 2.558 0.564) 2.657 37.100 ( 8.976 3.757 1.528) 9.850 37.769 ( 6.230 11.355 -10.962) 16.968 37.954 ( 7.546 10.840 8.068) 15.477 40.311 ( -3.434 2.865 -22.654) 23.091 ======================= Grid point 45 (37/371) ======================= q-point: ( 0.46 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.698 ( 4.164 16.217 10.298) 19.656 4.151 ( 12.635 13.448 6.445) 19.545 4.662 ( 4.616 2.196 -4.515) 6.820 6.057 ( -10.198 1.543 -5.521) 11.699 6.467 ( -0.872 -5.506 6.210) 8.345 7.294 ( 15.738 -0.257 -9.721) 18.500 7.917 ( 3.237 0.871 5.702) 6.614 8.058 ( 3.111 5.845 -6.287) 9.131 8.543 ( 5.057 -4.087 -2.747) 7.059 9.220 ( -10.731 14.849 2.391) 18.476 9.626 ( 8.070 -5.017 0.430) 9.512 9.895 ( -6.845 1.011 4.130) 8.058 11.159 ( 2.588 -14.032 9.877) 17.353 11.684 ( -1.989 1.251 3.605) 4.303 11.992 ( -15.650 -4.651 9.910) 19.099 12.494 ( -6.465 5.260 -5.545) 10.011 12.748 ( 7.640 4.484 -1.254) 8.947 13.141 ( -4.555 -1.239 -5.254) 7.063 18.565 ( -4.292 -2.682 1.076) 5.174 18.955 ( -5.868 -1.818 0.317) 6.151 19.156 ( 6.814 -2.130 -5.066) 8.754 19.312 ( -2.209 -5.345 -0.365) 5.795 20.699 ( 0.933 -1.480 3.977) 4.345 20.945 ( -2.399 -3.862 1.034) 4.662 27.696 ( 0.824 1.380 -0.269) 1.630 27.736 ( 0.826 2.710 -0.331) 2.853 37.274 ( 5.634 5.430 2.499) 8.214 37.864 ( 2.248 5.046 -7.583) 9.382 38.273 ( 14.259 9.561 4.879) 17.848 40.162 ( -3.069 -1.281 -15.657) 16.006 ======================= Grid point 46 (38/371) ======================= q-point: ( 0.54 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.891 ( 0.850 8.565 2.135) 8.868 4.418 ( 2.212 8.012 2.764) 8.759 4.761 ( 10.576 -5.661 0.811) 12.023 5.891 ( -7.819 1.528 -0.177) 7.969 6.467 ( 1.735 -3.110 5.174) 6.281 7.469 ( 7.927 3.865 -8.124) 11.991 7.887 ( -1.164 -0.438 -4.126) 4.309 8.156 ( 9.221 1.231 -11.941) 15.137 8.679 ( 8.938 0.089 8.128) 12.081 9.194 ( -9.473 11.704 4.234) 15.641 9.598 ( -15.723 -7.854 0.093) 17.575 9.752 ( 0.263 0.184 2.188) 2.211 11.112 ( 4.979 -11.795 8.237) 15.224 11.652 ( -6.073 -2.097 -0.945) 6.494 11.938 ( -4.856 1.386 11.854) 12.885 12.352 ( -5.544 5.222 -4.607) 8.901 12.911 ( 8.250 2.760 -2.047) 8.937 13.057 ( -3.675 0.688 -3.154) 4.891 18.525 ( -0.734 1.496 1.048) 1.969 18.818 ( -7.988 -1.193 -0.251) 8.081 19.225 ( 6.424 -5.680 -2.800) 9.020 19.246 ( 0.025 -1.946 -0.358) 1.979 20.732 ( 1.586 0.463 1.844) 2.476 20.872 ( -2.690 -3.404 0.341) 4.352 27.723 ( 0.523 1.752 -0.164) 1.836 27.760 ( 0.012 1.482 0.003) 1.482 37.402 ( 1.454 6.726 1.190) 6.984 37.872 ( -0.506 -0.308 -1.982) 2.068 38.598 ( 12.766 7.859 -0.521) 15.000 40.049 ( 0.680 -4.041 -7.863) 8.867 ======================= Grid point 47 (39/371) ======================= q-point: (-0.38 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.899 ( -6.602 2.901 -2.396) 7.599 4.382 ( -11.100 1.541 0.038) 11.206 4.855 ( 8.223 -11.347 0.978) 14.047 5.888 ( 3.676 4.209 2.142) 5.985 6.510 ( 2.163 -0.642 5.462) 5.909 7.512 ( 3.732 -4.318 -8.151) 9.950 7.864 ( -8.339 18.676 -8.413) 22.116 8.302 ( 12.800 -6.523 -1.731) 14.470 8.841 ( 3.640 1.931 3.084) 5.147 9.182 ( -6.308 3.029 4.432) 8.283 9.235 ( -9.847 -5.941 5.594) 12.789 9.795 ( 0.523 0.441 1.657) 1.792 11.209 ( 9.455 -2.623 6.103) 11.555 11.479 ( -11.122 -2.414 -10.575) 15.535 11.707 ( -13.893 -8.381 1.402) 16.286 12.516 ( 7.792 9.472 8.819) 15.107 12.977 ( -5.073 -0.261 -2.008) 5.462 13.047 ( 7.339 2.298 -2.458) 8.074 18.550 ( -0.366 1.177 0.228) 1.253 18.721 ( -2.638 2.694 0.779) 3.850 19.192 ( 2.074 -6.710 -0.214) 7.027 19.302 ( 4.377 -0.216 -1.669) 4.689 20.752 ( -2.153 0.262 -0.181) 2.176 20.820 ( 1.051 -1.804 0.511) 2.149 27.727 ( -1.692 0.948 0.143) 1.945 27.778 ( 0.733 1.097 0.068) 1.321 37.443 ( -3.443 5.216 -1.952) 6.548 37.841 ( -2.122 -1.991 4.476) 5.339 38.776 ( 3.226 4.466 -7.378) 9.208 40.066 ( 9.045 -3.687 0.737) 9.795 ======================= Grid point 48 (40/371) ======================= q-point: (-0.31 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.695 ( -18.512 -1.131 -1.389) 18.598 4.176 ( -14.762 3.065 -0.191) 15.078 4.827 ( 3.316 -12.278 -0.598) 12.732 6.067 ( 11.924 2.253 0.173) 12.136 6.578 ( 1.001 3.261 5.280) 6.286 7.474 ( 3.516 -5.587 -9.136) 11.271 7.855 ( -10.737 18.190 -6.291) 22.039 8.309 ( -4.303 -6.309 4.029) 8.634 8.681 ( -14.980 -7.676 3.839) 17.264 9.262 ( -0.185 5.323 7.075) 8.856 9.329 ( 20.050 -0.860 1.350) 20.114 9.771 ( -4.298 -0.615 1.206) 4.506 11.116 ( -17.228 -0.790 -13.224) 21.732 11.371 ( 7.951 -3.308 4.835) 9.876 11.600 ( 5.731 -1.196 0.714) 5.898 12.703 ( 0.124 4.450 6.473) 7.856 12.871 ( -4.991 -1.590 -2.193) 5.679 13.180 ( 7.764 2.318 -1.489) 8.238 18.520 ( -0.950 -2.209 0.382) 2.435 18.802 ( 4.361 6.490 0.599) 7.842 19.188 ( 3.441 -3.628 1.335) 5.176 19.350 ( 3.422 -1.071 -1.845) 4.032 20.680 ( -4.581 -0.811 -0.941) 4.747 20.860 ( 3.214 0.033 0.207) 3.221 27.698 ( -2.338 -0.021 0.743) 2.453 27.793 ( -0.090 0.829 -0.397) 0.923 37.367 ( -6.954 0.078 -2.827) 7.507 37.820 ( -4.407 1.717 8.119) 9.396 38.707 ( -7.130 -0.591 -10.965) 13.092 40.273 ( 15.966 -0.705 4.751) 16.673 ======================= Grid point 49 (41/371) ======================= q-point: (-0.23 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.294 ( -27.638 -1.400 1.366) 27.707 3.953 ( -20.178 6.835 0.878) 21.322 4.779 ( 2.751 -6.350 -0.466) 6.936 6.269 ( 12.923 -2.465 -2.426) 13.378 6.634 ( -2.173 5.661 0.505) 6.085 7.416 ( -3.955 -1.935 -4.153) 6.052 7.733 ( -13.138 4.357 -4.726) 14.626 8.247 ( 0.152 1.905 6.288) 6.572 8.379 ( -14.785 -9.090 4.195) 17.855 9.342 ( 1.416 3.343 1.731) 4.022 9.544 ( 4.287 -2.161 -0.729) 4.856 9.673 ( -6.633 -0.778 2.258) 7.049 10.934 ( -1.848 4.603 -2.904) 5.747 11.483 ( 15.376 -12.925 4.848) 20.663 11.816 ( 13.619 10.337 -4.908) 17.788 12.667 ( -9.603 3.030 3.585) 10.689 12.766 ( -4.925 -2.804 -3.140) 6.479 13.315 ( 7.719 0.587 -1.969) 7.987 18.514 ( 3.201 -3.561 1.037) 4.900 18.932 ( 5.020 2.980 -0.421) 5.853 19.252 ( 4.255 0.693 2.323) 4.897 19.388 ( 4.310 -0.366 -1.652) 4.630 20.592 ( -4.877 -0.181 -0.675) 4.927 20.914 ( 3.217 0.006 0.021) 3.217 27.665 ( -2.027 -0.360 1.196) 2.381 27.782 ( -1.508 0.275 -1.038) 1.852 37.214 ( -8.083 -3.301 -0.645) 8.755 37.804 ( -7.546 6.056 8.157) 12.655 38.460 ( -13.131 -3.552 -10.286) 17.054 40.572 ( 17.069 0.717 2.634) 17.286 ======================= Grid point 50 (42/371) ======================= q-point: (-0.15 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.830 ( -31.212 3.468 3.940) 31.650 3.618 ( -29.978 7.024 0.592) 30.795 4.762 ( -5.009 2.962 -0.957) 5.897 6.394 ( 6.956 -4.541 -3.316) 8.944 6.602 ( -3.752 3.475 -6.290) 8.107 7.185 ( -22.357 1.441 6.148) 23.232 7.606 ( 0.861 -2.210 -6.369) 6.796 8.104 ( -14.262 -0.925 5.125) 15.183 8.430 ( 13.024 2.201 10.263) 16.727 9.323 ( -4.341 -3.287 -10.556) 11.878 9.500 ( -5.366 2.152 6.424) 8.642 9.617 ( -1.774 0.182 4.077) 4.450 11.011 ( 2.739 6.687 2.086) 7.521 11.692 ( 23.820 -20.345 7.129) 32.127 12.072 ( 7.660 4.069 -9.010) 12.506 12.542 ( -12.080 4.381 -0.341) 12.854 12.672 ( 0.976 5.408 -3.309) 6.415 13.415 ( 7.096 -1.651 -3.533) 8.097 18.555 ( 5.930 -5.927 0.998) 8.443 19.006 ( 3.923 -1.180 -0.701) 4.157 19.324 ( 3.187 0.694 -1.045) 3.425 19.502 ( 7.600 3.447 1.092) 8.417 20.520 ( -4.371 0.876 1.562) 4.724 20.964 ( 2.988 -0.277 0.332) 3.019 27.641 ( -1.602 0.037 1.390) 2.121 27.741 ( -2.421 -0.308 -1.682) 2.964 37.057 ( -7.498 -2.907 1.988) 8.284 37.767 ( -10.004 7.918 6.190) 14.181 38.139 ( -16.324 -2.160 -6.905) 17.856 40.833 ( 14.491 -0.539 -4.198) 15.097 ======================= Grid point 51 (43/371) ======================= q-point: (-0.08 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.413 ( -31.379 11.490 6.429) 34.030 3.118 ( -38.946 7.505 -1.880) 39.707 4.586 ( -25.111 12.497 -1.667) 28.099 6.315 ( -8.106 -0.589 -7.399) 10.991 6.607 ( 5.177 -2.462 -1.409) 5.903 6.960 ( -12.185 7.616 10.185) 17.613 7.592 ( 4.177 -6.708 -2.813) 8.388 7.969 ( -9.736 6.853 7.662) 14.158 8.771 ( 17.362 3.195 9.618) 20.103 9.061 ( -12.931 -5.060 -12.123) 18.433 9.499 ( -3.538 1.715 8.853) 9.686 9.640 ( 1.210 -0.453 4.010) 4.213 11.166 ( 5.201 10.651 3.247) 12.290 11.813 ( 8.354 -29.816 -2.642) 31.076 12.048 ( 6.377 -2.693 -0.147) 6.924 12.381 ( -12.253 6.605 0.076) 13.920 12.889 ( 13.807 9.191 -10.348) 19.550 13.486 ( 6.926 -2.925 -3.827) 8.437 18.588 ( 5.696 -7.219 -0.014) 9.195 19.056 ( 4.305 -1.648 0.352) 4.623 19.368 ( 3.635 -0.777 -3.399) 5.037 19.656 ( 6.253 2.253 -0.907) 6.708 20.501 ( -1.797 1.719 7.965) 8.345 21.009 ( 2.670 -0.644 1.165) 2.984 27.620 ( -2.870 1.149 0.660) 3.162 27.695 ( -0.903 -0.747 -1.451) 1.865 36.954 ( -5.298 0.658 3.779) 6.541 37.633 ( -13.850 -1.551 -1.893) 14.064 37.898 ( -14.945 11.904 3.201) 19.372 40.961 ( 9.153 -3.276 -16.287) 18.968 ======================= Grid point 53 (44/371) ======================= q-point: ( 0.08 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.591 ( -24.338 19.993 13.968) 34.455 3.008 ( -22.597 29.157 1.727) 36.928 4.637 ( -20.935 16.588 -3.222) 26.904 6.182 ( 0.105 5.086 -2.877) 5.844 6.592 ( 5.537 -6.069 1.861) 8.424 7.271 ( -17.558 13.225 7.475) 23.217 7.654 ( 9.786 2.308 11.155) 15.018 8.188 ( -0.529 -1.028 -8.128) 8.210 8.397 ( -16.643 -3.631 2.016) 17.153 9.195 ( 12.514 -0.912 -0.023) 12.547 9.438 ( -3.900 -5.134 -2.624) 6.960 9.713 ( -6.203 0.216 7.180) 9.491 11.058 ( -3.034 -9.970 -2.094) 10.630 11.778 ( 7.073 10.686 -0.259) 12.817 12.121 ( 19.989 -1.758 5.583) 20.828 12.463 ( -4.939 0.611 -3.539) 6.107 12.785 ( -0.293 -7.073 -2.282) 7.438 13.457 ( 8.187 -3.211 -3.543) 9.481 18.612 ( 8.642 0.289 -1.527) 8.780 18.992 ( 2.565 -6.397 0.318) 6.900 19.331 ( 4.120 -2.264 -2.376) 5.267 19.591 ( -2.866 -4.248 -4.750) 6.988 20.688 ( 2.155 -3.498 12.067) 12.747 21.043 ( 2.468 -2.655 2.857) 4.616 27.583 ( -2.814 1.063 -1.602) 3.408 27.714 ( 0.678 2.061 0.321) 2.193 37.118 ( -0.823 8.031 3.547) 8.818 37.243 ( -13.971 0.665 -4.702) 14.756 38.282 ( -14.692 16.512 8.665) 23.740 40.504 ( 1.359 -0.630 -33.915) 33.948 ======================= Grid point 54 (45/371) ======================= q-point: ( 0.15 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.596 ( -11.115 25.254 18.876) 33.431 3.109 ( -7.374 36.520 6.838) 37.879 4.482 ( -15.538 18.756 -2.694) 24.504 6.295 ( 5.294 10.137 1.067) 11.486 6.614 ( 2.510 -6.356 3.090) 7.499 7.039 ( -23.481 8.745 -1.998) 25.136 7.792 ( -10.621 -3.383 -5.717) 12.528 8.025 ( 7.305 -6.986 7.672) 12.690 8.360 ( 1.528 4.860 6.997) 8.655 9.282 ( -1.125 0.650 -8.868) 8.963 9.369 ( 2.127 2.067 1.763) 3.450 9.620 ( -6.113 -3.958 3.388) 8.032 11.004 ( 2.376 -0.700 1.439) 2.865 11.923 ( 6.198 -2.110 1.311) 6.677 12.165 ( -13.284 -4.580 -5.732) 15.175 12.436 ( -1.950 7.771 4.225) 9.058 12.942 ( 26.374 -7.747 2.361) 27.589 13.542 ( 7.427 -3.249 -1.557) 8.255 18.688 ( 2.960 -6.878 -0.480) 7.503 19.009 ( 4.488 1.765 -0.915) 4.908 19.341 ( 1.036 -6.541 -3.903) 7.687 19.476 ( -0.721 -4.004 -3.461) 5.342 20.734 ( 1.542 -6.847 12.417) 14.264 21.063 ( 1.740 -3.699 3.338) 5.277 27.554 ( -1.433 1.936 -1.342) 2.758 27.739 ( -0.305 1.958 0.151) 1.988 36.982 ( -13.855 1.438 0.664) 13.946 37.268 ( 3.642 12.893 -4.264) 14.060 38.183 ( -19.055 13.523 6.319) 24.205 40.396 ( 4.483 6.623 -35.700) 36.585 ======================= Grid point 55 (46/371) ======================= q-point: ( 0.23 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.848 ( -1.185 26.096 18.612) 32.075 3.431 ( -1.599 31.650 10.090) 33.258 4.486 ( -3.200 18.597 -4.099) 19.310 6.499 ( 0.216 9.618 -3.281) 10.165 6.569 ( -2.723 0.708 3.452) 4.453 6.764 ( -8.844 2.470 -4.131) 10.069 7.465 ( -15.144 -4.466 -0.041) 15.789 8.167 ( 7.071 -7.840 7.309) 12.841 8.505 ( 7.430 3.817 0.050) 8.353 9.268 ( -1.462 10.836 -1.856) 11.090 9.453 ( -0.432 8.265 4.009) 9.196 9.485 ( -3.250 -8.726 -1.184) 9.387 11.094 ( 5.314 1.464 1.668) 5.758 11.768 ( -6.284 -21.422 2.355) 22.449 12.091 ( 1.345 9.649 -1.424) 9.846 12.474 ( -5.806 12.415 1.250) 13.763 13.247 ( 17.216 -10.378 -0.054) 20.103 13.596 ( 3.637 -7.432 0.818) 8.315 18.630 ( 1.368 -8.705 1.771) 8.988 19.083 ( -1.562 -2.357 1.373) 3.143 19.222 ( 1.503 -2.870 -11.673) 12.115 19.473 ( 2.832 -3.329 0.727) 4.431 20.738 ( 0.090 -7.682 10.982) 13.402 21.063 ( 0.830 -4.396 3.242) 5.525 27.560 ( 0.340 2.563 -1.136) 2.824 27.740 ( -1.553 1.570 0.083) 2.210 36.830 ( -7.167 3.915 -0.830) 8.209 37.443 ( 5.130 13.651 -5.497) 15.585 38.032 ( -16.832 13.192 4.877) 21.935 40.382 ( 5.224 8.433 -31.843) 33.352 ======================= Grid point 56 (47/371) ======================= q-point: ( 0.31 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.199 ( 3.980 23.064 15.992) 28.347 3.684 ( -3.747 22.672 8.188) 24.395 4.618 ( 3.295 9.773 -8.264) 13.216 6.356 ( -10.162 6.361 -2.419) 12.230 6.655 ( 4.385 0.796 -7.442) 8.675 6.759 ( -2.769 3.619 3.039) 5.478 7.354 ( 0.167 8.005 9.764) 12.627 8.167 ( 2.279 -12.260 2.750) 12.770 8.607 ( 2.559 3.024 -8.404) 9.290 9.317 ( -1.320 -5.271 0.109) 5.435 9.451 ( 0.726 12.694 0.375) 12.720 9.576 ( 2.810 10.321 9.024) 13.994 11.136 ( 0.186 -7.249 2.883) 7.804 11.603 ( 4.511 -12.346 5.642) 14.305 12.216 ( 3.174 10.848 -2.739) 11.630 12.503 ( -4.417 10.106 0.248) 11.031 13.314 ( 4.112 -9.854 -1.378) 10.766 13.456 ( -10.457 -11.608 0.861) 15.647 18.634 ( 6.555 -6.560 2.887) 9.713 18.919 ( -5.278 -11.254 -2.477) 12.675 19.232 ( 0.332 4.762 -8.181) 9.472 19.478 ( 0.799 -3.760 1.272) 4.049 20.715 ( -0.776 -6.391 8.567) 10.716 21.042 ( -0.139 -4.611 2.632) 5.311 27.600 ( 1.920 2.813 -1.067) 3.569 27.725 ( -1.900 1.401 0.139) 2.365 36.825 ( 2.540 4.184 -1.393) 5.089 37.620 ( 4.618 12.809 -6.356) 15.026 37.970 ( -8.976 13.608 5.452) 17.190 40.360 ( 1.801 5.680 -26.478) 27.141 ======================= Grid point 57 (48/371) ======================= q-point: ( 0.38 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.543 ( 5.777 16.035 12.795) 21.312 3.874 ( 1.035 16.632 6.482) 17.880 4.645 ( 0.702 2.461 -11.449) 11.731 6.301 ( -5.625 7.918 -1.925) 9.902 6.622 ( -7.509 -2.758 5.159) 9.519 6.781 ( 9.026 0.374 -7.733) 11.892 7.662 ( 11.141 15.374 13.861) 23.507 8.073 ( -0.059 -10.315 0.055) 10.316 8.550 ( -5.070 2.474 -13.319) 14.465 9.287 ( 9.614 -10.950 -4.057) 15.126 9.537 ( -7.879 16.663 1.859) 18.525 9.841 ( 6.520 11.799 12.407) 18.321 11.058 ( 1.630 -14.383 7.922) 16.501 11.656 ( 5.457 -4.199 4.197) 8.064 12.363 ( 4.330 9.521 -6.537) 12.334 12.497 ( -6.084 3.847 3.275) 7.908 13.060 ( -19.162 -9.968 4.241) 22.012 13.270 ( -2.344 -4.406 -5.368) 7.330 18.692 ( -1.375 -6.651 2.196) 7.138 18.769 ( 7.881 -9.237 -2.242) 12.348 19.205 ( -4.250 4.369 -6.038) 8.579 19.434 ( -2.579 -3.685 0.894) 4.586 20.691 ( -0.419 -4.047 5.861) 7.135 21.001 ( -1.002 -4.276 1.751) 4.728 27.655 ( 2.188 2.257 -1.059) 3.317 27.716 ( -0.768 1.777 0.270) 1.955 36.960 ( 9.881 2.912 -0.783) 10.330 37.758 ( 3.100 10.561 -7.504) 13.321 38.051 ( -0.585 12.705 7.092) 14.562 40.271 ( -2.012 2.088 -20.826) 21.027 ======================= Grid point 58 (49/371) ======================= q-point: ( 0.46 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.799 ( 5.359 7.363 8.203) 12.256 4.117 ( 7.842 12.273 6.667) 16.018 4.631 ( 1.789 2.748 -8.722) 9.318 6.242 ( -9.567 6.982 -4.131) 12.543 6.502 ( -6.183 -4.769 10.660) 13.214 6.948 ( 16.249 -0.132 -9.726) 18.938 7.858 ( -0.382 -9.270 4.452) 10.291 8.164 ( 6.217 18.393 3.025) 19.650 8.405 ( -1.591 -2.933 -11.192) 11.679 9.369 ( 13.148 -9.099 -2.118) 16.129 9.543 ( -9.773 14.304 0.580) 17.333 10.038 ( -2.153 8.105 7.035) 10.946 11.001 ( 3.447 -18.338 9.072) 20.748 11.729 ( 2.299 2.580 5.040) 6.111 12.247 ( -14.468 -4.214 2.981) 15.361 12.570 ( 3.562 6.884 1.192) 7.842 12.777 ( -10.536 -0.162 -2.404) 10.809 13.166 ( -3.130 -1.173 -4.700) 5.767 18.574 ( -2.188 -6.038 -0.489) 6.441 18.881 ( 10.440 -6.188 1.731) 12.259 19.121 ( -6.381 2.873 -5.636) 8.985 19.345 ( -4.555 -2.715 0.673) 5.346 20.690 ( 0.669 -1.637 3.462) 3.888 20.949 ( -1.761 -3.528 0.921) 4.049 27.690 ( 1.008 1.132 -0.473) 1.588 27.743 ( 1.068 2.313 -0.107) 2.550 37.168 ( 12.058 2.214 0.672) 12.277 37.834 ( 1.533 5.937 -8.075) 10.139 38.251 ( 5.963 11.669 7.713) 15.206 40.130 ( -3.939 -1.129 -15.151) 15.695 ======================= Grid point 59 (50/371) ======================= q-point: ( 0.54 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.948 ( 3.208 3.612 3.322) 5.863 4.393 ( 9.566 6.668 5.601) 12.936 4.653 ( 1.892 1.061 -3.995) 4.546 6.081 ( -12.867 3.840 -2.266) 13.618 6.466 ( -0.884 -2.528 10.295) 10.638 7.190 ( 19.012 -0.131 -10.754) 21.843 7.772 ( 1.720 -7.769 -0.337) 7.964 8.200 ( -7.735 9.053 -12.575) 17.318 8.547 ( 12.314 1.856 7.949) 14.774 9.456 ( -2.439 0.285 4.574) 5.191 9.531 ( 2.232 3.133 -5.570) 6.770 9.951 ( -15.802 0.553 2.200) 15.964 10.947 ( 6.145 -13.142 7.364) 16.270 11.767 ( -6.243 1.384 1.594) 6.590 12.111 ( -5.163 1.968 15.044) 16.026 12.501 ( -11.757 2.684 -6.893) 13.891 12.771 ( 8.119 0.982 -3.335) 8.832 13.106 ( -2.668 1.334 -2.488) 3.885 18.525 ( 0.918 -1.993 -0.014) 2.195 18.930 ( -4.626 -2.844 3.165) 6.285 19.048 ( 4.575 -2.218 -5.871) 7.766 19.265 ( -3.138 -0.491 0.487) 3.213 20.716 ( 1.671 0.066 1.714) 2.394 20.888 ( -2.533 -2.637 0.326) 3.671 27.718 ( 1.455 0.944 -0.107) 1.738 27.772 ( 0.220 1.497 -0.197) 1.526 37.379 ( 9.262 3.163 1.846) 9.959 37.837 ( 0.288 -0.136 -6.187) 6.195 38.522 ( 9.180 10.785 5.355) 15.141 39.983 ( -2.785 -3.800 -9.351) 10.471 ======================= Grid point 60 (51/371) ======================= q-point: ( 0.62 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.003 ( -1.942 3.554 0.007) 4.050 4.535 ( -1.759 2.196 1.962) 3.430 4.663 ( 3.809 -5.081 -0.440) 6.366 5.932 ( -6.224 2.027 -1.506) 6.717 6.519 ( 1.416 1.885 8.515) 8.835 7.353 ( 7.238 -3.939 -8.661) 11.955 7.891 ( 19.892 1.189 -2.600) 20.096 8.116 ( -4.567 3.960 -4.549) 7.565 8.758 ( 7.399 1.319 5.303) 9.198 9.386 ( -11.217 5.191 -0.454) 12.368 9.410 ( -12.235 -11.302 0.358) 16.660 9.774 ( -1.581 0.139 0.970) 1.860 11.071 ( 11.309 0.673 5.106) 12.426 11.609 ( -11.938 0.160 -2.385) 12.175 11.952 ( -19.930 -5.369 2.894) 20.842 12.505 ( 6.985 6.364 3.335) 10.020 12.893 ( 7.929 -0.095 -3.578) 8.699 13.061 ( -3.486 1.310 -0.513) 3.759 18.553 ( 2.261 0.763 0.058) 2.387 18.800 ( -6.972 -1.201 0.604) 7.100 19.087 ( 4.363 -4.121 -1.604) 6.212 19.255 ( 1.136 1.473 0.057) 1.861 20.759 ( 2.149 0.965 0.577) 2.425 20.821 ( -3.187 -1.909 0.006) 3.715 27.751 ( 1.209 0.938 -0.009) 1.530 27.774 ( -0.733 0.208 -0.035) 0.763 37.512 ( 0.805 3.651 0.534) 3.776 37.809 ( 2.891 -4.086 -1.363) 5.187 38.756 ( 4.586 8.692 0.541) 9.843 39.909 ( 3.980 -4.659 -2.940) 6.796 ======================= Grid point 61 (52/371) ======================= q-point: (-0.31 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.937 ( -10.391 2.618 -0.033) 10.715 4.448 ( -11.529 6.092 1.274) 13.102 4.657 ( 4.169 -10.106 -0.131) 10.933 5.916 ( 4.668 -0.984 -3.012) 5.642 6.618 ( 1.753 5.480 3.949) 6.978 7.346 ( 3.039 -2.845 -4.380) 6.043 8.059 ( -3.329 -3.510 3.282) 5.846 8.257 ( 12.247 8.493 -2.456) 15.104 8.836 ( -2.042 -5.071 0.603) 5.499 9.085 ( -3.173 -2.898 0.627) 4.343 9.337 ( -2.257 -0.750 4.700) 5.268 9.772 ( 0.359 -2.065 -2.003) 2.899 11.324 ( 6.875 7.728 0.216) 10.346 11.347 ( -15.211 2.942 -9.123) 17.980 11.611 ( -12.765 -5.874 7.011) 15.704 12.681 ( 7.546 -0.600 0.573) 7.592 12.941 ( -3.189 1.024 -0.111) 3.351 13.064 ( 5.356 0.470 -0.866) 5.445 18.551 ( -3.560 -0.707 0.438) 3.656 18.758 ( 3.185 -0.699 -0.233) 3.269 19.118 ( 3.567 -0.574 0.545) 3.654 19.303 ( 2.179 1.694 -0.523) 2.809 20.745 ( -4.317 -0.275 -0.193) 4.330 20.811 ( 2.915 0.230 0.101) 2.925 27.743 ( -2.440 0.316 0.575) 2.526 27.782 ( 1.412 -0.482 -0.504) 1.575 37.462 ( -6.543 -1.591 -0.753) 6.776 37.862 ( 4.435 -0.376 2.852) 5.287 38.792 ( -6.486 3.944 -3.693) 8.441 40.027 ( 14.233 -1.925 1.546) 14.446 ======================= Grid point 62 (53/371) ======================= q-point: (-0.23 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.705 ( -20.567 1.792 2.099) 20.751 4.325 ( -14.906 9.561 1.375) 17.763 4.662 ( 5.964 -3.352 1.945) 7.113 6.008 ( 11.479 -4.640 -4.665) 13.231 6.684 ( -0.177 4.895 -5.074) 7.053 7.402 ( 4.211 2.712 3.866) 6.327 7.912 ( -10.280 -11.418 2.063) 15.502 8.279 ( -6.854 -2.602 7.124) 10.223 8.682 ( -13.836 9.622 -5.076) 17.601 9.253 ( 13.245 -2.876 -6.459) 15.014 9.378 ( 8.847 -4.710 9.704) 13.950 9.717 ( -1.906 -3.653 -2.065) 4.609 11.056 ( -10.811 5.469 -6.858) 13.922 11.368 ( -7.283 -3.696 9.296) 12.374 11.686 ( 12.160 10.533 -3.327) 16.428 12.722 ( 2.857 -5.758 -5.030) 8.162 12.867 ( -8.099 3.211 3.217) 9.287 13.169 ( 7.746 -1.783 -2.272) 8.267 18.482 ( -2.359 -2.335 1.032) 3.476 18.822 ( 6.314 -3.880 -1.010) 7.479 19.212 ( 4.905 3.670 1.757) 6.373 19.346 ( 1.739 2.486 -0.961) 3.183 20.672 ( -4.686 0.488 0.237) 4.718 20.862 ( 3.080 0.075 -0.070) 3.082 27.706 ( -2.505 -0.146 0.908) 2.669 27.785 ( 0.156 -0.921 -0.966) 1.344 37.312 ( -7.781 -4.078 1.138) 8.859 37.934 ( 0.861 2.093 2.541) 3.403 38.624 ( -13.416 1.402 -3.264) 13.878 40.298 ( 17.699 0.087 0.306) 17.702 ======================= Grid point 63 (54/371) ======================= q-point: (-0.15 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.368 ( -26.041 5.581 4.709) 27.045 4.111 ( -21.599 6.446 0.344) 22.543 4.813 ( 4.791 9.786 3.829) 11.550 6.133 ( 13.167 -6.450 -6.451) 16.018 6.645 ( -3.426 2.245 -10.261) 11.048 7.529 ( 0.866 0.916 5.258) 5.407 7.567 ( -15.747 -8.716 5.491) 18.817 8.242 ( 0.541 -7.996 15.088) 17.084 8.524 ( -14.161 16.637 -7.387) 23.063 9.256 ( 0.714 -3.799 -12.967) 13.531 9.539 ( 6.228 -5.541 9.116) 12.353 9.655 ( -0.670 -2.732 0.894) 2.952 11.070 ( 2.346 9.597 2.116) 10.104 11.297 ( 2.686 -10.650 7.574) 13.342 11.955 ( 10.110 10.013 -8.138) 16.392 12.638 ( -1.986 -5.113 -6.366) 8.403 12.792 ( -7.313 5.326 3.499) 9.700 13.246 ( 7.468 -4.138 -4.441) 9.623 18.452 ( 1.308 -3.587 0.943) 3.932 18.870 ( 6.504 -6.587 -0.847) 9.296 19.302 ( 1.082 2.557 -0.702) 2.863 19.442 ( 6.103 5.070 0.806) 7.976 20.611 ( -4.324 1.462 1.687) 4.866 20.912 ( 3.156 -0.363 0.222) 3.185 27.675 ( -1.778 0.116 1.072) 2.079 27.758 ( -1.364 -1.234 -1.490) 2.367 37.165 ( -7.149 -2.876 3.161) 8.329 37.933 ( -3.717 0.134 -1.078) 3.873 38.402 ( -15.539 5.506 1.629) 16.566 40.558 ( 15.233 -0.900 -5.182) 16.115 ======================= Grid point 64 (55/371) ======================= q-point: (-0.08 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.041 ( -27.424 11.793 7.334) 30.740 3.748 ( -30.266 6.940 -0.900) 31.064 4.942 ( -7.114 14.931 -0.017) 16.540 6.222 ( 9.151 -6.132 -9.340) 14.441 6.550 ( -2.699 0.094 -5.785) 6.384 7.268 ( -6.842 -7.989 3.614) 11.122 7.586 ( -9.120 8.076 11.899) 17.029 8.218 ( -6.905 0.030 11.120) 13.090 8.588 ( 9.126 8.079 0.589) 12.203 9.098 ( -5.772 -4.472 -15.847) 17.448 9.574 ( -0.662 -3.643 6.313) 7.319 9.675 ( 1.933 -0.642 7.196) 7.479 11.223 ( 2.693 12.092 2.191) 12.581 11.331 ( 11.487 -19.200 6.486) 23.295 12.018 ( -2.042 -1.106 -9.936) 10.204 12.556 ( -2.580 2.163 -4.314) 5.472 12.806 ( 1.309 6.414 0.221) 6.550 13.302 ( 8.124 -4.788 -5.357) 10.845 18.458 ( 3.370 -4.038 0.012) 5.259 18.915 ( 7.295 -6.714 -0.019) 9.914 19.318 ( 0.428 1.002 -2.626) 2.843 19.590 ( 5.523 3.075 0.297) 6.329 20.586 ( -2.483 1.952 4.916) 5.844 20.960 ( 3.131 -0.877 0.940) 3.385 27.664 ( -0.895 1.061 1.026) 1.726 27.706 ( -2.362 -1.199 -1.893) 3.256 37.071 ( -5.319 0.805 4.153) 6.796 37.781 ( -10.075 -4.221 -4.950) 11.993 38.284 ( -13.159 14.022 7.610) 20.681 40.695 ( 9.721 -3.648 -13.983) 17.417 ======================= Grid point 66 (56/371) ======================= q-point: ( 0.08 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.218 ( -22.462 16.619 11.584) 30.247 3.612 ( -21.963 19.549 1.051) 29.421 4.996 ( -16.198 5.119 -5.437) 17.836 6.094 ( 10.167 -1.844 -8.315) 13.263 6.499 ( 0.344 -0.994 2.572) 2.779 7.438 ( 14.236 5.943 7.990) 17.373 7.890 ( -20.878 12.147 12.563) 27.226 8.140 ( -2.656 -8.413 -3.802) 9.607 8.608 ( -10.935 -3.311 -0.569) 11.440 8.988 ( 13.008 3.326 -2.753) 13.705 9.411 ( -2.278 -3.246 -6.041) 7.226 9.775 ( 3.054 -4.934 3.505) 6.780 11.099 ( -8.410 1.052 8.096) 11.721 11.758 ( 4.351 3.650 2.518) 6.213 11.792 ( 15.015 -2.597 2.989) 15.529 12.491 ( -0.812 -2.641 -7.646) 8.130 12.821 ( -5.164 -1.108 1.587) 5.515 13.266 ( 8.977 -2.106 -4.201) 10.133 18.497 ( 5.483 2.190 -1.450) 6.080 18.847 ( 7.225 -6.794 0.330) 9.923 19.272 ( -0.611 -1.038 -2.207) 2.514 19.575 ( -1.653 -4.588 -1.854) 5.217 20.694 ( 0.418 -0.897 6.309) 6.387 20.983 ( 3.015 -2.974 1.794) 4.599 27.625 ( -2.399 0.540 -1.276) 2.770 27.728 ( 0.709 2.482 0.183) 2.587 37.203 ( 0.395 7.893 -0.499) 7.918 37.464 ( -13.192 0.201 0.187) 13.195 38.681 ( -10.072 13.958 8.828) 19.344 40.302 ( 0.698 -4.726 -24.858) 25.313 ======================= Grid point 67 (57/371) ======================= q-point: ( 0.15 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.127 ( -16.434 20.769 14.117) 30.012 3.590 ( -10.452 27.364 5.065) 29.726 4.767 ( -12.448 3.046 -5.505) 13.948 6.233 ( 11.204 2.195 -5.206) 12.548 6.525 ( 1.666 -1.906 5.271) 5.847 7.535 ( -23.880 5.093 -6.297) 25.216 7.796 ( 7.981 1.356 3.769) 8.930 7.995 ( -8.848 1.363 1.242) 9.039 8.440 ( -4.880 -7.301 9.285) 12.780 9.180 ( 8.315 1.594 -3.553) 9.182 9.373 ( 1.299 7.369 -5.159) 9.089 9.722 ( -4.872 -4.110 1.557) 6.561 11.054 ( -5.246 4.638 7.812) 10.491 11.802 ( 3.471 -9.349 4.983) 11.148 12.129 ( 15.908 -6.247 -0.314) 17.094 12.420 ( 3.435 4.955 -0.223) 6.033 12.749 ( -3.224 0.961 -0.140) 3.368 13.370 ( 8.538 -2.299 -3.249) 9.421 18.579 ( 3.609 -3.043 -0.460) 4.743 18.912 ( 7.125 -0.820 -1.683) 7.366 19.252 ( 1.364 -4.569 -1.446) 4.983 19.461 ( -3.964 -4.882 -2.683) 6.837 20.720 ( 0.635 -3.102 7.092) 7.767 21.006 ( 2.562 -3.950 2.169) 5.184 27.592 ( -2.001 1.603 -0.996) 2.751 27.762 ( 0.324 2.492 -0.043) 2.513 37.247 ( -15.185 2.111 1.794) 15.436 37.308 ( 2.888 10.893 -3.420) 11.777 38.633 ( -16.333 11.427 7.573) 21.323 40.178 ( 4.901 -0.035 -27.976) 28.402 ======================= Grid point 68 (58/371) ======================= q-point: ( 0.23 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.227 ( -6.596 22.110 15.380) 27.728 3.789 ( -2.811 27.075 7.050) 28.119 4.606 ( -5.843 1.731 -6.596) 8.980 6.405 ( 9.650 -2.794 -3.663) 10.694 6.587 ( 2.297 4.074 6.639) 8.121 7.085 ( -21.311 1.622 -14.583) 25.874 7.746 ( -18.797 6.195 6.034) 20.691 8.006 ( 6.860 -8.093 6.322) 12.350 8.430 ( 5.151 -1.139 -2.044) 5.657 9.309 ( 4.816 10.249 0.756) 11.349 9.475 ( -1.223 1.345 1.034) 2.092 9.617 ( -3.676 5.481 1.253) 6.718 11.078 ( -0.915 2.143 4.532) 5.096 11.668 ( -4.489 -20.223 5.729) 21.492 12.170 ( 0.426 6.523 -2.211) 6.900 12.666 ( -1.819 10.413 1.056) 10.624 12.808 ( 21.410 -8.524 1.324) 23.083 13.452 ( 6.440 -4.682 -2.062) 8.225 18.547 ( 0.064 -7.395 0.945) 7.455 19.051 ( 7.963 3.964 -2.578) 9.262 19.142 ( -5.105 -9.349 -3.517) 11.218 19.401 ( 2.070 -2.265 -1.014) 3.232 20.726 ( 0.009 -4.288 6.807) 8.045 21.014 ( 1.831 -4.471 2.217) 5.315 27.582 ( -0.904 2.292 -0.712) 2.564 27.778 ( -0.870 1.940 -0.147) 2.132 37.042 ( -13.694 3.455 1.266) 14.180 37.459 ( 4.621 12.234 -5.043) 14.016 38.466 ( -18.967 9.832 5.529) 22.068 40.172 ( 8.486 3.238 -25.785) 27.338 ======================= Grid point 69 (59/371) ======================= q-point: ( 0.31 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.441 ( -0.741 18.448 12.746) 22.435 3.987 ( -4.904 19.021 5.262) 20.336 4.543 ( 2.035 -1.309 -9.423) 9.728 6.412 ( 0.667 -8.554 1.851) 8.778 6.634 ( -3.144 5.297 -9.461) 11.289 6.949 ( -0.587 12.424 1.862) 12.576 7.545 ( -14.405 6.906 9.578) 18.626 8.026 ( 3.616 -10.247 2.858) 11.236 8.516 ( 7.923 2.356 -10.174) 13.109 9.301 ( -9.437 -8.637 -2.466) 13.028 9.560 ( 6.119 17.536 6.379) 19.638 9.745 ( -0.199 14.256 6.848) 15.817 11.047 ( -0.335 -12.465 1.808) 12.600 11.504 ( -0.258 -8.114 8.664) 11.873 12.264 ( 1.829 10.720 -3.689) 11.484 12.672 ( -4.837 7.465 -0.569) 8.913 13.055 ( 15.156 -9.968 0.914) 18.163 13.435 ( -0.409 -9.175 -1.157) 9.256 18.505 ( 2.846 -6.111 1.443) 6.894 18.917 ( -7.805 -10.057 -1.845) 12.864 19.192 ( 5.500 4.474 -5.237) 8.815 19.424 ( 2.664 -2.533 0.401) 3.698 20.713 ( -0.639 -4.219 5.739) 7.151 21.004 ( 0.879 -4.463 1.912) 4.934 27.599 ( 0.574 2.590 -0.512) 2.702 27.770 ( -1.837 1.301 -0.154) 2.256 36.902 ( -7.462 3.918 -0.016) 8.428 37.624 ( 4.896 11.409 -5.375) 13.528 38.309 ( -14.322 10.283 5.213) 18.385 40.206 ( 6.397 2.643 -21.874) 22.943 ======================= Grid point 70 (60/371) ======================= q-point: ( 0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.643 ( 2.097 9.499 7.330) 12.180 4.072 ( -3.944 13.079 4.231) 14.301 4.515 ( 4.217 -3.645 -11.855) 13.101 6.366 ( -0.046 -4.920 4.358) 6.572 6.632 ( 3.257 5.133 -9.029) 10.885 6.962 ( -16.023 10.996 5.997) 20.338 7.641 ( 9.595 7.677 10.589) 16.222 7.979 ( 0.758 -7.325 0.864) 7.415 8.607 ( 2.594 7.489 -11.074) 13.618 9.056 ( -3.092 -12.478 -6.498) 14.404 9.786 ( -2.190 14.109 1.730) 14.383 9.960 ( 3.018 17.117 12.953) 21.676 10.910 ( 1.477 -18.826 6.305) 19.909 11.564 ( 5.370 -0.711 5.998) 8.082 12.367 ( 1.930 9.218 -6.900) 11.675 12.651 ( -5.281 5.132 0.721) 7.399 13.102 ( 1.718 -12.502 2.092) 12.792 13.276 ( -5.986 -5.819 -2.282) 8.654 18.546 ( 7.488 -5.003 0.445) 9.017 18.704 ( -6.148 -7.987 -1.008) 10.129 19.252 ( 0.205 3.512 -4.261) 5.526 19.428 ( 0.237 -2.566 0.765) 2.688 20.692 ( -0.624 -3.066 4.171) 5.215 20.980 ( -0.082 -3.855 1.333) 4.080 27.640 ( 1.665 2.393 -0.421) 2.945 27.749 ( -1.593 0.911 -0.107) 1.838 36.884 ( 1.532 3.071 -0.800) 3.525 37.762 ( 3.478 8.464 -4.845) 10.354 38.262 ( -6.813 10.635 5.686) 13.851 40.188 ( 1.796 0.687 -17.292) 17.399 ======================= Grid point 71 (61/371) ======================= q-point: ( 0.46 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.762 ( 4.864 0.112 3.338) 5.900 4.191 ( 1.942 10.668 4.833) 11.872 4.516 ( 5.823 -1.090 -9.909) 11.545 6.341 ( -1.275 -2.414 1.665) 3.198 6.706 ( 4.150 -1.956 -3.054) 5.511 6.808 ( -15.199 13.074 4.854) 20.628 7.817 ( 0.167 -6.042 3.962) 7.227 8.071 ( 13.727 4.160 4.319) 14.979 8.544 ( -12.140 8.940 -9.901) 18.037 9.014 ( 15.235 -10.072 -6.399) 19.352 9.819 ( -7.950 10.920 1.161) 13.557 10.192 ( -0.386 12.973 7.123) 14.805 10.821 ( 2.813 -17.962 8.389) 20.023 11.689 ( 6.803 0.684 3.638) 7.745 12.378 ( -4.318 0.777 -4.160) 6.046 12.626 ( -2.705 5.337 2.087) 6.337 12.925 ( -9.539 -7.319 1.211) 12.084 13.180 ( -2.232 -0.320 -2.976) 3.734 18.536 ( -1.373 -6.835 -2.464) 7.395 18.678 ( 8.484 -2.625 1.980) 9.099 19.223 ( -4.727 2.259 -2.976) 6.025 19.389 ( -2.752 -1.954 0.702) 3.447 20.684 ( 0.218 -1.339 2.452) 2.803 20.945 ( -0.936 -2.745 0.701) 2.983 27.681 ( 1.103 1.160 -0.369) 1.643 27.746 ( 0.388 1.272 -0.056) 1.331 36.995 ( 9.488 1.544 -0.818) 9.647 37.835 ( 0.880 4.173 -4.154) 5.953 38.342 ( 0.668 10.166 6.000) 11.823 40.103 ( -2.418 -1.187 -12.162) 12.457 ======================= Grid point 72 (62/371) ======================= q-point: ( 0.54 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.871 ( 7.570 -1.904 3.062) 8.385 4.365 ( 5.646 6.772 3.877) 9.632 4.567 ( 5.975 -0.491 -7.002) 9.218 6.272 ( -6.654 0.555 -3.442) 7.512 6.619 ( -10.263 0.943 14.680) 17.937 6.881 ( 9.966 3.484 -9.215) 14.013 7.739 ( -3.411 -3.455 0.204) 4.860 8.260 ( 1.437 -5.415 -0.223) 5.607 8.466 ( 3.709 8.784 -2.406) 9.834 9.198 ( 15.806 -3.397 -4.100) 16.679 9.760 ( -10.364 7.969 0.418) 13.080 10.211 ( -12.337 4.193 1.036) 13.072 10.754 ( 6.133 -13.166 5.768) 15.627 11.809 ( 4.085 0.207 0.404) 4.110 12.285 ( -6.056 0.790 9.733) 11.490 12.660 ( -4.959 -4.032 -5.656) 8.535 12.709 ( -5.723 6.090 -1.058) 8.423 13.144 ( -1.794 1.167 -0.802) 2.286 18.474 ( 1.141 -3.245 -1.307) 3.680 18.815 ( 9.452 -2.313 1.356) 9.825 19.115 ( -8.370 0.900 -2.208) 8.703 19.323 ( -3.778 -0.574 0.735) 3.891 20.700 ( 1.242 0.064 1.005) 1.599 20.906 ( -1.801 -1.420 0.223) 2.304 27.698 ( 1.103 -0.160 -0.271) 1.147 27.776 ( 1.021 1.425 -0.024) 1.753 37.196 ( 13.807 0.579 -0.423) 13.825 37.824 ( -1.786 -0.708 -3.263) 3.787 38.526 ( 6.487 9.417 5.640) 12.750 39.972 ( -4.782 -2.864 -6.960) 8.917 ======================= Grid point 73 (63/371) ======================= q-point: (-0.38 -0.62 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.987 ( 5.939 -0.850 1.887) 6.289 4.499 ( 4.097 -0.247 1.755) 4.464 4.609 ( 3.197 -0.633 -4.568) 5.611 6.100 ( -11.974 1.333 -3.538) 12.557 6.610 ( -3.371 4.661 11.611) 12.958 7.067 ( 17.098 -2.126 -7.626) 18.842 7.690 ( 1.921 -0.373 -0.342) 1.986 8.177 ( -3.122 -4.179 3.071) 6.053 8.660 ( 10.888 1.978 -0.321) 11.071 9.340 ( 5.599 -2.897 -4.748) 7.892 9.636 ( -12.999 4.942 -2.106) 14.066 9.924 ( -15.987 -5.787 1.108) 17.038 10.901 ( 13.650 2.546 3.291) 14.270 11.787 ( -6.474 0.894 -1.438) 6.692 12.222 ( -14.557 -4.999 7.205) 16.994 12.450 ( -0.347 -0.087 -6.360) 6.370 12.796 ( 4.260 4.582 -0.125) 6.257 13.123 ( -2.645 1.165 1.284) 3.163 18.494 ( 3.896 -0.585 -1.195) 4.117 18.916 ( -2.079 -3.065 5.362) 6.517 18.984 ( -0.750 1.706 -5.376) 5.690 19.280 ( -1.833 0.967 0.983) 2.294 20.732 ( 1.927 0.500 0.047) 1.991 20.862 ( -2.765 -0.057 -0.035) 2.766 27.717 ( 1.999 -0.994 -0.333) 2.257 27.794 ( -0.310 0.892 0.199) 0.965 37.427 ( 12.995 0.943 -0.094) 13.029 37.740 ( -2.726 -5.455 -1.914) 6.392 38.763 ( 7.709 8.772 4.220) 12.417 39.843 ( -3.112 -4.213 -2.142) 5.659 ======================= Grid point 75 (64/371) ======================= q-point: (-0.31 -0.62 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.042 ( 0.254 -0.576 0.406) 0.749 4.508 ( 2.290 -7.364 -0.632) 7.738 4.618 ( -1.390 3.969 -1.298) 4.401 5.918 ( -7.921 -0.232 -2.900) 8.439 6.671 ( -0.356 5.631 1.317) 5.794 7.252 ( 7.942 0.191 1.136) 8.025 7.867 ( 17.704 -3.220 3.107) 18.260 8.147 ( 3.006 -2.282 6.247) 7.299 8.797 ( 4.083 -2.828 -1.769) 5.272 9.232 ( -10.797 0.140 -5.558) 12.144 9.408 ( -10.821 -1.877 -2.383) 11.238 9.760 ( -2.324 -3.346 1.413) 4.312 11.217 ( 14.675 10.932 -0.136) 18.300 11.614 ( -16.131 4.400 -5.559) 17.621 11.882 ( -18.127 -5.331 3.801) 19.273 12.493 ( 7.496 -5.486 -4.582) 10.358 12.912 ( 5.796 1.689 0.769) 6.086 13.089 ( -4.132 1.138 2.897) 5.173 18.556 ( 3.596 0.441 -1.520) 3.928 18.774 ( -8.113 -3.049 2.088) 8.915 19.057 ( 4.737 2.087 -0.705) 5.224 19.298 ( 1.142 2.514 0.844) 2.888 20.765 ( 1.714 -0.531 -0.319) 1.822 20.819 ( -3.077 1.848 -0.184) 3.594 27.737 ( 2.164 -1.850 -0.566) 2.902 27.785 ( -1.659 0.421 0.549) 1.798 37.533 ( -3.883 -2.539 0.862) 4.719 37.711 ( 10.382 -4.297 -1.466) 11.332 38.921 ( -1.281 6.764 2.341) 7.271 39.824 ( 7.010 -3.368 1.534) 7.927 ======================= Grid point 76 (65/371) ======================= q-point: (-0.23 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.973 ( -8.658 0.006 0.465) 8.670 4.463 ( 2.101 -8.463 -2.396) 9.043 4.670 ( -1.308 12.831 5.104) 13.870 5.828 ( 1.081 -3.310 -3.678) 5.065 6.692 ( -0.260 3.051 -7.542) 8.140 7.403 ( 4.883 7.056 8.290) 11.931 7.898 ( -3.839 -17.721 8.732) 20.125 8.395 ( 7.229 5.616 -0.886) 9.196 8.709 ( 4.379 -7.360 0.433) 8.575 9.147 ( -6.022 8.913 -1.689) 10.888 9.256 ( 1.425 -7.631 -4.057) 8.759 9.700 ( -1.851 -4.012 -0.578) 4.456 11.295 ( -15.957 5.900 -9.434) 19.453 11.575 ( 9.792 13.616 -0.853) 16.793 11.638 ( -13.235 -0.568 9.374) 16.228 12.513 ( 7.747 -9.246 -8.485) 14.748 13.005 ( 2.802 -0.141 0.587) 2.867 13.043 ( -2.434 -0.680 2.622) 3.642 18.550 ( -5.286 0.427 0.398) 5.318 18.686 ( 2.726 -5.734 -0.209) 6.352 19.170 ( 5.641 4.275 0.883) 7.132 19.352 ( 1.150 3.512 0.080) 3.696 20.746 ( -2.986 0.102 0.255) 2.998 20.825 ( 1.343 1.543 -0.559) 2.121 27.737 ( -0.156 -1.781 -0.201) 1.799 27.764 ( -0.668 -0.511 0.154) 0.855 37.395 ( -6.787 -5.761 2.606) 9.276 37.848 ( 8.776 -1.697 -2.765) 9.356 38.868 ( -11.598 4.343 3.000) 12.743 40.017 ( 16.135 -0.744 1.207) 16.197 ======================= Grid point 77 (66/371) ======================= q-point: (-0.15 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.787 ( -16.176 3.449 2.703) 16.759 4.372 ( -6.188 -2.401 -1.869) 6.896 4.889 ( 4.922 17.751 8.793) 20.412 5.845 ( 8.787 -5.906 -5.460) 11.912 6.653 ( -1.459 1.766 -9.731) 9.997 7.538 ( -8.968 -11.182 1.768) 14.443 7.682 ( 2.848 0.544 10.333) 10.732 8.332 ( -8.751 -1.223 10.015) 13.356 8.812 ( -3.319 5.961 -6.249) 9.252 9.099 ( 3.072 -5.215 -7.956) 9.996 9.306 ( 10.955 -5.129 0.021) 12.096 9.635 ( -0.695 -3.992 0.527) 4.086 11.166 ( -4.269 9.597 -0.122) 10.505 11.467 ( -14.376 2.842 11.549) 18.658 11.850 ( 9.651 10.447 -6.639) 15.696 12.488 ( 6.221 -9.589 -9.866) 15.099 12.960 ( -6.663 2.182 3.010) 7.630 13.072 ( 5.748 -5.079 -2.178) 7.973 18.462 ( -4.355 -0.759 1.031) 4.539 18.699 ( 5.487 -6.977 -0.729) 8.906 19.308 ( 3.733 4.683 0.733) 6.033 19.405 ( 2.594 3.464 -0.272) 4.336 20.699 ( -3.702 1.370 1.031) 4.080 20.863 ( 2.424 0.298 -0.278) 2.458 27.708 ( -1.591 -0.634 0.533) 1.793 27.748 ( -0.184 -1.577 -0.800) 1.778 37.259 ( -5.953 -4.139 3.975) 8.269 37.905 ( 2.816 -2.895 -4.889) 6.341 38.723 ( -13.470 6.340 5.891) 16.011 40.276 ( 15.536 -0.773 -2.829) 15.810 ======================= Grid point 78 (67/371) ======================= q-point: (-0.08 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.568 ( -19.901 8.709 5.950) 22.523 4.183 ( -16.702 2.953 -0.960) 16.988 5.166 ( 0.059 18.502 5.521) 19.308 5.924 ( 11.808 -6.796 -7.977) 15.788 6.583 ( -3.463 1.364 -6.629) 7.602 7.206 ( -5.542 -16.125 -1.029) 17.082 7.898 ( 0.251 12.005 13.836) 18.320 8.266 ( -3.334 -6.158 14.857) 16.425 8.714 ( -8.382 9.617 -6.368) 14.259 9.013 ( -0.134 -4.781 -16.771) 17.440 9.452 ( 12.571 -9.113 3.281) 15.869 9.611 ( 1.159 -3.365 1.853) 4.013 11.257 ( -2.362 2.259 11.409) 11.868 11.373 ( -6.355 11.462 5.927) 14.384 11.960 ( 1.393 -0.347 -10.318) 10.418 12.466 ( 6.704 -4.630 -8.779) 11.977 12.904 ( -4.260 2.435 2.818) 5.658 13.104 ( 6.394 -4.692 -3.901) 8.838 18.416 ( -0.998 -0.542 0.097) 1.139 18.726 ( 6.813 -7.554 -0.010) 10.173 19.345 ( -2.202 3.251 -1.348) 4.151 19.518 ( 6.346 1.554 0.523) 6.555 20.668 ( -2.916 1.866 2.469) 4.252 20.905 ( 2.933 -0.704 0.355) 3.037 27.687 ( -0.844 0.141 0.418) 0.952 27.718 ( -1.276 -1.116 -1.035) 1.986 37.174 ( -4.278 -0.451 4.095) 5.939 37.832 ( -4.145 -3.888 -5.343) 7.800 38.641 ( -10.761 10.684 8.171) 17.226 40.440 ( 9.973 -3.050 -9.304) 13.976 ======================= Grid point 80 (68/371) ======================= q-point: ( 0.08 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.702 ( -12.934 10.625 7.910) 18.514 4.074 ( -16.073 10.373 0.872) 19.150 5.232 ( -14.928 -3.372 -6.111) 16.479 5.832 ( 10.723 -3.696 -5.916) 12.792 6.545 ( -2.155 1.523 2.807) 3.852 7.293 ( 15.780 10.332 5.575) 19.668 8.036 ( -2.139 -14.837 -0.462) 14.998 8.385 ( -14.544 12.209 10.209) 21.560 8.648 ( -0.936 -3.394 -11.041) 11.589 8.838 ( 6.439 3.459 0.312) 7.316 9.395 ( 0.892 0.088 -4.897) 4.978 9.615 ( 7.427 -5.199 3.441) 9.697 11.393 ( -10.005 5.354 9.071) 14.527 11.626 ( -1.669 -6.868 2.773) 7.592 11.770 ( 1.076 3.608 5.908) 7.005 12.346 ( 8.909 -3.566 -9.644) 13.605 12.888 ( -3.587 -0.574 0.658) 3.692 13.115 ( 6.272 0.480 -2.291) 6.695 18.468 ( 1.351 4.968 -1.423) 5.342 18.662 ( 7.476 -5.831 0.647) 9.503 19.307 ( -5.100 -0.202 -1.459) 5.308 19.527 ( 1.316 -4.985 -0.329) 5.166 20.719 ( -0.617 0.495 2.580) 2.698 20.913 ( 2.686 -2.843 0.753) 3.983 27.661 ( -1.707 0.928 -0.466) 1.997 27.733 ( 1.056 1.637 -0.116) 1.951 37.246 ( 1.218 5.434 -2.444) 6.081 37.659 ( -8.536 1.458 2.866) 9.121 38.919 ( -1.627 7.045 4.033) 8.279 40.178 ( -4.089 -4.166 -13.383) 14.601 ======================= Grid point 81 (69/371) ======================= q-point: ( 0.15 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.627 ( -15.345 14.927 9.211) 23.305 3.993 ( -10.066 17.002 4.019) 20.163 4.934 ( -12.430 -4.952 -5.110) 14.323 5.973 ( 13.850 -2.915 -5.144) 15.059 6.563 ( -0.617 2.343 6.001) 6.471 7.652 ( 10.517 10.207 1.503) 14.733 7.772 ( -10.937 -12.173 -11.020) 19.729 8.279 ( -12.882 9.414 0.222) 15.956 8.487 ( -8.229 -9.943 7.836) 15.099 9.033 ( 11.140 5.035 0.220) 12.227 9.406 ( 1.786 7.893 -6.762) 10.546 9.675 ( 3.537 -6.454 2.017) 7.631 11.344 ( -12.654 9.155 12.128) 19.774 11.662 ( 8.975 -8.391 7.563) 14.428 11.822 ( 7.162 -7.357 2.995) 10.695 12.397 ( 4.736 1.317 -6.828) 8.413 12.824 ( -4.206 1.816 -0.778) 4.647 13.212 ( 6.895 -0.413 -2.805) 7.455 18.529 ( 1.185 1.482 0.001) 1.897 18.753 ( 9.241 -2.193 -1.263) 9.581 19.219 ( -2.804 -3.078 -1.291) 4.359 19.460 ( -2.553 -5.379 -1.152) 6.065 20.728 ( -0.305 -0.596 3.446) 3.511 20.932 ( 2.908 -3.857 1.028) 4.939 27.640 ( -2.167 1.956 -0.316) 2.937 27.770 ( 1.225 1.904 -0.325) 2.287 37.330 ( 3.162 8.988 -4.961) 10.742 37.521 ( -13.083 2.323 4.918) 14.169 38.955 ( -6.524 6.837 5.121) 10.749 39.998 ( -1.575 -2.895 -18.802) 19.088 ======================= Grid point 82 (70/371) ======================= q-point: ( 0.23 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.620 ( -10.099 17.212 9.902) 22.278 4.091 ( -3.216 18.917 6.003) 20.105 4.689 ( -9.361 -4.439 -4.150) 11.161 6.157 ( 13.918 -3.699 -2.531) 14.621 6.634 ( 1.693 3.905 7.722) 8.817 7.304 ( -21.243 -6.318 -18.864) 29.104 7.843 ( 6.128 -2.520 1.284) 6.750 8.192 ( -10.637 9.128 -0.120) 14.017 8.320 ( -4.984 -4.699 3.349) 7.625 9.283 ( 10.310 5.999 6.096) 13.395 9.542 ( 4.695 11.588 -2.663) 12.783 9.640 ( -0.328 -3.511 0.709) 3.597 11.237 ( -12.704 -0.310 6.287) 14.177 11.630 ( -4.241 -9.697 9.922) 14.508 12.044 ( 18.727 -2.211 2.827) 19.068 12.489 ( 8.946 0.848 -2.716) 9.387 12.794 ( -2.688 4.928 -1.397) 5.785 13.293 ( 6.451 -2.738 -3.352) 7.768 18.512 ( -1.721 -3.770 1.457) 4.393 18.911 ( 10.530 2.923 -3.679) 11.531 19.125 ( -3.386 -7.372 -0.265) 8.117 19.369 ( -1.543 -2.709 -1.529) 3.473 20.729 ( -0.523 -1.684 3.695) 4.094 20.945 ( 2.617 -4.106 1.138) 5.000 27.626 ( -1.922 2.543 -0.129) 3.190 27.798 ( 0.364 1.463 -0.409) 1.562 37.328 ( -15.505 3.459 2.845) 16.139 37.466 ( 4.555 10.002 -4.186) 11.761 38.853 ( -15.378 4.928 4.780) 16.841 39.932 ( 7.130 0.252 -19.360) 20.633 ======================= Grid point 83 (71/371) ======================= q-point: ( 0.31 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.695 ( -5.250 13.501 7.610) 16.363 4.239 ( -3.239 14.407 4.245) 15.364 4.507 ( -5.566 -3.438 -4.170) 7.758 6.284 ( 7.036 -6.102 1.815) 9.489 6.731 ( -4.863 4.447 0.373) 6.600 6.945 ( 0.404 0.164 -9.946) 9.955 7.870 ( 3.019 -9.825 3.371) 10.817 8.036 ( -20.074 12.867 7.793) 25.085 8.320 ( 7.649 0.856 -12.527) 14.703 9.366 ( -5.699 -8.355 2.439) 10.403 9.671 ( 3.534 17.495 1.078) 17.881 9.824 ( 10.678 9.734 7.179) 16.134 10.990 ( -9.238 -15.139 1.538) 17.802 11.563 ( -5.025 0.733 10.677) 11.823 12.282 ( 6.621 7.536 -2.652) 10.375 12.653 ( 13.331 -7.243 -0.619) 15.184 12.820 ( 1.707 3.764 1.056) 4.266 13.319 ( 3.546 -6.036 -3.460) 7.809 18.452 ( -1.212 -3.880 1.548) 4.350 18.948 ( -7.113 -7.480 -2.337) 10.583 19.091 ( 8.567 2.618 -1.965) 9.171 19.358 ( 2.510 -1.415 -0.774) 2.984 20.717 ( -0.864 -2.234 3.329) 4.101 20.951 ( 1.868 -3.762 1.071) 4.334 27.626 ( -0.974 2.663 0.023) 2.836 27.801 ( -0.938 0.706 -0.387) 1.236 37.122 ( -14.203 2.993 1.827) 14.629 37.620 ( 4.965 10.136 -4.401) 12.114 38.652 ( -15.710 4.440 3.715) 16.743 39.992 ( 9.175 1.075 -16.082) 18.546 ======================= Grid point 84 (72/371) ======================= q-point: ( 0.38 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.742 ( -3.204 4.793 1.932) 6.081 4.271 ( -6.238 7.825 1.655) 10.143 4.412 ( -0.879 -1.139 -3.737) 4.005 6.316 ( 2.380 -5.192 5.040) 7.617 6.632 ( -3.138 4.456 -7.482) 9.256 7.115 ( 10.113 2.654 1.076) 10.511 7.778 ( -8.960 0.307 7.614) 11.762 7.960 ( -4.731 5.726 3.392) 8.165 8.432 ( 11.858 2.605 -11.086) 16.440 9.113 ( -13.500 -8.445 -2.841) 16.175 9.881 ( 4.178 9.505 0.852) 10.417 10.151 ( 5.443 18.610 10.456) 22.030 10.743 ( -1.409 -18.551 3.151) 18.869 11.572 ( -2.031 2.661 7.261) 7.996 12.388 ( 1.299 7.748 -7.388) 10.784 12.722 ( 1.501 -0.407 -1.605) 2.234 12.919 ( 8.087 -7.235 4.489) 11.743 13.262 ( -0.811 -5.821 -2.783) 6.503 18.435 ( 2.144 -2.553 0.812) 3.432 18.748 ( -7.689 -5.929 -0.850) 9.746 19.218 ( 5.112 2.326 -2.465) 6.133 19.388 ( 2.460 -1.325 -0.071) 2.795 20.697 ( -0.869 -1.957 2.463) 3.264 20.947 ( 0.903 -2.886 0.796) 3.127 27.645 ( 0.328 2.366 0.099) 2.391 27.780 ( -1.685 0.025 -0.322) 1.715 36.966 ( -8.204 2.404 0.472) 8.562 37.757 ( 3.721 7.467 -3.304) 8.974 38.500 ( -9.977 4.544 3.333) 11.458 40.052 ( 5.793 0.302 -11.716) 13.073 ======================= Grid point 85 (73/371) ======================= q-point: ( 0.46 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.721 ( -0.154 -1.046 -0.412) 1.135 4.264 ( -0.836 3.665 0.498) 3.792 4.408 ( 1.665 0.972 -2.372) 3.057 6.325 ( 0.629 -2.685 2.619) 3.804 6.631 ( 1.453 1.689 -3.509) 4.157 7.183 ( -7.725 5.365 2.859) 9.830 7.756 ( 2.284 -1.875 3.275) 4.411 7.995 ( 1.631 4.487 2.914) 5.593 8.643 ( 15.145 4.549 -5.091) 16.613 8.781 ( -14.118 -8.029 -4.893) 16.962 9.978 ( -1.103 4.952 0.606) 5.109 10.375 ( -2.287 15.160 3.207) 15.663 10.654 ( 4.459 -14.505 6.454) 16.490 11.614 ( 2.468 0.361 2.398) 3.461 12.404 ( -0.714 2.249 -4.945) 5.480 12.713 ( -1.816 1.246 -0.115) 2.206 12.943 ( 0.145 -5.797 2.576) 6.345 13.197 ( -1.310 -0.984 -1.448) 2.187 18.462 ( 2.437 -2.581 -0.839) 3.648 18.616 ( -1.881 -2.035 0.634) 2.842 19.268 ( 0.052 1.206 -1.393) 1.843 19.400 ( 0.031 -0.918 0.209) 0.942 20.683 ( -0.239 -0.869 1.239) 1.532 20.936 ( -0.021 -1.530 0.378) 1.577 27.675 ( 0.784 1.247 0.008) 1.473 27.755 ( -0.747 0.007 -0.167) 0.765 36.919 ( 0.500 1.104 -0.271) 1.241 37.835 ( 1.277 2.958 -1.764) 3.673 38.454 ( -2.627 4.245 2.690) 5.670 40.059 ( 0.849 -0.517 -6.463) 6.539 ======================= Grid point 86 (74/371) ======================= q-point: (-0.46 -0.54 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.757 ( 5.214 -0.952 2.152) 5.720 4.328 ( 5.359 1.209 0.357) 5.505 4.438 ( 3.523 -0.942 -3.207) 4.856 6.309 ( -1.418 0.119 -2.344) 2.742 6.653 ( 3.005 -3.186 2.244) 4.921 7.061 ( -15.167 7.600 2.560) 17.156 7.774 ( -0.523 0.230 -0.446) 0.724 8.116 ( 9.633 -3.076 1.709) 10.255 8.492 ( -8.412 -7.777 -3.175) 11.888 8.941 ( 15.459 7.193 -1.079) 17.085 9.951 ( -6.110 1.927 0.234) 6.411 10.449 ( -8.839 10.460 -2.279) 13.882 10.566 ( 3.864 -14.200 2.319) 14.898 11.682 ( 6.556 -2.446 -2.621) 7.472 12.388 ( -1.622 -0.876 5.908) 6.188 12.695 ( -2.964 1.202 -0.228) 3.207 12.861 ( -6.818 2.429 -2.917) 7.804 13.180 ( -1.010 1.277 0.911) 1.866 18.435 ( -0.608 -1.782 -1.243) 2.256 18.677 ( 7.161 1.086 0.833) 7.291 19.228 ( -5.073 -0.035 -0.105) 5.075 19.375 ( -2.472 -0.184 0.389) 2.509 20.688 ( 0.704 0.399 -0.035) 0.810 20.922 ( -0.907 0.042 -0.031) 0.908 27.681 ( 0.120 -0.948 -0.276) 0.995 27.767 ( 1.336 0.946 0.158) 1.644 36.998 ( 8.915 -0.367 -0.716) 8.951 37.831 ( -1.636 -2.092 -0.168) 2.661 38.520 ( 4.659 3.598 1.774) 6.148 40.006 ( -3.890 -1.159 -0.839) 4.145 ======================= Grid point 88 (75/371) ======================= q-point: (-0.38 -0.54 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.861 ( 7.081 -2.686 1.602) 7.741 4.423 ( 4.899 -2.931 -0.235) 5.714 4.483 ( 6.529 -1.359 -3.544) 7.552 6.243 ( -6.128 2.028 -4.573) 7.910 6.742 ( 9.060 -2.664 10.389) 14.040 6.888 ( -11.199 3.804 -3.434) 12.316 7.749 ( -4.265 4.657 -1.047) 6.401 8.200 ( -0.099 -5.646 8.373) 10.099 8.397 ( 11.436 -9.178 -5.270) 15.582 9.222 ( 9.870 8.041 -2.281) 12.934 9.834 ( -8.379 -1.185 0.425) 8.473 10.129 ( -18.385 -10.640 -5.823) 22.025 10.736 ( 12.528 8.447 0.683) 15.125 11.731 ( 6.214 -4.521 -6.487) 10.057 12.369 ( -4.711 -5.784 8.962) 11.660 12.555 ( -12.884 2.999 -4.719) 14.045 12.822 ( -1.114 4.749 -1.165) 5.015 13.190 ( -1.929 3.042 3.065) 4.730 18.431 ( 2.063 0.170 -1.480) 2.545 18.831 ( 8.133 2.855 1.179) 8.700 19.109 ( -8.835 -0.755 0.504) 8.881 19.332 ( -2.932 0.528 0.798) 3.084 20.710 ( 1.313 1.008 -1.010) 1.939 20.906 ( -1.859 1.497 -0.306) 2.407 27.674 ( 1.125 -1.959 -0.362) 2.287 27.797 ( 0.934 0.636 0.333) 1.178 37.180 ( 14.478 -1.251 -1.425) 14.602 37.746 ( -4.085 -6.357 1.366) 7.679 38.684 ( 10.503 3.046 0.911) 10.973 39.909 ( -7.117 -1.857 4.304) 8.522 ======================= Grid point 89 (76/371) ======================= q-point: (-0.31 -0.54 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.926 ( 6.966 -7.796 -2.093) 10.662 4.403 ( 1.252 -8.878 -3.714) 9.705 4.587 ( 6.763 2.616 -0.536) 7.271 6.095 ( -12.081 2.232 -2.018) 12.450 6.749 ( -5.328 1.640 -4.648) 7.258 7.046 ( 19.769 1.472 11.833) 23.087 7.746 ( -0.424 5.605 0.529) 5.646 8.159 ( -3.107 -5.489 12.946) 14.401 8.535 ( 16.599 -9.228 -7.808) 20.533 9.340 ( -2.612 6.308 -5.887) 9.015 9.637 ( -16.982 -1.164 -3.824) 17.446 9.764 ( -5.058 -11.378 1.038) 12.495 11.077 ( 15.594 13.364 -0.934) 20.558 11.735 ( 2.905 -2.984 -7.409) 8.499 12.104 ( -19.459 -4.460 -4.921) 20.562 12.441 ( -5.035 0.735 3.024) 5.919 12.852 ( 2.274 -0.828 0.673) 2.512 13.193 ( -3.878 3.239 4.066) 6.486 18.482 ( 4.006 1.347 -2.014) 4.682 18.923 ( -8.895 -2.962 5.488) 10.863 19.006 ( 3.965 5.738 -2.905) 7.555 19.316 ( -0.344 1.597 1.277) 2.073 20.735 ( 1.399 0.687 -1.529) 2.183 20.887 ( -2.699 2.708 -0.415) 3.846 27.678 ( 2.045 -2.509 -0.404) 3.262 27.807 ( -0.423 -0.047 0.506) 0.661 37.408 ( 15.729 -1.377 -2.802) 16.035 37.606 ( -5.208 -9.012 2.925) 10.812 38.901 ( 11.005 2.702 0.083) 11.332 39.808 ( -5.511 -2.209 8.250) 10.164 ======================= Grid point 90 (77/371) ======================= q-point: (-0.23 -0.54 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.935 ( 6.521 -9.472 -3.986) 12.171 4.304 ( 2.711 -11.389 -4.288) 12.468 4.752 ( 6.527 8.419 2.889) 11.038 5.904 ( -11.600 1.099 0.199) 11.654 6.674 ( -0.991 -0.372 -8.141) 8.210 7.431 ( 10.608 9.013 12.963) 19.021 7.816 ( 1.924 -7.940 4.921) 9.537 8.207 ( 9.393 1.449 9.433) 13.391 8.613 ( 6.625 -7.206 -8.799) 13.162 9.191 ( -8.390 -4.601 -6.600) 11.625 9.392 ( -11.602 4.996 -0.255) 12.634 9.679 ( -0.298 -5.611 1.023) 5.711 11.424 ( 10.439 11.809 -5.773) 16.785 11.650 ( -11.881 5.017 -5.520) 14.028 11.783 ( -4.691 -4.590 -4.872) 8.174 12.374 ( -3.857 -2.733 1.977) 5.124 12.887 ( 4.674 -4.306 0.581) 6.382 13.162 ( -5.298 1.796 3.590) 6.647 18.546 ( 3.459 0.615 -2.119) 4.103 18.741 ( -10.737 -2.772 2.938) 11.472 19.129 ( 4.625 4.919 0.431) 6.766 19.365 ( 1.936 3.626 0.952) 4.220 20.748 ( 0.842 -0.141 -1.484) 1.712 20.868 ( -2.734 3.496 -0.445) 4.460 27.686 ( 2.158 -2.658 -0.417) 3.449 27.789 ( -1.552 -0.690 0.605) 1.803 37.448 ( -5.588 -8.236 3.930) 10.701 37.620 ( 13.783 -2.636 -4.262) 14.666 39.026 ( 0.226 1.491 0.716) 1.669 39.832 ( 5.894 -0.686 8.829) 10.637 ======================= Grid point 91 (78/371) ======================= q-point: (-0.15 -0.54 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.914 ( 1.272 -5.323 -3.353) 6.419 4.274 ( 7.401 -8.984 -2.421) 11.889 4.994 ( 8.035 13.107 6.870) 16.839 5.766 ( -5.590 -0.446 0.381) 5.620 6.622 ( 0.310 -0.563 -7.641) 7.668 7.600 ( -12.575 -17.744 1.281) 21.786 7.709 ( 5.321 13.451 8.227) 16.642 8.494 ( 1.974 4.037 4.512) 6.368 8.591 ( 12.050 -7.315 2.494) 14.316 9.009 ( -1.775 -9.182 -8.945) 12.941 9.317 ( -5.922 7.924 -0.482) 9.904 9.616 ( -2.048 -3.739 0.055) 4.263 11.364 ( -9.962 8.025 -3.638) 13.300 11.705 ( -1.064 -1.413 -1.459) 2.293 11.762 ( 7.620 8.835 -4.552) 12.523 12.290 ( -1.887 -5.053 -1.142) 5.513 12.928 ( 4.964 -4.216 -0.588) 6.540 13.096 ( -5.892 0.465 2.840) 6.557 18.568 ( -1.363 -6.697 1.422) 6.980 18.583 ( -4.636 3.147 -0.797) 5.660 19.261 ( 6.168 3.439 1.131) 7.152 19.429 ( 0.217 4.702 0.092) 4.708 20.743 ( -0.443 -0.246 -0.786) 0.935 20.862 ( -1.363 2.927 -0.474) 3.263 27.691 ( 1.442 -2.186 -0.341) 2.641 27.756 ( -1.745 -1.014 0.478) 2.074 37.317 ( -4.432 -6.357 4.527) 8.975 37.754 ( 8.712 -2.999 -5.507) 10.734 38.971 ( -7.631 1.290 3.256) 8.397 40.039 ( 12.573 0.692 4.950) 13.530 ======================= Grid point 92 (79/371) ======================= q-point: (-0.08 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.846 ( -4.970 0.222 -0.130) 4.977 4.299 ( 1.921 -3.153 -1.161) 3.870 5.310 ( 7.780 14.387 7.639) 18.052 5.720 ( 1.751 -2.414 -1.581) 3.375 6.593 ( -0.016 0.322 -4.934) 4.945 7.197 ( -12.991 -15.441 -2.945) 20.393 7.956 ( 5.971 11.349 4.665) 13.647 8.452 ( -8.511 1.331 13.729) 16.208 8.730 ( 6.170 -9.551 -1.681) 11.494 8.875 ( 0.985 -4.359 -12.029) 12.833 9.307 ( -1.287 4.542 -2.252) 5.230 9.574 ( 0.524 -3.106 1.345) 3.425 11.387 ( -0.131 9.535 5.808) 11.165 11.652 ( -6.942 5.546 2.191) 9.151 11.880 ( 3.329 -0.810 -6.256) 7.133 12.229 ( 4.232 -6.001 -5.574) 9.219 12.949 ( 1.573 -2.108 -1.758) 3.164 13.030 ( -2.769 -0.282 2.344) 3.639 18.471 ( -4.236 -0.268 0.968) 4.354 18.582 ( 2.517 -3.420 -0.569) 4.284 19.389 ( 4.406 2.163 0.796) 4.972 19.455 ( -0.533 2.814 -0.451) 2.899 20.727 ( -1.316 0.485 0.236) 1.422 20.872 ( 0.445 1.025 -0.223) 1.140 27.688 ( 0.374 -1.116 -0.219) 1.197 27.725 ( -1.088 -0.730 0.148) 1.318 37.237 ( -2.700 -2.714 3.554) 5.223 37.789 ( 2.417 -2.799 -4.545) 5.860 38.890 ( -6.584 3.281 4.321) 8.531 40.238 ( 8.884 -0.344 -0.430) 8.901 ======================= Grid point 187 (80/371) ======================= q-point: ( 0.08 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 371 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.599 ( -0.000 0.000 38.458) 38.458 0.599 ( -0.000 0.000 38.458) 38.458 0.993 ( -0.000 0.000 63.603) 63.603 6.181 ( -0.000 0.000 1.367) 1.367 6.181 ( 0.000 0.000 1.367) 1.367 7.449 ( 0.000 -0.000 -6.501) 6.501 7.449 ( 0.000 -0.000 -6.501) 6.501 8.577 ( 0.000 -0.000 -0.709) 0.709 8.655 ( -0.000 0.000 3.862) 3.862 8.655 ( -0.000 0.000 3.862) 3.862 9.758 ( 0.000 -0.000 -4.435) 4.435 10.641 ( 0.000 -0.000 -2.424) 2.424 11.380 ( -0.000 -0.000 -1.193) 1.193 11.380 ( 0.000 0.000 -1.193) 1.193 11.589 ( -0.000 0.000 1.365) 1.365 11.589 ( -0.000 0.000 1.365) 1.365 13.716 ( 0.000 -0.000 -2.851) 2.851 13.792 ( -0.000 0.000 1.912) 1.912 18.978 ( -0.000 0.000 1.203) 1.203 18.978 ( -0.000 0.000 1.203) 1.203 19.638 ( 0.000 -0.000 -1.083) 1.083 19.638 ( 0.000 -0.000 -1.083) 1.083 21.123 ( -0.000 0.000 3.929) 3.929 22.782 ( 0.000 -0.000 -2.605) 2.605 27.418 ( -0.000 0.000 0.598) 0.598 27.781 ( 0.000 -0.000 -0.720) 0.720 36.885 ( 0.000 -0.000 -2.879) 2.879 36.885 ( 0.000 -0.000 -2.879) 2.879 36.978 ( -0.000 0.000 2.900) 2.900 36.978 ( 0.000 0.000 2.900) 2.900 ======================= Grid point 188 (81/371) ======================= q-point: ( 0.15 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.000 ( 26.642 16.368 19.553) 36.879 1.103 ( 16.708 9.139 35.236) 40.053 2.082 ( 54.852 31.449 36.428) 72.971 6.111 ( -0.623 -5.778 -2.020) 6.152 6.372 ( 7.663 8.656 -2.641) 11.858 7.342 ( -8.993 5.387 -7.719) 13.018 7.567 ( 11.816 -0.653 -3.384) 12.309 7.826 ( -18.009 -22.641 28.148) 40.364 8.607 ( -9.554 8.662 -0.263) 12.899 8.986 ( 11.469 0.697 5.919) 12.926 9.694 ( -3.189 -1.121 -5.952) 6.845 10.050 ( -17.866 -6.764 11.738) 22.421 11.415 ( -4.464 2.969 3.999) 6.689 11.488 ( 3.455 -4.873 -7.632) 9.692 11.691 ( 10.480 6.317 -1.457) 12.323 12.403 ( 27.989 17.297 -26.518) 42.258 13.612 ( -11.467 -7.911 -4.528) 14.649 13.751 ( -3.437 -3.416 0.277) 4.853 18.924 ( -4.707 -2.745 0.823) 5.511 19.022 ( 2.684 2.204 1.551) 3.804 19.580 ( -2.784 -3.210 -2.500) 4.931 19.674 ( 1.083 2.233 -6.163) 6.644 21.134 ( -1.352 -0.798 4.954) 5.197 21.540 ( -51.187 -29.574 50.235) 77.578 27.432 ( 1.636 1.021 0.051) 1.929 27.743 ( -1.386 -1.102 -0.113) 1.774 36.899 ( -0.061 -3.564 2.296) 4.240 36.943 ( -2.018 15.542 -2.043) 15.805 37.155 ( 20.164 -3.097 1.264) 20.439 39.289 ( 98.821 58.596 -110.553) 159.440 ======================= Grid point 189 (82/371) ======================= q-point: ( 0.23 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.682 ( 23.850 13.975 24.103) 36.675 1.777 ( 33.011 21.161 9.943) 40.453 3.368 ( 48.378 26.412 18.590) 58.169 6.068 ( 2.045 -2.328 -1.352) 3.381 6.558 ( 7.975 6.291 2.788) 10.534 7.152 ( -11.382 -0.998 -2.309) 11.657 7.718 ( -0.397 -4.464 11.433) 12.280 7.778 ( 17.427 -4.542 -1.678) 18.087 8.526 ( -9.013 10.974 -5.353) 15.176 9.194 ( 8.574 -1.031 6.600) 10.869 9.593 ( -4.659 0.992 -2.181) 5.239 9.836 ( -11.039 -2.526 9.165) 14.568 11.379 ( -10.358 14.550 -2.605) 18.049 11.476 ( 9.467 -14.595 -2.850) 17.628 11.955 ( 13.314 8.048 -1.049) 15.593 12.634 ( 3.275 4.336 -6.919) 8.798 13.166 ( -21.011 -17.314 -5.775) 27.831 13.651 ( -4.670 -4.072 -1.894) 6.479 18.795 ( -7.096 -4.302 0.526) 8.315 19.100 ( 1.765 3.145 1.449) 3.887 19.469 ( -4.043 -4.683 -3.345) 7.033 19.643 ( -1.443 0.985 -7.634) 7.831 21.023 ( -16.966 -10.010 25.036) 31.856 21.148 ( -4.567 -2.844 9.392) 10.824 27.486 ( 2.990 2.153 -0.589) 3.732 27.712 ( -0.914 -1.159 -0.476) 1.551 36.914 ( 3.882 -2.456 1.511) 4.836 37.089 ( 1.670 17.025 -0.904) 17.131 37.520 ( 24.145 0.360 3.521) 24.403 40.109 ( 31.459 20.285 -69.743) 79.153 ======================= Grid point 190 (83/371) ======================= q-point: ( 0.31 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.335 ( 26.210 14.437 18.789) 35.333 2.564 ( 32.438 23.484 4.283) 40.275 4.264 ( 31.510 14.782 1.765) 34.850 6.112 ( 3.052 0.786 -0.771) 3.245 6.718 ( -4.575 0.199 7.834) 9.074 7.081 ( 12.294 3.029 1.771) 12.785 7.694 ( -3.065 -7.347 8.595) 11.716 8.021 ( 14.743 1.258 -1.779) 14.903 8.498 ( -3.317 13.067 -9.552) 16.522 9.184 ( -3.825 -10.814 -2.812) 11.810 9.626 ( -4.085 8.544 9.938) 13.728 9.755 ( -0.510 1.363 8.390) 8.516 11.311 ( -12.442 16.042 -9.421) 22.381 11.490 ( 9.938 -16.042 2.887) 19.090 12.199 ( 2.752 5.206 -0.564) 5.916 12.467 ( -13.918 -13.181 8.199) 20.848 12.820 ( 0.125 -2.273 -10.817) 11.054 13.496 ( -6.769 -5.602 -4.227) 9.751 18.634 ( -7.364 -4.515 0.192) 8.640 19.112 ( -4.426 0.878 1.347) 4.709 19.342 ( -3.404 -4.381 -3.728) 6.685 19.602 ( 0.272 1.154 -6.304) 6.415 20.850 ( -9.077 -5.757 16.230) 19.466 21.105 ( -3.336 -2.124 4.836) 6.247 27.555 ( 2.900 2.810 -1.139) 4.196 27.690 ( -0.017 -1.205 -0.249) 1.231 36.985 ( 5.685 -0.645 0.251) 5.727 37.291 ( 3.643 16.130 0.595) 16.547 37.960 ( 25.627 1.055 5.364) 26.204 40.253 ( 9.953 9.196 -46.017) 47.971 ======================= Grid point 191 (84/371) ======================= q-point: ( 0.38 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.978 ( 25.651 13.197 14.216) 32.160 3.292 ( 27.931 22.451 1.823) 35.881 4.763 ( 21.298 8.454 -6.599) 23.846 6.094 ( -4.033 -3.247 -5.035) 7.222 6.577 ( -7.201 -3.007 4.539) 9.027 7.402 ( 2.265 -5.347 8.807) 10.550 7.723 ( 15.975 5.607 11.823) 20.650 8.238 ( 5.531 10.103 -2.653) 11.820 8.548 ( 4.664 4.801 -9.055) 11.261 8.945 ( -7.573 -13.700 -3.510) 16.043 9.597 ( -10.465 7.597 5.101) 13.901 9.866 ( -1.124 1.703 6.725) 7.027 11.212 ( -6.867 9.627 -1.651) 11.940 11.532 ( 9.099 -12.061 5.197) 15.977 11.958 ( -14.575 -6.461 3.478) 16.318 12.460 ( 3.294 0.280 -4.216) 5.358 12.832 ( 3.604 1.721 -0.977) 4.112 13.291 ( -7.661 -6.639 -5.667) 11.614 18.489 ( -5.209 -3.605 -0.237) 6.339 18.988 ( -9.614 -2.738 0.787) 10.027 19.263 ( -0.384 -1.031 -3.355) 3.531 19.601 ( 0.888 0.666 -3.660) 3.825 20.767 ( -4.349 -3.093 9.046) 10.503 21.045 ( -3.920 -2.400 3.115) 5.553 27.613 ( 1.695 2.834 -1.506) 3.630 27.689 ( 1.206 -1.077 0.271) 1.639 37.077 ( 5.526 0.684 -1.222) 5.700 37.501 ( 4.065 12.854 2.423) 13.698 38.398 ( 23.081 0.087 5.427) 23.711 40.208 ( 1.978 6.126 -31.673) 32.320 ======================= Grid point 192 (85/371) ======================= q-point: ( 0.46 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.527 ( 19.862 9.169 9.393) 23.807 3.882 ( 20.047 17.119 0.456) 26.366 5.112 ( 17.214 8.160 -8.912) 21.032 5.890 ( -9.377 -5.907 -4.770) 12.066 6.542 ( 0.397 0.108 4.880) 4.897 7.254 ( -8.009 -11.010 6.208) 14.963 8.190 ( 15.234 3.372 11.770) 19.544 8.326 ( -5.153 16.810 -3.185) 17.868 8.626 ( 1.894 -2.414 -7.364) 7.977 8.704 ( 2.388 -11.323 -4.049) 12.260 9.494 ( -11.735 6.234 -0.964) 13.323 9.755 ( -9.681 -5.544 5.774) 12.562 11.360 ( 8.284 9.624 10.311) 16.358 11.619 ( 9.712 -7.264 6.072) 13.563 11.775 ( -6.761 1.137 0.498) 6.874 12.375 ( -6.851 -4.549 -8.770) 12.022 12.907 ( 1.794 2.115 0.607) 2.839 13.103 ( -4.267 -5.181 -3.442) 7.543 18.410 ( -0.862 -1.661 -0.542) 1.949 18.791 ( -10.342 -3.658 0.561) 10.985 19.278 ( 3.249 1.974 -2.274) 4.430 19.581 ( -1.673 -1.275 -1.810) 2.775 20.738 ( -1.218 -1.134 4.275) 4.588 20.969 ( -4.041 -2.347 1.628) 4.948 27.649 ( 1.014 1.994 -1.007) 2.453 27.705 ( 1.206 -0.564 0.301) 1.365 37.153 ( 3.741 1.286 -2.685) 4.781 37.677 ( 3.188 7.830 4.313) 9.491 38.732 ( 15.477 -1.597 1.548) 15.636 40.151 ( 1.305 5.946 -18.665) 19.633 ======================= Grid point 193 (86/371) ======================= q-point: ( 0.54 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.822 ( 4.740 0.864 2.283) 5.331 4.229 ( 8.143 5.941 -0.358) 10.086 5.362 ( 9.459 7.578 -10.712) 16.176 5.729 ( -3.221 -0.635 1.441) 3.585 6.598 ( 2.209 -0.231 5.349) 5.792 7.072 ( -5.307 -8.395 4.301) 10.823 8.156 ( -9.412 -1.336 1.931) 9.700 8.398 ( -4.864 -0.864 -21.583) 22.141 8.620 ( 6.916 7.410 8.306) 13.104 8.798 ( 9.120 -2.173 3.276) 9.931 9.385 ( -3.557 -0.514 3.635) 5.112 9.620 ( -7.049 -0.654 5.791) 9.146 11.485 ( -4.816 1.775 -5.057) 7.205 11.738 ( 2.808 -4.867 6.865) 8.871 11.821 ( 3.297 1.861 3.652) 5.260 12.181 ( 0.453 -0.089 -0.233) 0.517 12.931 ( 0.838 -0.350 -0.254) 0.943 13.026 ( -1.493 -0.512 -0.964) 1.849 18.426 ( 3.116 0.876 -0.613) 3.294 18.615 ( -7.200 -2.497 0.769) 7.659 19.368 ( 5.273 3.342 -1.606) 6.446 19.507 ( -3.723 -2.868 -0.667) 4.747 20.736 ( -0.598 -0.451 1.051) 1.290 20.899 ( -2.459 -1.369 0.637) 2.886 27.675 ( 0.807 0.824 -0.130) 1.161 27.715 ( 0.251 -0.083 0.132) 0.295 37.188 ( 0.962 1.250 -3.905) 4.211 37.788 ( 1.384 1.843 5.921) 6.354 38.856 ( 3.245 -2.269 -6.343) 7.477 40.203 ( 5.975 5.753 -4.430) 9.404 ======================= Grid point 194 (87/371) ======================= q-point: (-0.38 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.702 ( -13.363 -7.989 -3.792) 16.024 4.234 ( -6.389 -7.471 -0.160) 9.832 5.386 ( -5.831 2.400 -9.283) 11.222 5.847 ( 10.075 7.086 7.349) 14.343 6.628 ( -1.186 -3.396 7.129) 7.985 7.009 ( 2.436 -1.330 0.524) 2.824 8.054 ( -0.074 -0.722 -4.065) 4.130 8.118 ( -13.081 -2.978 -20.800) 24.751 8.812 ( 2.630 3.449 7.284) 8.478 8.969 ( 8.933 -0.639 8.407) 12.283 9.401 ( 0.807 2.950 6.435) 7.125 9.567 ( -1.133 0.155 1.367) 1.783 11.259 ( -11.423 -6.723 -14.937) 19.970 11.594 ( -11.804 3.491 -4.094) 12.972 11.908 ( 8.219 -8.708 11.916) 16.893 12.428 ( 10.329 7.574 10.135) 16.333 12.906 ( -1.676 -2.848 -2.572) 4.187 13.060 ( 4.147 4.551 1.847) 6.428 18.449 ( -3.081 1.527 0.755) 3.521 18.598 ( 6.908 1.327 -0.240) 7.038 19.401 ( -3.421 -2.457 0.446) 4.235 19.495 ( 5.174 2.762 -1.586) 6.076 20.694 ( -3.169 -1.564 -1.394) 3.799 20.890 ( 1.305 0.753 0.140) 1.513 27.686 ( 0.142 -0.246 0.351) 0.451 27.714 ( -0.496 0.114 0.257) 0.570 37.166 ( -2.035 0.846 -4.710) 5.200 37.814 ( -0.922 -4.270 6.967) 8.223 38.746 ( -7.707 -1.828 -11.696) 14.126 40.393 ( 10.040 4.943 5.655) 12.539 ======================= Grid point 195 (88/371) ======================= q-point: (-0.31 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.269 ( -23.831 -12.437 -4.193) 27.207 3.905 ( -19.364 -16.913 1.626) 25.761 5.192 ( -12.753 -2.019 -4.089) 13.543 6.156 ( 11.406 7.622 8.552) 16.165 6.583 ( -3.024 -4.781 6.992) 8.994 7.106 ( 6.851 2.850 -1.924) 7.665 7.713 ( -17.765 -6.396 -18.700) 26.574 8.079 ( 5.853 -0.211 -9.065) 10.793 8.812 ( -9.143 5.543 5.275) 11.922 9.080 ( 2.280 -7.951 12.151) 14.699 9.490 ( 2.012 1.675 -0.609) 2.688 9.615 ( 4.121 2.530 -3.689) 6.082 11.041 ( 5.207 -3.915 -9.097) 11.189 11.467 ( -9.570 9.390 -3.058) 13.751 11.994 ( 4.088 -9.115 13.124) 16.494 12.629 ( 0.457 3.667 6.684) 7.638 12.837 ( 0.696 -1.453 -2.926) 3.340 13.236 ( 8.192 5.505 4.133) 10.700 18.442 ( -0.305 3.321 1.456) 3.639 18.772 ( 10.684 3.123 -0.623) 11.148 19.346 ( -1.197 -1.259 1.962) 2.621 19.589 ( 4.163 2.277 -2.082) 5.182 20.606 ( -3.889 -1.837 -3.191) 5.355 20.935 ( 2.489 1.464 -0.424) 2.919 27.683 ( -0.441 0.190 0.017) 0.480 27.699 ( -1.307 -1.175 0.851) 1.952 37.093 ( -4.469 0.415 -5.042) 6.750 37.750 ( -3.302 -9.645 7.275) 12.524 38.479 ( -14.681 -1.827 -12.488) 19.360 40.656 ( 11.240 4.739 9.996) 15.771 ======================= Grid point 196 (89/371) ======================= q-point: (-0.23 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.691 ( -29.183 -14.461 -1.032) 32.585 3.341 ( -28.584 -21.995 4.725) 36.375 4.870 ( -21.924 -8.804 -0.646) 23.635 6.345 ( -0.523 -1.892 7.897) 8.137 6.568 ( 3.206 -0.388 4.047) 5.178 7.080 ( -13.627 -1.513 -11.033) 17.598 7.416 ( 4.619 -2.962 -8.666) 10.258 8.073 ( -3.205 1.171 -5.782) 6.714 8.808 ( 0.725 8.768 0.171) 8.799 9.038 ( -2.709 -10.070 8.122) 13.217 9.481 ( -3.402 -1.595 -4.645) 5.975 9.604 ( 0.598 -0.306 -5.420) 5.462 11.232 ( 14.666 -4.395 -4.151) 15.863 11.478 ( 2.125 17.840 1.254) 18.010 12.013 ( 1.600 -5.755 8.276) 10.207 12.530 ( -11.446 -2.279 -0.849) 11.702 12.970 ( 9.997 3.423 8.791) 13.746 13.432 ( 7.478 4.285 2.815) 9.067 18.518 ( 3.511 5.172 1.637) 6.462 18.965 ( 9.275 2.369 -0.594) 9.592 19.366 ( 2.166 0.871 3.109) 3.888 19.656 ( 3.580 2.089 -2.699) 4.946 20.506 ( -3.753 -1.790 -4.494) 6.123 20.986 ( 2.369 1.403 -0.602) 2.818 27.651 ( -3.157 -0.922 -0.118) 3.291 27.685 ( 0.409 -0.661 0.828) 1.136 36.985 ( -5.658 0.285 -4.951) 7.524 37.606 ( -5.357 -13.355 6.707) 15.876 38.125 ( -18.379 -2.468 -10.732) 21.426 40.937 ( 10.902 5.023 10.136) 15.710 ======================= Grid point 197 (90/371) ======================= q-point: (-0.15 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.060 ( -31.800 -15.432 4.400) 35.620 2.638 ( -34.643 -24.445 8.611) 43.265 4.184 ( -44.631 -23.686 -3.226) 50.630 6.255 ( -5.193 -6.357 7.219) 10.931 6.670 ( 3.824 1.366 5.747) 7.037 6.818 ( -6.987 2.361 -15.204) 16.899 7.486 ( 8.511 -4.586 -8.881) 13.128 7.991 ( -8.937 5.439 5.122) 11.648 8.848 ( -1.814 -17.504 9.637) 20.064 8.974 ( -3.900 14.575 -12.270) 19.447 9.388 ( 4.317 -1.816 -3.276) 5.715 9.643 ( 3.439 2.074 -0.984) 4.135 11.260 ( -0.576 1.279 -5.249) 5.433 11.721 ( 3.949 -2.157 7.021) 8.339 12.131 ( 10.874 1.601 -1.765) 11.132 12.306 ( -9.767 4.378 -2.784) 11.059 13.270 ( 13.543 5.578 15.601) 21.399 13.583 ( 5.897 2.722 1.300) 6.624 18.657 ( 5.589 5.996 1.713) 8.374 19.079 ( 3.451 -0.611 -0.725) 3.579 19.452 ( 4.264 2.103 3.051) 5.650 19.737 ( 5.722 3.691 -4.615) 8.226 20.411 ( -3.301 -1.800 -2.260) 4.387 21.031 ( 1.901 1.109 -0.170) 2.208 27.579 ( -3.866 -1.894 -0.112) 4.306 27.697 ( 0.876 0.157 0.369) 0.964 36.875 ( -5.107 0.711 -4.542) 6.872 37.404 ( -6.852 -14.231 5.023) 16.574 37.744 ( -18.617 -3.554 -7.410) 20.350 41.192 ( 9.397 4.943 4.259) 11.440 ======================= Grid point 198 (91/371) ======================= q-point: (-0.08 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.431 ( -32.394 -15.591 12.473) 38.053 1.866 ( -38.082 -25.258 13.814) 47.739 2.989 ( -62.649 -35.462 -3.244) 72.062 6.201 ( -0.564 -3.797 6.323) 7.397 6.668 ( -4.646 2.215 -21.017) 21.638 6.819 ( 6.345 3.573 16.953) 18.451 7.489 ( 4.156 -4.938 -9.291) 11.313 7.901 ( -11.853 -1.754 10.154) 15.706 8.676 ( -6.115 -2.643 -1.082) 6.749 8.920 ( -3.073 -1.234 -3.336) 4.701 9.588 ( 13.454 6.689 -2.765) 15.277 9.723 ( 3.726 2.844 1.499) 4.921 11.245 ( -0.024 3.061 -4.964) 5.832 11.694 ( -2.302 -6.143 3.611) 7.488 11.979 ( -12.035 -6.944 1.522) 13.977 12.522 ( 12.881 11.272 -9.601) 19.626 13.622 ( 10.150 5.787 7.964) 14.139 13.710 ( 7.978 1.897 5.958) 10.136 18.814 ( 5.436 5.411 1.729) 7.863 19.063 ( -1.866 -2.895 -1.524) 3.766 19.556 ( 4.210 1.778 1.874) 4.940 19.832 ( 5.061 4.060 -14.517) 15.902 20.392 ( 0.891 0.034 16.942) 16.965 21.068 ( 1.347 0.762 0.952) 1.817 27.497 ( -3.536 -1.881 -0.313) 4.018 27.718 ( 1.165 0.449 0.091) 1.252 36.799 ( -2.631 1.890 -3.891) 5.063 37.183 ( -7.697 -10.766 2.104) 13.401 37.398 ( -14.834 -5.734 -2.909) 16.168 41.321 ( 3.534 2.146 -20.725) 21.134 ======================= Grid point 201 (92/371) ======================= q-point: ( 0.15 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( 0.766 30.969 23.299) 38.762 1.524 ( -0.592 36.341 30.007) 47.132 2.109 ( 0.020 44.285 44.595) 62.848 6.161 ( -7.747 1.261 -6.489) 10.183 6.316 ( 6.507 6.598 2.313) 9.551 7.239 ( 5.932 -7.336 -7.700) 12.178 7.627 ( -3.920 17.465 -6.071) 18.901 7.903 ( -9.995 -33.822 21.546) 41.329 8.710 ( 20.588 -2.493 6.711) 21.797 8.872 ( -12.840 4.125 1.157) 13.536 9.648 ( 0.731 -4.959 -7.396) 8.934 10.075 ( 2.585 -22.030 9.505) 24.132 11.230 ( 0.889 -5.588 -2.395) 6.144 11.604 ( -1.395 4.794 -1.093) 5.111 11.776 ( -0.931 11.562 1.189) 11.660 12.211 ( 1.188 28.447 -20.910) 35.325 13.684 ( 0.420 -0.535 -4.324) 4.377 13.810 ( -2.440 1.237 -2.296) 3.571 18.968 ( 1.600 -3.732 2.632) 4.839 18.986 ( -1.060 0.628 0.708) 1.421 19.578 ( -2.017 -3.337 -5.843) 7.024 19.636 ( 1.993 -0.350 -1.040) 2.275 21.161 ( -0.023 -1.653 5.910) 6.137 21.746 ( 0.040 -60.694 38.069) 71.645 27.433 ( 0.076 1.589 0.357) 1.631 27.742 ( -0.282 -1.702 -0.413) 1.774 36.755 ( 5.264 -3.625 -2.356) 6.812 36.976 ( 1.259 7.170 -1.864) 7.515 37.161 ( -8.200 10.676 1.988) 13.608 38.879 ( 1.667 116.454 -82.800) 142.899 ======================= Grid point 202 (93/371) ======================= q-point: ( 0.23 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.749 ( 14.578 31.840 18.749) 39.722 1.890 ( -4.847 36.236 27.386) 45.679 3.105 ( 34.317 39.043 26.556) 58.372 6.041 ( -2.212 0.639 -4.487) 5.043 6.501 ( 7.589 6.283 1.331) 9.942 7.258 ( -1.678 -3.719 -6.314) 7.518 7.465 ( 0.538 -20.269 8.090) 21.831 7.837 ( -0.869 15.778 3.170) 16.117 8.720 ( -8.382 3.446 -4.077) 9.938 9.030 ( 13.508 -2.951 8.421) 16.189 9.578 ( 1.655 -4.460 -4.330) 6.433 9.936 ( -2.973 -13.011 7.073) 15.104 11.231 ( 4.607 -6.370 -0.331) 7.868 11.641 ( -3.545 9.647 -3.110) 10.738 11.866 ( 3.906 12.091 -0.665) 12.723 12.444 ( 13.073 4.450 -11.440) 17.933 13.484 ( -25.868 -2.971 -2.973) 26.207 13.669 ( -4.402 -5.247 -1.513) 7.014 18.906 ( -6.777 -0.245 0.433) 6.795 19.039 ( 5.938 -2.128 2.557) 6.806 19.459 ( -3.151 -5.966 -5.653) 8.802 19.631 ( -0.746 -0.991 -3.394) 3.613 21.154 ( -2.497 -4.514 7.203) 8.860 21.316 ( -13.602 -28.837 27.939) 42.393 27.470 ( 1.692 2.886 -0.111) 3.348 27.712 ( -0.943 -1.322 -0.738) 1.784 36.859 ( 5.876 -1.655 0.970) 6.181 37.149 ( 15.966 5.968 -4.064) 17.523 37.231 ( 0.811 14.147 1.792) 14.283 39.612 ( 23.426 56.881 -67.727) 91.494 ======================= Grid point 203 (94/371) ======================= q-point: ( 0.31 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.320 ( 10.379 23.385 26.357) 36.732 2.470 ( 18.688 38.566 8.120) 43.618 3.988 ( 25.414 22.814 7.635) 34.995 6.068 ( 3.784 2.733 -1.964) 5.064 6.760 ( 12.753 9.173 9.856) 18.545 7.003 ( -9.271 -10.799 -0.771) 14.253 7.518 ( 12.778 -13.197 -0.290) 18.372 7.999 ( -0.450 16.662 3.250) 16.982 8.618 ( -5.175 7.037 -10.478) 13.642 9.101 ( 0.052 -9.387 -2.231) 9.649 9.663 ( 9.110 1.498 9.202) 13.035 9.833 ( -2.426 -7.056 7.513) 10.589 11.239 ( 4.510 -7.977 1.061) 9.225 11.631 ( -8.933 15.847 -6.412) 19.288 12.110 ( 12.056 8.643 -0.322) 14.838 12.582 ( 8.709 -3.581 -3.701) 10.118 12.886 ( -34.652 -10.524 1.045) 36.229 13.525 ( -5.833 -5.943 -4.060) 9.265 18.766 ( -10.080 0.011 0.706) 10.105 19.121 ( 3.651 -2.811 2.459) 5.223 19.322 ( -2.429 -5.722 -6.072) 8.690 19.573 ( -1.535 -1.670 -4.482) 5.024 20.999 ( -9.055 -13.785 16.584) 23.389 21.157 ( -3.052 -5.012 7.143) 9.245 27.535 ( 2.575 3.621 -0.607) 4.484 27.684 ( -0.645 -0.863 -0.703) 1.287 36.937 ( 3.025 3.156 1.309) 4.564 37.383 ( 4.669 13.332 -2.246) 14.304 37.560 ( 24.176 3.994 2.274) 24.609 39.970 ( 12.129 26.023 -48.937) 56.737 ======================= Grid point 204 (95/371) ======================= q-point: ( 0.38 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.859 ( 15.829 20.065 18.787) 31.720 3.174 ( 21.097 32.794 5.206) 39.340 4.478 ( 18.542 9.651 -4.589) 21.401 6.101 ( -1.302 -0.518 -3.831) 4.079 6.701 ( -10.310 -7.844 6.213) 14.367 7.305 ( 20.531 11.949 12.072) 26.647 7.542 ( 8.593 -10.547 -0.981) 13.640 8.183 ( 6.001 9.111 4.141) 11.669 8.573 ( -2.909 10.427 -15.093) 18.574 8.917 ( -6.521 -11.317 -4.350) 13.767 9.781 ( -2.570 -2.702 8.472) 9.257 9.892 ( 5.674 1.332 9.353) 11.020 11.249 ( 4.090 -4.895 1.980) 6.679 11.583 ( -10.779 13.907 -4.049) 18.055 12.220 ( -22.450 -4.834 1.862) 23.040 12.377 ( 2.624 -1.710 3.419) 4.637 12.696 ( 10.239 -3.618 -2.061) 11.054 13.327 ( -7.786 -6.286 -6.049) 11.693 18.602 ( -9.989 -0.173 0.824) 10.025 19.079 ( -4.819 -5.267 0.665) 7.170 19.239 ( -0.343 -1.598 -4.208) 4.514 19.535 ( 2.371 -2.694 -4.057) 5.416 20.850 ( -5.490 -7.969 10.560) 14.323 21.093 ( -3.324 -4.175 4.122) 6.743 27.605 ( 2.109 3.678 -1.179) 4.401 27.673 ( 0.227 -0.265 -0.077) 0.357 37.033 ( 3.134 5.205 0.255) 6.081 37.569 ( 4.111 11.778 0.213) 12.477 38.015 ( 25.649 2.130 2.248) 25.835 40.063 ( 4.833 13.308 -34.434) 37.231 ======================= Grid point 205 (96/371) ======================= q-point: ( 0.46 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.373 ( 16.725 14.583 11.098) 24.810 3.786 ( 17.062 24.732 3.184) 30.215 4.814 ( 19.404 4.890 -7.510) 21.374 5.966 ( -8.258 -4.283 -4.082) 10.159 6.579 ( -2.611 -3.612 7.455) 8.686 7.345 ( -7.584 -4.666 2.196) 9.171 7.956 ( 23.852 4.594 5.716) 24.954 8.385 ( 11.812 -3.601 1.834) 12.484 8.548 ( -4.173 13.083 -14.485) 19.960 8.690 ( -8.332 -3.623 0.626) 9.107 9.743 ( -7.646 1.522 5.004) 9.264 9.870 ( -8.585 -6.455 3.623) 11.335 11.367 ( 8.887 3.881 8.482) 12.883 11.530 ( -4.257 2.876 5.145) 7.270 11.903 ( -10.015 -2.722 2.427) 10.659 12.379 ( -2.980 -3.215 -5.544) 7.068 12.840 ( 7.981 -0.295 0.457) 7.999 13.122 ( -6.121 -4.345 -5.138) 9.097 18.468 ( -6.533 0.588 0.647) 6.591 18.916 ( -8.839 -4.424 -0.232) 9.887 19.229 ( 2.187 0.470 -2.706) 3.511 19.532 ( 2.619 -4.501 -2.795) 5.910 20.773 ( -2.511 -3.736 5.674) 7.243 21.013 ( -3.709 -3.940 2.291) 5.876 27.652 ( 0.774 2.695 -1.443) 3.154 27.689 ( 1.147 0.768 0.650) 1.526 37.129 ( 2.210 6.040 -1.349) 6.571 37.728 ( 2.829 7.781 2.817) 8.746 38.424 ( 21.203 0.973 -0.232) 21.227 40.069 ( 3.036 7.565 -22.031) 23.490 ======================= Grid point 206 (97/371) ======================= q-point: ( 0.54 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.740 ( 9.867 6.262 3.168) 12.108 4.182 ( 7.633 12.279 1.025) 14.494 5.115 ( 17.583 2.102 -8.606) 19.688 5.799 ( -5.483 -1.593 1.155) 5.825 6.588 ( 1.484 -2.446 7.471) 8.000 7.191 ( -9.106 1.233 0.818) 9.225 8.111 ( 0.678 -13.555 -6.989) 15.266 8.451 ( 2.074 0.559 -10.473) 10.692 8.590 ( 5.573 7.893 -4.168) 10.523 8.732 ( 1.127 10.736 12.613) 16.602 9.521 ( -13.582 -3.446 1.295) 14.072 9.759 ( -5.178 -1.848 8.694) 10.287 11.551 ( 7.747 -9.590 9.567) 15.604 11.556 ( -2.142 2.813 -2.282) 4.208 11.878 ( 1.028 4.455 6.884) 8.264 12.202 ( -5.531 -2.100 -5.172) 7.858 12.906 ( 1.427 0.020 -1.953) 2.419 13.038 ( -0.387 -0.343 -0.647) 0.828 18.423 ( -1.017 2.698 0.424) 2.914 18.731 ( -9.088 -2.799 0.112) 9.510 19.289 ( 5.314 1.317 -2.039) 5.842 19.492 ( -0.025 -5.913 -1.769) 6.172 20.749 ( -0.742 -1.000 2.273) 2.592 20.928 ( -3.234 -3.327 1.030) 4.753 27.676 ( 0.405 1.701 -0.582) 1.843 27.717 ( 0.479 1.248 0.464) 1.415 37.195 ( 0.107 6.032 -3.032) 6.752 37.828 ( 0.592 2.715 5.422) 6.093 38.688 ( 11.658 0.573 -6.387) 13.305 40.112 ( 6.247 4.313 -9.270) 11.981 ======================= Grid point 207 (98/371) ======================= q-point: (-0.38 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.794 ( -5.723 -2.762 -2.309) 6.761 4.259 ( -3.664 -1.617 -1.096) 4.152 5.286 ( 8.537 -4.411 -9.010) 13.173 5.824 ( 4.848 5.428 6.393) 9.687 6.627 ( 1.375 -4.148 7.855) 8.988 7.109 ( -6.973 10.535 -1.374) 12.708 7.902 ( -1.153 -13.229 -11.456) 17.538 8.339 ( -13.017 5.912 -10.324) 17.635 8.780 ( 10.708 3.944 0.736) 11.435 8.912 ( 2.544 7.761 9.872) 12.813 9.410 ( 0.906 -3.957 7.776) 8.772 9.696 ( -7.605 1.202 7.348) 10.644 11.345 ( -14.780 -4.871 -14.920) 21.558 11.669 ( 11.552 -11.400 9.925) 19.024 11.760 ( -7.975 -4.081 -1.744) 9.126 12.384 ( 10.939 9.529 10.490) 17.903 12.901 ( -1.228 -0.644 -1.195) 1.830 13.057 ( 2.165 3.129 -0.367) 3.822 18.488 ( 3.813 5.361 0.230) 6.583 18.587 ( -6.174 -0.949 0.711) 6.287 19.383 ( 4.561 -1.044 -1.425) 4.891 19.421 ( 0.643 -3.965 -1.285) 4.218 20.725 ( -2.581 -1.021 -0.343) 2.797 20.879 ( 0.025 -1.274 0.603) 1.410 27.688 ( -0.154 0.507 0.190) 0.563 27.732 ( -0.356 1.521 0.300) 1.591 37.210 ( -2.578 5.389 -4.341) 7.384 37.850 ( -2.277 -2.265 7.518) 8.175 38.737 ( 0.076 0.520 -12.584) 12.595 40.268 ( 11.393 2.406 1.226) 11.709 ======================= Grid point 208 (99/371) ======================= q-point: (-0.31 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.514 ( -19.556 -7.925 -1.900) 21.186 4.052 ( -13.778 -10.039 -0.454) 17.054 5.218 ( -1.555 -9.955 -6.513) 11.997 6.084 ( 11.821 9.013 6.533) 16.238 6.621 ( -1.796 -4.922 7.409) 9.074 7.145 ( -2.798 14.962 -2.601) 15.442 7.713 ( -2.548 -9.168 -18.258) 20.589 8.107 ( -12.215 3.441 -4.061) 13.324 8.926 ( 2.441 -5.150 5.653) 8.027 9.056 ( 1.082 5.338 8.532) 10.122 9.505 ( 5.762 1.949 3.283) 6.912 9.617 ( -6.605 2.092 3.738) 7.872 10.979 ( -9.069 -4.827 -13.434) 16.912 11.635 ( -4.666 3.729 -2.524) 6.485 11.830 ( 12.388 -12.079 12.737) 21.485 12.632 ( 5.971 2.942 7.598) 10.101 12.829 ( -4.548 -1.728 -3.157) 5.800 13.182 ( 7.008 5.390 2.019) 9.069 18.522 ( -3.166 3.229 1.950) 4.925 18.645 ( 8.268 5.178 -0.559) 9.771 19.344 ( -0.396 -3.843 0.972) 3.984 19.491 ( 6.365 -0.901 -2.893) 7.049 20.644 ( -4.430 -1.819 -1.767) 5.104 20.903 ( 2.421 0.486 0.157) 2.474 27.684 ( -0.432 -0.660 0.808) 1.129 27.733 ( -1.565 1.590 -0.047) 2.232 37.168 ( -5.088 4.363 -4.955) 8.335 37.790 ( -5.390 -6.093 8.727) 11.931 38.590 ( -8.876 -0.249 -14.647) 17.128 40.520 ( 14.124 2.022 5.658) 15.349 ======================= Grid point 209 (100/371) ======================= q-point: (-0.23 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.037 ( -27.296 -10.974 2.195) 29.501 3.641 ( -24.259 -11.870 2.869) 27.159 5.023 ( -8.093 -10.298 -3.538) 13.567 6.362 ( 7.110 7.223 3.857) 10.845 6.561 ( -3.075 -4.781 5.843) 8.152 7.233 ( -3.153 11.490 -2.844) 12.249 7.380 ( -14.135 -6.708 -17.447) 23.434 8.051 ( 2.032 3.409 -3.035) 4.996 8.835 ( -2.864 -13.580 6.508) 15.329 9.123 ( -4.749 6.967 7.375) 11.202 9.534 ( -3.847 1.046 -0.980) 4.105 9.574 ( -1.695 -0.295 -4.851) 5.147 10.950 ( 11.002 -0.291 -2.401) 11.265 11.657 ( 0.100 14.263 -3.354) 14.652 11.958 ( 5.792 -7.394 12.617) 15.729 12.684 ( -9.311 -0.536 -1.676) 9.476 12.770 ( 11.245 -8.010 4.579) 14.545 13.363 ( 7.487 4.203 1.475) 8.712 18.559 ( 1.016 5.879 2.507) 6.471 18.834 ( 8.922 4.458 -0.567) 9.989 19.341 ( 2.144 -1.460 2.121) 3.350 19.557 ( 5.896 -1.986 -4.089) 7.445 20.543 ( -4.628 -1.723 -1.862) 5.277 20.953 ( 2.731 0.818 -0.055) 2.852 27.671 ( -0.635 -1.785 1.481) 2.405 27.710 ( -2.604 1.740 -0.908) 3.261 37.081 ( -6.717 3.265 -4.738) 8.845 37.656 ( -8.315 -7.832 8.852) 14.451 38.314 ( -14.578 -1.553 -13.592) 19.992 40.802 ( 14.257 2.254 4.516) 15.124 ======================= Grid point 210 (101/371) ======================= q-point: (-0.15 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.471 ( -31.081 -12.942 8.015) 34.608 3.086 ( -33.734 -10.376 6.492) 35.886 4.636 ( -28.582 -11.809 -3.277) 31.099 6.348 ( -9.935 -3.021 3.861) 11.079 6.618 ( 7.089 0.857 3.543) 7.972 6.940 ( -15.077 -2.063 -10.689) 18.596 7.346 ( 3.022 7.282 -9.604) 12.426 8.110 ( 0.246 1.596 1.886) 2.483 8.752 ( 2.669 -12.802 11.363) 17.324 9.143 ( -5.943 13.238 -2.454) 14.716 9.356 ( -6.699 -5.441 -5.751) 10.371 9.602 ( 3.043 1.991 0.507) 3.672 11.106 ( 9.194 -5.533 0.162) 10.732 11.859 ( -0.099 20.891 -2.126) 20.999 12.017 ( 3.654 -1.432 5.872) 7.063 12.491 ( -10.952 0.742 -2.532) 11.266 12.976 ( 22.849 -14.553 9.310) 28.645 13.508 ( 6.388 2.294 -0.522) 6.808 18.680 ( 3.614 8.055 2.783) 9.257 18.981 ( 5.871 0.023 -0.308) 5.879 19.398 ( 4.410 -0.424 1.089) 4.562 19.621 ( 6.899 -0.015 -5.701) 8.950 20.455 ( -3.751 -1.077 1.557) 4.202 21.004 ( 2.498 0.704 0.359) 2.620 27.628 ( -3.484 -1.559 0.781) 3.896 27.693 ( -0.356 0.952 -0.757) 1.268 36.972 ( -6.887 2.398 -3.663) 8.160 37.475 ( -10.571 -6.576 7.778) 14.679 37.966 ( -17.406 -2.760 -11.018) 20.784 41.048 ( 12.154 1.631 -2.975) 12.619 ======================= Grid point 211 (102/371) ======================= q-point: (-0.08 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.888 ( -32.276 -13.049 15.262) 38.012 2.426 ( -40.875 -9.240 8.310) 42.722 3.801 ( -57.208 -10.104 -0.409) 58.095 6.194 ( -4.644 -4.701 0.454) 6.624 6.674 ( -4.274 -0.585 -10.010) 10.900 6.836 ( 6.502 3.733 11.506) 13.734 7.401 ( 1.301 8.599 -11.507) 14.424 8.052 ( -7.129 -9.244 7.178) 13.704 8.767 ( -1.412 0.546 12.741) 12.831 8.998 ( -10.917 0.460 -11.845) 16.115 9.423 ( 11.621 6.213 1.299) 13.241 9.684 ( 4.144 1.749 1.455) 4.727 11.164 ( 4.978 -3.920 -0.337) 6.345 11.858 ( -11.753 8.925 -0.239) 14.760 12.048 ( -4.700 -6.504 -0.085) 8.025 12.467 ( 4.344 12.148 -3.933) 13.488 13.304 ( 27.249 -15.448 6.967) 32.089 13.613 ( 5.571 0.727 -1.557) 5.830 18.835 ( 4.144 7.047 2.301) 8.493 19.008 ( 0.830 -4.161 -0.432) 4.265 19.475 ( 5.722 -0.830 -1.910) 6.090 19.713 ( 6.092 2.882 -9.522) 11.666 20.459 ( 1.399 0.972 14.638) 14.737 21.052 ( 2.134 0.459 1.517) 2.658 27.551 ( -4.502 -0.829 -0.171) 4.581 27.701 ( 0.956 0.219 -0.429) 1.070 36.878 ( -5.153 2.042 -1.681) 5.792 37.286 ( -11.672 -1.444 5.550) 13.005 37.600 ( -17.342 -3.669 -7.773) 19.355 41.142 ( 4.650 -1.306 -23.230) 23.726 ======================= Grid point 214 (103/371) ======================= q-point: ( 0.15 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.703 ( -11.626 28.306 21.765) 37.552 1.909 ( 3.662 37.633 24.675) 45.150 3.119 ( -35.589 40.113 26.356) 59.751 6.167 ( 4.686 5.670 -3.848) 8.302 6.427 ( -10.952 3.713 2.228) 11.777 7.058 ( 1.911 -10.898 -4.415) 11.913 7.776 ( -2.442 2.467 -1.479) 3.773 7.943 ( -4.967 5.985 10.313) 12.917 8.431 ( 12.423 -6.345 3.328) 14.341 9.108 ( -12.662 0.510 1.824) 12.803 9.532 ( 1.364 -6.515 -7.242) 9.837 9.879 ( 4.761 -13.702 7.560) 16.358 11.157 ( -0.369 -8.042 -2.524) 8.437 11.733 ( -1.668 9.975 -1.446) 10.216 11.862 ( -1.432 13.359 0.305) 13.439 12.404 ( -12.414 1.281 -9.935) 15.951 13.512 ( 18.801 -2.148 -4.672) 19.492 13.730 ( 7.781 -0.843 -0.869) 7.874 18.891 ( 5.331 -2.558 0.317) 5.921 19.023 ( -3.182 -1.868 2.178) 4.285 19.508 ( 1.568 -3.930 -6.260) 7.556 19.589 ( 1.735 -2.561 -2.035) 3.703 21.154 ( 2.530 -4.577 7.334) 9.008 21.319 ( 13.283 -28.192 27.463) 41.538 27.463 ( -1.364 2.279 -0.207) 2.664 27.724 ( 0.586 -0.632 -0.585) 1.042 36.794 ( -11.526 -3.514 -1.507) 12.143 37.005 ( 2.792 8.446 -1.148) 8.969 37.484 ( -15.164 14.139 3.408) 21.011 39.570 ( -22.252 56.325 -69.775) 92.392 ======================= Grid point 215 (104/371) ======================= q-point: ( 0.23 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.029 ( 1.957 32.365 20.064) 38.130 2.476 ( -0.773 34.924 22.749) 41.687 3.354 ( -0.224 46.234 25.607) 52.852 6.112 ( -8.723 3.574 -9.572) 13.435 6.452 ( 5.296 5.491 1.251) 7.731 7.061 ( 10.164 -7.343 0.410) 12.546 7.494 ( -15.897 -18.389 4.502) 24.721 8.054 ( -1.458 21.308 -0.053) 21.358 8.684 ( 12.425 -6.322 4.710) 14.715 8.956 ( -4.215 3.493 1.290) 5.624 9.464 ( 2.165 -4.881 -5.307) 7.528 9.825 ( 1.906 -14.363 4.370) 15.133 11.154 ( 3.249 -0.961 0.141) 3.391 11.710 ( -2.701 7.123 -0.915) 7.672 12.019 ( -2.511 13.493 -0.328) 13.728 12.270 ( 3.276 -2.778 -5.294) 6.817 13.595 ( 1.833 -4.409 -4.036) 6.252 13.773 ( -6.205 -2.024 -3.835) 7.570 18.898 ( 2.957 -6.920 3.597) 8.341 19.020 ( -1.101 2.828 -0.598) 3.093 19.396 ( -1.931 -7.958 -7.842) 11.339 19.605 ( 1.461 -2.208 -0.273) 2.662 21.160 ( -0.036 -8.675 8.917) 12.440 21.269 ( -0.222 -25.628 20.834) 33.029 27.480 ( 0.476 3.098 -0.198) 3.141 27.711 ( -0.709 -0.819 -0.728) 1.305 36.711 ( 4.085 0.948 -1.662) 4.511 37.134 ( 2.295 12.139 -3.608) 12.870 37.413 ( -8.292 13.623 2.505) 16.144 39.658 ( 1.876 53.106 -56.094) 77.268 ======================= Grid point 216 (105/371) ======================= q-point: ( 0.31 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.530 ( 9.369 29.867 19.245) 36.745 2.826 ( -4.487 35.437 18.502) 40.228 3.984 ( 11.813 31.596 10.820) 35.425 6.033 ( 0.650 4.636 -6.547) 8.049 6.640 ( 11.992 6.982 0.412) 13.883 7.106 ( -11.142 -18.860 5.805) 22.662 7.213 ( 9.625 -1.642 2.866) 10.176 8.216 ( -2.333 16.869 0.460) 17.036 8.660 ( -2.551 -1.820 -8.465) 9.027 9.014 ( 1.568 -1.562 -0.914) 2.395 9.537 ( 10.130 0.334 7.816) 12.799 9.752 ( 3.131 -12.010 2.722) 12.706 11.187 ( 0.302 -0.510 3.166) 3.221 11.784 ( 1.249 8.014 -2.505) 8.489 12.072 ( 0.673 9.397 -0.574) 9.438 12.350 ( 10.135 -4.021 -2.763) 11.248 13.394 ( -29.529 -5.113 -1.136) 29.990 13.524 ( -3.944 -6.899 -3.982) 8.888 18.898 ( -2.166 -2.507 1.517) 3.643 19.024 ( 2.457 -1.187 1.896) 3.323 19.244 ( -1.423 -8.507 -8.412) 12.048 19.573 ( -1.965 -2.680 -1.160) 3.520 21.041 ( -4.613 -18.159 15.239) 24.151 21.177 ( -1.738 -6.923 7.278) 10.194 27.532 ( 1.904 3.845 -0.521) 4.322 27.687 ( -0.908 -0.426 -0.674) 1.208 36.863 ( 10.928 1.172 0.458) 11.001 37.283 ( 5.812 13.146 -6.300) 15.694 37.522 ( 2.820 13.900 3.815) 14.687 39.876 ( 5.044 32.900 -44.008) 55.177 ======================= Grid point 217 (106/371) ======================= q-point: ( 0.38 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.021 ( 6.277 23.885 21.264) 32.589 3.274 ( 9.867 34.610 9.246) 37.158 4.351 ( 7.120 14.177 -3.552) 16.257 6.079 ( 1.560 2.016 -5.108) 5.709 6.803 ( -8.749 -12.116 6.103) 16.143 7.042 ( 24.614 5.247 1.475) 25.210 7.373 ( 6.213 3.110 6.816) 9.733 8.264 ( -3.520 2.219 3.280) 5.298 8.582 ( 0.340 2.368 -15.696) 15.878 8.955 ( -6.224 4.345 -3.663) 8.429 9.723 ( 5.579 -9.329 5.985) 12.409 9.812 ( 10.446 1.254 9.423) 14.124 11.210 ( 0.914 -0.116 6.941) 7.002 11.798 ( -5.225 6.406 -4.695) 9.507 12.240 ( 8.015 5.658 -2.679) 10.170 12.465 ( 9.676 -3.604 -1.218) 10.397 12.773 ( -36.133 -5.915 6.261) 37.145 13.355 ( -6.370 -6.287 -5.924) 10.733 18.778 ( -9.877 -1.062 1.135) 9.999 19.064 ( 0.181 -3.997 0.503) 4.033 19.148 ( 5.048 -5.354 -6.162) 9.598 19.491 ( -2.972 -3.431 -1.908) 4.924 20.892 ( -4.206 -11.773 10.793) 16.516 21.116 ( -2.441 -5.577 4.309) 7.458 27.601 ( 2.250 3.985 -1.037) 4.692 27.673 ( -0.302 0.309 -0.171) 0.464 37.035 ( 5.860 4.455 2.390) 7.739 37.504 ( 11.635 9.709 -9.337) 17.800 37.783 ( 11.023 11.634 6.704) 17.372 39.975 ( 2.587 18.365 -33.202) 38.031 ======================= Grid point 218 (107/371) ======================= q-point: ( 0.46 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.419 ( 6.188 19.384 14.888) 25.213 3.809 ( 13.477 26.699 6.034) 30.510 4.557 ( 12.217 5.896 -6.805) 15.176 6.026 ( -5.094 -1.363 -4.361) 6.843 6.632 ( -4.972 -7.636 9.463) 13.137 7.316 ( 9.658 -7.356 -5.981) 13.534 7.678 ( 14.912 13.898 4.684) 20.916 8.226 ( 1.832 -9.467 1.245) 9.723 8.546 ( 2.926 1.522 -9.958) 10.490 8.910 ( -8.816 15.339 -1.024) 17.722 9.758 ( 4.660 -6.705 5.360) 9.768 9.936 ( -2.003 -2.733 4.015) 5.254 11.320 ( 5.538 1.721 11.467) 12.850 11.707 ( -7.795 1.778 -1.695) 8.173 12.124 ( -18.606 -5.689 1.406) 19.507 12.400 ( -5.677 1.487 2.074) 6.224 12.676 ( 11.362 1.700 0.191) 11.490 13.159 ( -6.614 -4.213 -6.370) 10.103 18.612 ( -9.170 -0.821 1.320) 9.301 18.977 ( -4.439 -3.083 -2.672) 6.029 19.181 ( 3.509 -1.925 -1.772) 4.377 19.419 ( 1.181 -5.755 -2.323) 6.318 20.799 ( -2.382 -6.282 6.442) 9.308 21.038 ( -3.029 -5.123 2.441) 6.432 27.655 ( 1.087 2.805 -1.611) 3.412 27.688 ( 0.923 1.774 0.742) 2.132 37.166 ( 2.249 7.383 1.552) 7.873 37.707 ( 8.427 6.432 -5.682) 12.029 38.140 ( 16.733 7.632 4.381) 18.906 39.989 ( 1.790 9.530 -23.298) 25.235 ======================= Grid point 219 (108/371) ======================= q-point: ( 0.54 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.716 ( 4.985 11.704 5.401) 13.820 4.215 ( 7.008 16.178 3.625) 17.999 4.804 ( 16.839 1.219 -4.912) 17.583 5.889 ( -6.919 -1.212 0.271) 7.029 6.585 ( -0.255 -5.150 9.459) 10.774 7.318 ( -1.562 3.432 -4.302) 5.720 7.909 ( 5.731 -3.779 -12.304) 14.090 8.181 ( 10.122 -9.446 -5.148) 14.771 8.652 ( 4.267 7.334 2.856) 8.952 8.948 ( -5.506 15.923 5.314) 17.666 9.731 ( -16.085 -4.719 -1.375) 16.819 9.799 ( 2.386 -4.885 6.736) 8.656 11.413 ( 2.301 -10.959 10.047) 15.044 11.646 ( -4.280 2.531 0.119) 4.974 11.961 ( -2.293 3.420 11.643) 12.350 12.269 ( -8.545 -0.602 -6.109) 10.522 12.843 ( 6.858 2.116 -1.944) 7.436 13.037 ( -2.055 -0.833 -3.252) 3.936 18.504 ( -4.946 1.652 1.336) 5.383 18.841 ( -7.495 -2.313 -1.418) 7.971 19.217 ( 3.345 0.585 -1.669) 3.784 19.384 ( 3.166 -8.051 -2.163) 8.917 20.760 ( -0.668 -2.253 3.210) 3.978 20.950 ( -3.206 -4.493 1.125) 5.633 27.684 ( 0.556 2.198 -0.801) 2.404 27.726 ( 0.664 2.000 0.494) 2.164 37.260 ( -0.368 8.481 -0.569) 8.508 37.838 ( 4.296 2.530 -0.020) 4.985 38.469 ( 14.089 5.372 -1.528) 15.156 40.001 ( 4.465 3.865 -13.148) 14.413 ======================= Grid point 220 (109/371) ======================= q-point: ( 0.62 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.831 ( -1.186 3.225 -1.379) 3.702 4.342 ( -4.730 4.094 0.981) 6.332 5.020 ( 12.927 -4.835 -4.582) 14.543 5.844 ( 0.553 2.204 4.757) 5.272 6.600 ( 1.578 -4.815 8.600) 9.982 7.323 ( -4.388 13.986 -4.917) 15.461 7.756 ( -3.005 -9.681 -13.257) 16.689 8.333 ( 13.230 -1.337 -7.091) 15.070 8.745 ( -1.664 8.615 -1.511) 8.903 9.072 ( -1.984 10.704 11.861) 16.099 9.434 ( -9.319 -8.406 3.766) 13.103 9.818 ( -1.266 -1.346 6.656) 6.908 11.412 ( 4.291 -10.883 3.983) 12.358 11.486 ( -9.123 -5.006 -5.060) 11.571 11.862 ( -12.100 -6.910 1.103) 13.977 12.365 ( 10.017 11.363 9.717) 17.997 12.922 ( -0.001 3.710 -1.990) 4.210 13.020 ( 2.919 -0.623 -2.183) 3.698 18.499 ( 0.107 3.961 0.737) 4.030 18.701 ( -6.976 -0.263 0.175) 6.984 19.280 ( 4.681 -0.333 -1.861) 5.048 19.343 ( 2.338 -7.268 -1.508) 7.782 20.751 ( -1.167 -0.375 0.678) 1.401 20.873 ( -1.539 -3.261 0.685) 3.670 27.703 ( -0.346 1.552 -0.170) 1.599 27.752 ( 0.220 1.706 0.412) 1.769 37.302 ( -3.047 7.996 -2.652) 8.958 37.894 ( 0.197 -1.019 4.951) 5.059 38.649 ( 5.285 4.080 -8.916) 11.139 40.096 ( 10.301 0.563 -3.345) 10.845 ======================= Grid point 221 (110/371) ======================= q-point: (-0.31 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.720 ( -12.246 -2.127 -1.157) 12.483 4.189 ( -12.494 -3.447 -0.270) 12.964 5.054 ( 4.190 -11.359 -4.714) 12.992 6.002 ( 10.121 5.508 4.565) 12.394 6.619 ( 0.756 -4.136 6.584) 7.812 7.385 ( -4.981 20.234 -5.684) 21.600 7.567 ( -1.959 -6.942 -12.310) 14.268 8.338 ( -10.058 2.166 -3.573) 10.892 8.824 ( 4.590 -1.316 0.332) 4.787 9.172 ( -1.790 8.076 7.910) 11.445 9.395 ( 8.211 -4.880 7.760) 12.306 9.788 ( -5.970 0.172 5.911) 8.403 11.085 ( -17.234 -3.737 -15.528) 23.497 11.545 ( 13.171 -11.784 10.709) 20.664 11.681 ( -3.535 -4.252 0.830) 5.592 12.636 ( 4.358 6.570 7.461) 10.855 12.880 ( -4.186 -0.593 -1.684) 4.551 13.116 ( 7.128 3.533 -0.813) 7.997 18.543 ( 0.905 -0.106 -0.428) 1.007 18.664 ( -0.405 7.598 1.942) 7.853 19.288 ( 2.088 -5.856 0.022) 6.217 19.364 ( 5.185 -1.468 -2.813) 6.079 20.695 ( -4.307 -1.280 -0.896) 4.582 20.867 ( 2.130 -0.623 0.626) 2.306 27.699 ( -1.164 0.311 0.456) 1.288 27.768 ( -0.543 1.684 0.065) 1.770 37.282 ( -5.472 6.082 -3.681) 8.971 37.879 ( -4.046 -2.639 8.294) 9.598 38.625 ( -4.146 1.956 -13.490) 14.247 40.306 ( 15.147 -0.146 1.839) 15.259 ======================= Grid point 222 (111/371) ======================= q-point: (-0.23 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.389 ( -23.670 -6.093 3.736) 24.725 3.918 ( -17.339 -2.916 1.192) 17.623 4.948 ( 0.135 -11.549 -3.927) 12.199 6.260 ( 12.761 3.749 1.504) 13.386 6.603 ( -2.215 -2.280 1.570) 3.545 7.411 ( -7.135 6.895 -10.090) 14.151 7.463 ( -4.906 8.380 -3.602) 10.357 8.146 ( -11.319 3.713 -1.148) 11.968 8.759 ( -2.278 -16.375 5.804) 17.522 9.272 ( 0.595 6.439 5.458) 8.462 9.534 ( 2.849 0.648 -1.285) 3.191 9.687 ( -9.294 0.720 3.817) 10.073 10.856 ( -0.324 2.213 -5.061) 5.533 11.675 ( 5.084 2.930 -2.232) 6.278 11.739 ( 16.104 -10.665 11.215) 22.335 12.675 ( -4.116 -1.671 2.035) 4.886 12.792 ( -5.135 -1.145 -1.167) 5.390 13.275 ( 7.929 2.884 -0.142) 8.438 18.560 ( 2.817 -0.601 0.963) 3.037 18.800 ( 4.149 9.505 1.052) 10.424 19.290 ( 2.881 -2.918 1.513) 4.371 19.410 ( 5.529 -3.025 -4.227) 7.588 20.601 ( -4.899 -1.108 -0.626) 5.061 20.912 ( 2.961 0.233 0.326) 2.988 27.680 ( -1.228 -0.634 0.983) 1.696 27.761 ( -1.952 1.386 -0.605) 2.470 37.205 ( -7.077 3.296 -3.147) 8.417 37.804 ( -8.231 -1.509 9.569) 12.712 38.433 ( -10.734 -0.606 -14.059) 17.698 40.576 ( 16.233 0.197 0.781) 16.253 ======================= Grid point 223 (112/371) ======================= q-point: (-0.15 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.914 ( -29.756 -7.692 9.071) 32.045 3.561 ( -26.972 -0.618 4.034) 27.279 4.798 ( -6.860 -7.581 -4.126) 11.025 6.477 ( 11.363 -1.776 0.686) 11.522 6.504 ( -7.406 0.652 -4.829) 8.866 7.187 ( -20.763 -0.006 -1.174) 20.797 7.432 ( -5.796 12.323 -6.288) 15.000 8.100 ( 0.522 2.213 -0.610) 2.355 8.638 ( 3.288 -13.068 11.245) 17.551 9.339 ( -0.779 0.539 0.724) 1.192 9.421 ( -12.314 3.790 -4.288) 13.579 9.618 ( -2.084 1.845 2.820) 3.962 10.960 ( 6.596 1.277 2.680) 7.233 11.867 ( 9.959 9.896 -4.103) 14.627 11.999 ( 17.208 -3.061 9.986) 20.129 12.574 ( 0.066 -8.305 -1.744) 8.486 12.650 ( -8.366 -4.945 0.713) 9.744 13.408 ( 6.996 0.730 -2.085) 7.337 18.640 ( 6.591 -1.062 1.793) 6.913 18.946 ( 3.096 6.496 0.630) 7.224 19.327 ( 3.063 -1.407 -0.363) 3.390 19.470 ( 7.568 -0.840 -3.985) 8.595 20.522 ( -3.969 -0.162 2.129) 4.507 20.966 ( 3.005 0.296 0.598) 3.078 27.658 ( -1.407 -1.086 1.358) 2.237 27.726 ( -2.749 1.002 -1.506) 3.290 37.091 ( -7.469 0.741 -1.253) 7.610 37.691 ( -11.731 2.303 8.934) 14.925 38.139 ( -14.721 -2.447 -12.357) 19.375 40.815 ( 13.870 -0.377 -6.053) 15.138 ======================= Grid point 224 (113/371) ======================= q-point: (-0.08 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( -32.033 -5.204 14.356) 35.487 3.056 ( -37.372 -0.678 4.505) 37.648 4.458 ( -28.656 -1.114 -3.622) 28.905 6.303 ( -10.858 -1.802 -5.501) 12.304 6.648 ( 8.112 -1.626 3.292) 8.904 6.887 ( -12.926 3.964 2.432) 13.737 7.461 ( -0.602 12.550 -8.678) 15.270 8.074 ( -3.526 -8.535 7.221) 11.723 8.777 ( 10.654 1.227 11.993) 16.089 9.105 ( -11.770 -5.883 -13.522) 18.867 9.432 ( -1.788 9.488 7.527) 12.243 9.655 ( 2.069 1.398 2.831) 3.775 11.071 ( 4.908 0.956 2.906) 5.783 12.012 ( 0.042 -0.099 -6.740) 6.740 12.160 ( -6.867 7.108 4.798) 10.986 12.498 ( -0.457 -9.741 4.637) 10.798 12.676 ( 25.645 -7.730 -4.826) 27.216 13.502 ( 6.649 -0.816 -3.312) 7.473 18.739 ( 7.218 -5.965 1.331) 9.458 19.022 ( 0.612 4.405 0.792) 4.517 19.364 ( 4.411 -0.809 -4.018) 6.021 19.589 ( 7.391 2.518 -4.498) 9.011 20.519 ( 0.245 1.365 9.915) 10.011 21.022 ( 2.887 0.120 1.602) 3.304 27.616 ( -3.743 -0.386 0.498) 3.795 27.694 ( -0.555 0.148 -1.303) 1.424 36.977 ( -6.411 -0.289 1.168) 6.523 37.570 ( -13.624 7.431 7.162) 17.092 37.800 ( -16.600 -2.375 -9.483) 19.264 40.915 ( 6.941 -2.512 -20.308) 21.608 ======================= Grid point 227 (114/371) ======================= q-point: ( 0.15 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.270 ( -15.160 20.744 23.805) 35.026 2.439 ( -13.275 36.603 10.675) 40.373 4.045 ( -26.763 26.054 7.266) 38.051 6.163 ( 2.614 5.977 2.977) 7.171 6.701 ( -9.831 2.729 8.745) 13.438 6.948 ( -6.847 -4.073 -6.724) 10.425 7.811 ( -2.026 0.115 -0.639) 2.127 8.130 ( 9.324 12.388 0.575) 15.515 8.260 ( -7.140 -5.829 4.819) 10.401 9.252 ( -2.530 -0.843 -6.816) 7.319 9.454 ( -4.724 -8.832 0.641) 10.037 9.761 ( 0.782 -8.066 8.157) 11.498 11.077 ( -1.051 -7.677 -2.255) 8.070 11.785 ( 6.614 13.366 1.382) 14.977 12.084 ( -10.329 8.065 -2.965) 13.435 12.516 ( -8.162 -7.618 -0.559) 11.179 13.037 ( 29.670 -2.700 -2.078) 29.865 13.582 ( 7.937 -2.558 -2.706) 8.767 18.753 ( 8.680 -1.597 -0.428) 8.836 19.052 ( -2.267 -5.216 1.110) 5.794 19.409 ( 4.076 -2.567 -2.826) 5.585 19.524 ( -0.666 -3.284 -5.095) 6.098 21.006 ( 8.796 -12.858 15.800) 22.189 21.163 ( 3.249 -4.900 7.472) 9.508 27.512 ( -2.359 1.881 -0.833) 3.130 27.711 ( 0.661 0.864 -0.412) 1.164 36.975 ( -11.579 0.742 -4.269) 12.363 37.063 ( -2.946 5.618 3.543) 7.266 37.926 ( -17.558 17.206 5.078) 25.102 39.889 ( -11.982 23.094 -51.954) 58.104 ======================= Grid point 228 (115/371) ======================= q-point: ( 0.23 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.453 ( -5.357 27.235 21.193) 34.923 2.842 ( 4.951 36.865 16.703) 40.774 4.003 ( -14.995 30.943 9.895) 35.781 6.281 ( -3.431 10.087 -0.142) 10.656 6.510 ( -12.537 4.161 -3.399) 13.640 6.865 ( 5.689 -8.891 2.834) 10.929 7.604 ( -12.724 -10.513 -2.453) 16.687 8.241 ( -1.615 8.811 3.683) 9.686 8.443 ( 14.433 1.001 6.857) 16.010 9.093 ( -7.397 2.423 -5.112) 9.312 9.388 ( 0.765 -0.294 -3.401) 3.498 9.700 ( -0.308 -12.480 4.955) 13.431 11.084 ( 4.751 -0.086 1.967) 5.143 11.874 ( -8.180 7.377 -2.051) 11.204 12.072 ( 4.828 2.710 -0.489) 5.558 12.303 ( -10.121 -0.026 0.721) 10.147 13.390 ( 16.126 -6.020 -4.316) 17.746 13.689 ( 8.464 -2.393 -2.141) 9.052 18.803 ( 2.400 -7.754 1.776) 8.309 19.034 ( 2.019 2.297 -0.849) 3.174 19.318 ( -3.311 -8.265 -6.383) 10.955 19.534 ( 4.138 -2.659 -0.312) 4.928 21.047 ( 4.195 -17.184 14.435) 22.831 21.184 ( 1.452 -7.090 7.649) 10.530 27.506 ( -0.500 2.575 -0.588) 2.688 27.717 ( -0.593 0.687 -0.547) 1.059 36.771 ( -9.155 1.692 -0.542) 9.325 37.176 ( 3.559 11.797 -3.137) 12.715 37.788 ( -18.082 14.694 3.546) 23.568 39.810 ( -1.071 32.944 -45.902) 56.510 ======================= Grid point 229 (116/371) ======================= q-point: ( 0.31 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.803 ( 2.997 28.462 18.078) 33.851 3.264 ( -1.490 27.714 14.251) 31.199 4.242 ( 1.204 27.604 6.135) 28.303 6.148 ( -12.733 9.980 -6.266) 17.350 6.539 ( 6.342 5.238 -3.631) 8.991 6.924 ( 6.787 -12.163 6.294) 15.284 7.330 ( -9.577 -1.932 6.732) 11.864 8.314 ( 1.339 2.421 -1.516) 3.155 8.584 ( 3.416 -4.575 -3.458) 6.675 9.084 ( -3.351 13.480 -0.356) 13.895 9.458 ( 7.110 4.694 2.619) 8.914 9.595 ( 0.841 -12.951 3.106) 13.344 11.187 ( 3.478 1.089 4.356) 5.679 11.804 ( -1.565 0.352 0.179) 1.614 12.126 ( 2.517 -5.404 1.061) 6.055 12.269 ( -2.065 13.519 -1.790) 13.793 13.440 ( 2.904 -6.887 -4.955) 8.967 13.652 ( -8.824 -7.135 -2.911) 11.715 18.792 ( 5.237 -8.104 3.497) 10.263 19.068 ( -2.591 1.050 0.033) 2.796 19.145 ( -1.646 -7.370 -9.039) 11.778 19.552 ( 1.151 -3.282 0.248) 3.486 20.983 ( -0.333 -16.632 12.757) 20.964 21.163 ( -0.298 -6.524 5.709) 8.675 27.536 ( 1.238 3.198 -0.670) 3.494 27.703 ( -1.376 0.710 -0.462) 1.615 36.744 ( 3.219 3.571 -0.825) 4.878 37.340 ( 3.409 13.684 -4.189) 14.711 37.719 ( -8.887 15.287 3.750) 18.076 39.903 ( 2.226 27.001 -37.792) 46.499 ======================= Grid point 230 (117/371) ======================= q-point: ( 0.38 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.234 ( 7.120 24.518 16.155) 30.213 3.540 ( 0.439 23.789 10.877) 26.161 4.448 ( -1.490 13.849 -4.777) 14.725 6.097 ( -3.459 9.288 -3.922) 10.659 6.721 ( 14.251 2.162 -4.579) 15.124 6.829 ( -4.271 -13.540 6.810) 15.746 7.431 ( 5.293 13.294 13.966) 19.995 8.280 ( -0.942 -8.153 -2.589) 8.606 8.503 ( -1.874 -3.167 -11.532) 12.105 9.154 ( -5.745 18.116 -2.580) 19.179 9.529 ( 6.787 -12.501 -0.414) 14.231 9.728 ( 9.970 7.292 12.290) 17.425 11.242 ( 0.554 -1.531 8.080) 8.243 11.814 ( 2.440 -5.618 2.158) 6.494 12.173 ( 4.781 5.654 -3.076) 8.018 12.370 ( 2.159 7.998 -1.676) 8.452 13.260 ( -26.705 -8.599 0.705) 28.064 13.344 ( -2.973 -6.454 -6.042) 9.328 18.837 ( 2.003 -6.403 3.674) 7.649 18.942 ( 2.371 -10.504 -4.108) 11.525 19.088 ( -3.079 3.682 -4.924) 6.877 19.508 ( -2.590 -3.519 -0.077) 4.370 20.881 ( -2.081 -12.249 9.647) 15.730 21.113 ( -1.480 -6.221 3.877) 7.478 27.594 ( 2.241 3.435 -1.039) 4.231 27.689 ( -1.003 1.106 -0.066) 1.494 36.903 ( 11.652 2.636 -0.106) 11.947 37.485 ( 1.620 14.301 -5.595) 15.442 37.833 ( 2.243 13.968 5.571) 15.204 39.963 ( 0.640 17.792 -30.096) 34.967 ======================= Grid point 231 (118/371) ======================= q-point: ( 0.46 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.610 ( 3.951 17.765 14.045) 22.989 3.876 ( 9.742 19.427 7.607) 23.026 4.486 ( 0.997 7.865 -8.658) 11.740 6.092 ( -4.891 5.932 -2.646) 8.130 6.683 ( -4.561 -9.530 9.199) 14.009 6.950 ( 17.188 -4.085 -6.260) 18.743 7.757 ( 3.985 18.807 8.583) 21.053 8.131 ( -2.651 -12.095 -2.906) 12.718 8.419 ( 4.598 -2.512 -8.913) 10.339 9.207 ( -7.821 19.542 -3.211) 21.293 9.562 ( 10.054 -10.927 1.526) 14.927 9.960 ( 2.761 4.367 8.121) 9.625 11.299 ( 3.869 -4.897 11.650) 13.217 11.771 ( -2.281 -4.168 2.555) 5.395 12.242 ( -2.911 2.465 -7.955) 8.823 12.495 ( 6.767 3.706 3.008) 8.281 12.770 ( -23.975 -1.031 3.878) 24.308 13.183 ( -5.343 -4.360 -6.960) 9.798 18.707 ( -5.583 -7.340 0.723) 9.250 18.996 ( 7.420 -2.465 -6.470) 10.149 19.038 ( -1.780 -0.877 1.249) 2.344 19.410 ( -4.661 -3.660 -0.466) 5.945 20.798 ( -1.557 -7.458 6.354) 9.920 21.042 ( -2.262 -5.602 2.206) 6.432 27.651 ( 1.661 2.674 -1.394) 3.442 27.699 ( 0.419 2.064 0.495) 2.163 37.128 ( 11.256 2.706 1.841) 11.722 37.615 ( 3.941 11.776 -8.582) 15.096 38.077 ( 8.009 11.412 7.844) 15.997 39.955 ( -0.601 10.158 -22.617) 24.801 ======================= Grid point 232 (119/371) ======================= q-point: ( 0.54 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.831 ( 0.183 11.191 6.752) 13.072 4.249 ( 10.698 13.505 5.939) 18.224 4.587 ( 8.588 4.154 -4.950) 10.748 6.016 ( -8.420 2.735 0.584) 8.872 6.602 ( -2.312 -6.452 10.076) 12.186 7.151 ( 16.372 -2.209 -8.069) 18.385 7.865 ( -4.686 7.612 -10.700) 13.942 7.980 ( 0.485 -7.940 -4.482) 9.131 8.579 ( 12.619 2.041 6.885) 14.519 9.233 ( -8.417 16.968 -1.101) 18.973 9.650 ( 10.276 -9.064 2.641) 13.954 9.936 ( -11.492 0.647 1.135) 11.566 11.314 ( 1.877 -16.236 10.026) 19.174 11.743 ( -3.917 2.312 3.012) 5.455 12.121 ( -5.516 3.315 6.592) 9.212 12.444 ( -15.526 0.553 -0.257) 15.538 12.716 ( 9.072 3.029 -2.804) 9.967 13.057 ( -3.226 0.242 -5.413) 6.306 18.583 ( -3.595 -3.399 1.302) 5.116 18.929 ( -6.638 1.373 -4.027) 7.884 19.112 ( 8.588 -4.810 -0.161) 9.845 19.303 ( -3.278 -3.760 -0.882) 5.065 20.759 ( -0.240 -3.402 3.605) 4.963 20.960 ( -2.767 -4.703 0.957) 5.540 27.687 ( 1.091 2.119 -0.704) 2.485 27.735 ( 0.820 2.200 0.199) 2.356 37.314 ( 5.138 5.337 2.569) 7.841 37.740 ( 6.452 5.490 -8.072) 11.702 38.362 ( 9.554 9.431 6.391) 14.868 39.921 ( 0.785 4.254 -15.067) 15.676 ======================= Grid point 233 (120/371) ======================= q-point: ( 0.62 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.909 ( -2.641 6.347 0.417) 6.887 4.462 ( -0.791 7.097 2.632) 7.611 4.758 ( 12.061 -3.127 -1.211) 12.518 5.914 ( -5.693 0.598 3.539) 6.730 6.585 ( 0.206 -4.221 8.287) 9.302 7.341 ( 9.753 2.250 -7.333) 12.408 7.748 ( -5.553 5.443 -12.136) 14.413 8.018 ( 12.895 -0.903 -6.819) 14.615 8.797 ( 5.639 1.766 6.281) 8.624 9.253 ( -4.944 9.793 3.542) 11.528 9.618 ( -14.955 -7.973 2.230) 17.094 9.774 ( 2.883 -1.776 0.989) 3.527 11.258 ( 4.730 -13.739 10.208) 17.758 11.602 ( -11.733 -1.625 -5.734) 13.160 12.073 ( -18.161 -4.923 5.178) 19.515 12.365 ( 8.073 10.757 6.610) 14.985 12.867 ( 8.617 1.724 -3.376) 9.414 13.004 ( -2.795 1.818 -3.566) 4.882 18.544 ( -0.862 0.862 1.489) 1.925 18.803 ( -6.923 -0.066 -1.791) 7.151 19.193 ( 6.788 -5.681 -1.131) 8.923 19.235 ( -0.639 -1.142 -1.002) 1.648 20.759 ( 0.498 -0.580 1.524) 1.705 20.877 ( -2.756 -3.840 0.340) 4.739 27.720 ( 0.507 2.129 -0.225) 2.200 27.761 ( 0.349 1.196 0.161) 1.256 37.413 ( -1.277 7.260 0.410) 7.383 37.840 ( 6.191 -0.440 -2.506) 6.693 38.594 ( 5.362 8.284 0.355) 9.875 39.932 ( 6.096 0.009 -7.127) 9.379 ======================= Grid point 234 (121/371) ======================= q-point: (-0.31 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.875 ( -7.274 3.543 -0.515) 8.107 4.393 ( -12.041 1.394 1.338) 12.195 4.848 ( 6.668 -9.507 -1.768) 11.746 5.922 ( 4.383 0.251 3.048) 5.344 6.602 ( 0.961 -1.795 4.067) 4.548 7.389 ( 2.936 -3.535 -5.672) 7.300 7.724 ( -7.222 21.064 -9.227) 24.104 8.267 ( 16.787 -0.334 -3.105) 17.075 8.845 ( -3.915 3.328 -2.151) 5.571 9.267 ( -0.186 -11.048 5.819) 12.488 9.362 ( -7.542 3.873 10.169) 13.240 9.812 ( 2.513 -3.737 0.673) 4.553 11.270 ( -14.244 -0.734 -10.540) 17.735 11.348 ( 4.856 -7.631 7.105) 11.502 11.763 ( -12.978 -6.407 5.005) 15.314 12.645 ( 8.000 6.615 7.226) 12.648 12.932 ( -3.203 -1.075 -3.720) 5.025 13.012 ( 6.891 3.649 -1.667) 7.974 18.553 ( -1.311 0.993 0.193) 1.656 18.732 ( -1.063 2.577 0.755) 2.888 19.186 ( 2.898 -5.873 -0.595) 6.576 19.275 ( 3.505 0.449 -1.703) 3.923 20.747 ( -3.175 -0.215 -0.366) 3.203 20.830 ( 1.263 -1.905 0.769) 2.411 27.730 ( -1.357 1.271 0.182) 1.868 27.778 ( 0.647 0.688 0.033) 0.945 37.414 ( -5.364 5.530 -1.523) 7.854 37.906 ( 3.069 -1.988 3.207) 4.864 38.664 ( -3.409 6.102 -6.363) 9.452 40.064 ( 13.354 -1.319 -1.190) 13.471 ======================= Grid point 235 (122/371) ======================= q-point: (-0.23 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.711 ( -16.774 -0.209 3.331) 17.103 4.190 ( -15.023 3.929 2.046) 15.662 4.806 ( 2.465 -10.305 -2.032) 10.789 6.063 ( 11.730 -2.227 0.077) 11.940 6.606 ( -0.428 0.393 -3.518) 3.566 7.395 ( 2.915 -0.668 0.328) 3.009 7.746 ( -10.145 20.540 -7.193) 24.011 8.361 ( -5.662 1.178 2.433) 6.274 8.699 ( -7.070 -9.934 -2.157) 12.382 9.265 ( 5.399 -2.123 -0.493) 5.822 9.478 ( 6.605 1.754 11.271) 13.181 9.787 ( -1.025 -4.581 1.124) 4.827 10.941 ( -11.741 2.472 -8.807) 14.884 11.486 ( 7.312 -5.259 9.700) 13.237 11.623 ( 0.816 -2.920 2.224) 3.760 12.777 ( 1.139 0.465 1.939) 2.297 12.825 ( -6.794 -0.081 -2.918) 7.394 13.160 ( 8.087 1.573 -0.978) 8.297 18.526 ( -0.555 -1.505 0.313) 1.635 18.815 ( 4.425 4.738 1.159) 6.586 19.206 ( 4.545 -2.458 0.806) 5.229 19.311 ( 2.295 -0.121 -3.049) 3.818 20.671 ( -4.725 -0.381 -0.148) 4.743 20.865 ( 3.033 -0.304 0.440) 3.080 27.709 ( -1.980 0.205 0.646) 2.093 27.786 ( -0.383 0.369 -0.480) 0.716 37.337 ( -7.304 1.962 -1.054) 7.636 37.933 ( -1.478 -0.081 5.918) 6.100 38.546 ( -10.634 3.119 -9.264) 14.444 40.302 ( 16.626 -0.661 -1.062) 16.673 ======================= Grid point 236 (123/371) ======================= q-point: (-0.15 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.370 ( -25.851 -2.221 8.109) 27.184 3.987 ( -19.881 6.449 3.454) 21.184 4.761 ( 1.459 -3.386 -1.827) 4.115 6.226 ( 13.223 -6.044 -3.118) 14.870 6.553 ( -2.863 1.837 -9.164) 9.775 7.453 ( -2.772 6.548 5.564) 9.029 7.664 ( -13.860 5.448 -2.238) 15.059 8.225 ( -12.198 8.528 -4.517) 15.553 8.527 ( 0.969 -13.749 9.470) 16.723 9.279 ( 1.123 -4.528 -7.266) 8.635 9.592 ( -1.171 3.437 4.181) 5.537 9.720 ( -4.304 -1.971 4.453) 6.499 10.934 ( 3.828 6.390 2.933) 8.005 11.579 ( 15.272 -13.144 6.535) 21.182 11.766 ( 9.929 5.449 -0.525) 11.338 12.682 ( -8.222 -0.520 -3.946) 9.135 12.732 ( -6.437 -0.497 1.089) 6.547 13.275 ( 7.130 -1.203 -3.217) 7.914 18.531 ( 3.556 -3.406 1.153) 5.057 18.931 ( 5.046 1.218 0.326) 5.201 19.275 ( 2.546 -0.175 0.350) 2.576 19.348 ( 5.366 2.854 -3.194) 6.866 20.600 ( -4.137 0.550 1.681) 4.500 20.918 ( 3.342 -0.102 0.526) 3.385 27.682 ( -1.723 -0.279 0.985) 2.004 27.764 ( -1.947 -0.099 -1.216) 2.298 37.216 ( -7.836 -0.557 0.854) 7.902 37.916 ( -5.724 2.226 5.743) 8.408 38.310 ( -14.984 2.385 -8.435) 17.360 40.541 ( 14.825 -0.772 -6.373) 16.156 ======================= Grid point 237 (124/371) ======================= q-point: (-0.08 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.959 ( -29.420 1.149 12.099) 31.831 3.650 ( -30.445 4.063 3.404) 30.903 4.725 ( -7.647 5.444 -3.661) 10.076 6.296 ( 4.621 -6.880 -9.809) 12.842 6.514 ( 3.081 1.259 -2.501) 4.163 7.339 ( -24.949 4.653 12.036) 28.088 7.512 ( -0.944 4.764 -5.533) 7.362 8.151 ( -6.197 5.316 2.030) 8.413 8.615 ( 12.690 -4.088 11.323) 17.492 9.119 ( -6.460 -7.000 -14.497) 17.346 9.614 ( -2.514 4.083 6.203) 7.840 9.695 ( -2.444 2.335 7.249) 7.998 11.064 ( 2.135 5.910 4.927) 7.985 11.804 ( 24.943 -24.358 4.326) 35.131 11.950 ( 6.230 3.347 -3.410) 7.851 12.511 ( -9.142 0.788 -4.093) 10.047 12.648 ( -4.722 7.362 0.378) 8.754 13.347 ( 7.327 -2.935 -5.161) 9.430 18.572 ( 5.705 -6.636 1.208) 8.834 19.000 ( 4.429 -1.803 -0.121) 4.783 19.291 ( 1.709 0.235 -3.186) 3.623 19.493 ( 6.785 5.592 -1.922) 9.000 20.582 ( -1.204 1.572 6.017) 6.334 20.977 ( 3.471 -0.246 1.280) 3.708 27.660 ( -1.550 -0.055 1.138) 1.923 27.713 ( -2.713 -0.452 -1.945) 3.369 37.094 ( -7.198 -0.729 2.635) 7.700 37.829 ( -9.232 -1.060 0.832) 9.330 38.063 ( -16.796 9.697 -2.070) 19.504 40.668 ( 8.773 -2.402 -16.439) 18.787 ======================= Grid point 240 (125/371) ======================= q-point: ( 0.15 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.845 ( -19.825 17.703 17.954) 32.075 3.067 ( -19.281 29.298 5.797) 35.549 4.570 ( -17.161 13.549 -5.262) 22.489 6.167 ( 5.452 2.696 0.871) 6.145 6.652 ( 6.356 -7.535 6.159) 11.624 7.353 ( -25.298 12.028 2.054) 28.087 7.809 ( 5.529 0.179 5.956) 8.129 8.017 ( -2.404 -2.966 -6.257) 7.330 8.485 ( -7.721 8.535 4.815) 12.476 9.135 ( 8.776 0.424 -7.766) 11.726 9.417 ( -2.763 -15.300 -0.733) 15.565 9.812 ( -5.763 -3.320 6.089) 9.017 11.061 ( -4.425 -2.627 3.279) 6.102 11.805 ( 6.358 11.196 3.134) 13.252 12.163 ( 11.378 -1.025 -0.778) 11.451 12.443 ( 4.952 -5.048 1.992) 7.347 12.758 ( -2.083 -0.513 -1.827) 2.818 13.393 ( 9.584 -2.620 -4.597) 10.948 18.595 ( 8.509 -0.483 -0.624) 8.546 18.995 ( 2.158 -7.435 0.020) 7.742 19.297 ( 5.007 -1.332 -1.972) 5.544 19.520 ( -4.495 -2.718 -4.107) 6.668 20.863 ( 5.657 -7.049 10.017) 13.492 21.098 ( 3.592 -4.064 4.260) 6.896 27.562 ( -2.659 1.083 -1.106) 3.076 27.716 ( 0.489 2.169 -0.132) 2.227 37.081 ( -1.824 8.016 -5.989) 10.172 37.276 ( -14.233 -0.749 6.680) 15.741 38.396 ( -15.483 17.699 5.884) 24.241 39.931 ( -6.159 7.695 -38.317) 39.565 ======================= Grid point 241 (126/371) ======================= q-point: ( 0.23 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.905 ( -8.705 21.587 20.282) 30.873 3.240 ( -3.543 35.147 9.948) 36.699 4.429 ( -11.787 13.189 -4.381) 18.223 6.327 ( 6.920 6.294 3.096) 9.854 6.703 ( 4.308 -8.172 8.448) 12.518 6.943 ( -28.298 6.153 -10.433) 30.781 7.711 ( -10.896 -0.914 -1.986) 11.113 8.159 ( 11.421 -4.917 7.383) 14.461 8.472 ( -4.340 3.832 5.756) 8.164 9.116 ( 0.401 2.665 -11.803) 12.107 9.392 ( 3.545 4.374 0.819) 5.689 9.688 ( -6.879 -7.955 5.657) 11.942 11.055 ( 0.724 1.924 5.228) 5.618 11.966 ( 4.919 0.269 3.908) 6.288 12.081 ( -10.635 -3.067 -4.967) 12.132 12.488 ( -5.430 5.884 2.471) 8.380 12.949 ( 25.468 -5.591 -1.376) 26.111 13.504 ( 9.395 -2.544 -3.323) 10.285 18.687 ( 4.365 -5.785 0.323) 7.254 18.983 ( 4.004 -0.538 -2.388) 4.693 19.293 ( -3.663 -6.985 -1.774) 8.085 19.437 ( 2.830 -2.192 -2.099) 4.150 20.910 ( 3.947 -10.691 9.889) 15.089 21.126 ( 2.542 -5.695 4.637) 7.771 27.538 ( -1.352 1.930 -0.715) 2.463 27.737 ( -0.369 2.124 -0.412) 2.195 36.987 ( -13.478 3.012 -0.106) 13.811 37.225 ( 0.974 9.732 -1.370) 9.876 38.268 ( -20.638 13.895 4.681) 25.316 39.823 ( 1.835 17.545 -36.697) 40.717 ======================= Grid point 242 (127/371) ======================= q-point: ( 0.31 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.131 ( -1.869 22.727 17.543) 28.771 3.588 ( -0.442 27.297 9.727) 28.981 4.415 ( -0.809 10.901 -5.297) 12.147 6.487 ( 4.302 3.932 -2.618) 6.389 6.509 ( -19.214 4.986 -5.440) 20.582 6.803 ( 3.842 -0.176 9.043) 9.827 7.509 ( -12.118 0.570 5.400) 13.279 8.232 ( 4.098 -8.963 0.743) 9.883 8.481 ( 3.077 -2.062 -4.074) 5.506 9.228 ( 5.333 16.784 -3.461) 17.948 9.465 ( -8.292 -0.158 0.041) 8.294 9.558 ( 2.018 0.676 8.394) 8.659 11.146 ( 4.425 0.750 5.153) 6.834 11.815 ( -5.559 -14.692 3.148) 16.021 12.081 ( 1.599 6.046 0.506) 6.274 12.471 ( -6.542 12.075 -1.665) 13.834 13.210 ( 14.439 -7.896 -4.313) 17.013 13.583 ( 5.004 -6.344 -2.869) 8.574 18.660 ( 2.656 -8.981 1.996) 9.576 19.061 ( 2.689 0.118 -8.316) 8.741 19.110 ( -5.081 -5.505 1.470) 7.634 19.479 ( 4.021 -2.915 -0.026) 4.967 20.895 ( 1.346 -11.555 8.995) 14.705 21.121 ( 1.133 -6.423 4.171) 7.742 27.547 ( 0.240 2.564 -0.547) 2.632 27.737 ( -1.476 1.786 -0.470) 2.364 36.828 ( -8.516 3.893 0.574) 9.381 37.372 ( 4.701 12.539 -3.578) 13.861 38.101 ( -17.103 14.059 4.068) 22.510 39.884 ( 4.631 18.173 -31.327) 36.511 ======================= Grid point 243 (128/371) ======================= q-point: ( 0.38 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.428 ( 3.504 19.154 13.225) 23.538 3.800 ( -3.037 18.694 6.602) 20.057 4.477 ( 2.777 2.719 -10.115) 10.836 6.343 ( -9.952 12.063 0.477) 15.646 6.544 ( 4.990 -1.743 -5.065) 7.320 6.870 ( -5.158 1.136 10.710) 11.941 7.518 ( 4.985 9.155 10.974) 15.136 8.168 ( 0.629 -10.869 -3.027) 11.300 8.467 ( -0.406 0.318 -9.496) 9.510 9.272 ( -1.125 -12.701 -4.350) 13.472 9.451 ( -1.142 20.203 -1.428) 20.285 9.760 ( 5.583 11.738 13.595) 18.809 11.214 ( 2.873 -7.297 7.044) 10.541 11.702 ( 3.041 -9.936 6.890) 12.467 12.164 ( 1.919 7.760 -3.374) 8.677 12.485 ( -4.214 11.586 -2.792) 12.641 13.251 ( 3.530 -6.679 -5.905) 9.588 13.454 ( -9.494 -10.852 -1.815) 14.533 18.670 ( 7.330 -7.602 1.293) 10.640 18.874 ( -5.772 -10.549 -2.642) 12.312 19.144 ( -0.109 5.106 -3.423) 6.148 19.492 ( 0.821 -3.408 0.512) 3.543 20.840 ( -0.557 -9.924 7.405) 12.395 21.086 ( -0.270 -6.355 3.096) 7.074 27.586 ( 1.625 2.936 -0.644) 3.417 27.723 ( -1.667 1.559 -0.293) 2.301 36.813 ( 2.004 4.026 -0.350) 4.511 37.550 ( 4.047 11.984 -2.292) 12.855 38.047 ( -8.374 14.665 4.234) 17.410 39.949 ( 2.320 13.930 -25.688) 29.314 ======================= Grid point 244 (129/371) ======================= q-point: ( 0.46 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.709 ( 6.531 10.089 8.280) 14.594 3.976 ( 1.875 15.222 6.621) 16.706 4.463 ( 2.520 0.991 -11.677) 11.987 6.317 ( -9.987 10.425 4.304) 15.065 6.603 ( 7.501 -1.230 -7.401) 10.609 6.819 ( -4.922 -2.524 11.858) 13.085 7.865 ( 11.066 12.715 11.850) 20.605 8.043 ( -0.034 -7.993 -3.780) 8.842 8.354 ( -6.893 1.644 -11.563) 13.561 9.207 ( 10.964 -12.011 -5.928) 17.309 9.546 ( -6.995 16.949 -0.857) 18.356 10.025 ( 3.714 10.256 10.770) 15.329 11.203 ( 3.667 -14.376 10.550) 18.205 11.741 ( 3.939 -4.137 6.560) 8.699 12.249 ( 1.910 7.268 -7.319) 10.490 12.515 ( -1.832 8.062 -1.324) 8.372 13.106 ( -18.071 -9.387 1.480) 20.418 13.174 ( -2.959 -3.057 -6.653) 7.897 18.680 ( -1.857 -9.983 -3.635) 10.785 18.768 ( 8.670 -5.503 2.211) 10.504 19.136 ( -4.307 4.613 -2.858) 6.928 19.445 ( -2.901 -3.272 0.515) 4.403 20.780 ( -0.871 -6.982 5.372) 8.852 21.029 ( -1.324 -5.539 1.798) 5.972 27.640 ( 1.897 2.699 -0.854) 3.408 27.718 ( -0.485 1.642 0.024) 1.713 36.950 ( 10.654 2.620 -0.611) 10.988 37.682 ( 0.443 10.371 -2.051) 10.581 38.149 ( 1.284 13.175 5.432) 14.308 39.951 ( -0.772 9.192 -19.733) 21.783 ======================= Grid point 245 (130/371) ======================= q-point: ( 0.54 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.896 ( 5.077 2.500 4.298) 7.107 4.219 ( 8.179 11.478 6.144) 15.375 4.503 ( 5.440 3.645 -7.320) 9.822 6.238 ( -11.155 4.827 3.527) 12.656 6.638 ( -1.861 0.452 1.962) 2.742 6.855 ( 9.681 -3.606 2.339) 10.592 7.848 ( -3.011 -8.687 -5.012) 10.471 8.116 ( -11.422 14.302 -8.695) 20.263 8.381 ( 16.763 0.796 7.082) 18.215 9.310 ( 15.200 -7.864 -5.038) 17.840 9.551 ( -8.769 12.484 0.034) 15.256 10.123 ( -6.231 5.439 3.758) 9.084 11.150 ( 2.843 -20.436 10.029) 22.941 11.811 ( 1.710 0.963 5.000) 5.371 12.249 ( -3.737 5.150 -1.201) 6.475 12.593 ( 4.457 4.737 -0.597) 6.532 12.748 ( -18.267 -4.833 -0.106) 18.896 13.086 ( -2.652 1.791 -5.443) 6.314 18.564 ( -0.642 -6.760 -0.730) 6.830 18.886 ( 10.171 -4.345 -1.583) 11.173 19.066 ( -7.140 2.667 -0.945) 7.680 19.353 ( -4.911 -2.197 0.451) 5.399 20.744 ( 0.042 -3.828 3.321) 5.068 20.962 ( -2.045 -4.262 0.716) 4.781 27.682 ( 1.276 1.730 -0.540) 2.216 27.741 ( 0.915 1.976 -0.073) 2.179 37.175 ( 13.968 1.431 -0.016) 14.041 37.743 ( -1.353 7.653 -3.504) 8.525 38.365 ( 6.630 10.726 6.889) 14.369 39.903 ( -2.286 4.973 -13.701) 14.754 ======================= Grid point 246 (131/371) ======================= q-point: ( 0.62 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.981 ( 1.388 2.493 1.099) 3.057 4.477 ( 8.039 5.361 4.801) 10.789 4.592 ( 5.615 0.283 -3.602) 6.677 6.087 ( -11.781 0.398 3.410) 12.271 6.611 ( -2.623 -0.324 5.207) 5.839 7.064 ( 17.297 -0.981 -2.880) 17.562 7.719 ( 0.227 -4.273 -6.095) 7.447 8.035 ( -6.983 13.694 -8.593) 17.610 8.675 ( 12.701 -1.368 8.024) 15.086 9.435 ( 4.248 0.035 -6.156) 7.479 9.514 ( -2.107 0.042 2.524) 3.288 9.965 ( -15.863 0.869 -0.414) 15.892 11.081 ( 6.180 -15.980 9.832) 19.754 11.768 ( -9.546 0.350 -1.508) 9.671 12.340 ( -0.632 3.326 14.173) 14.571 12.390 ( -13.441 -1.675 -7.435) 15.451 12.721 ( 7.543 2.272 -2.818) 8.367 13.059 ( -2.196 4.338 -3.525) 6.005 18.529 ( 1.897 -3.131 0.617) 3.712 18.921 ( -6.365 2.107 -5.447) 8.638 19.017 ( 6.027 -5.235 2.869) 8.483 19.271 ( -3.610 0.131 0.323) 3.627 20.743 ( 1.164 -1.380 1.660) 2.453 20.891 ( -2.692 -2.959 0.073) 4.001 27.716 ( 1.604 1.065 -0.046) 1.926 27.769 ( 0.278 1.525 -0.261) 1.572 37.402 ( 10.702 2.016 1.005) 10.937 37.755 ( -0.099 2.505 -4.084) 4.792 38.608 ( 6.501 9.684 5.691) 12.978 39.848 ( -0.396 1.182 -7.835) 7.933 ======================= Grid point 247 (132/371) ======================= q-point: (-0.31 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.005 ( -2.877 4.153 0.387) 5.067 4.557 ( -3.810 2.161 0.384) 4.397 4.653 ( 6.467 -7.029 -0.449) 9.561 5.938 ( -6.303 -2.123 2.731) 7.190 6.606 ( -0.712 1.314 0.462) 1.565 7.270 ( 7.754 -1.759 0.087) 7.951 7.826 ( 16.849 7.236 -5.747) 19.217 8.056 ( -1.866 11.303 -3.140) 11.879 8.844 ( 6.105 -2.571 5.057) 8.333 9.305 ( -11.648 -4.971 -5.040) 13.630 9.483 ( -1.307 -8.306 4.319) 9.453 9.778 ( -5.180 1.668 -0.450) 5.460 11.176 ( 10.759 -4.712 8.259) 14.359 11.524 ( -18.177 1.454 -7.503) 19.718 12.008 ( -18.301 -5.735 3.380) 19.474 12.552 ( 9.248 -0.732 1.977) 9.485 12.858 ( 7.190 3.147 -0.294) 7.854 13.043 ( -3.083 4.259 -1.818) 5.563 18.558 ( 2.533 -0.669 0.634) 2.696 18.795 ( -6.504 0.758 -1.331) 6.682 19.075 ( 4.848 -4.115 0.072) 6.359 19.255 ( 0.073 2.224 -0.074) 2.227 20.768 ( 1.571 0.286 0.468) 1.664 20.820 ( -2.949 -2.118 -0.033) 3.631 27.751 ( 1.497 0.618 0.109) 1.623 27.773 ( -0.831 0.534 -0.150) 0.999 37.521 ( -1.089 3.311 0.692) 3.553 37.783 ( 7.044 -2.909 -2.028) 7.886 38.773 ( -0.864 9.211 1.649) 9.397 39.866 ( 6.978 -1.181 -2.559) 7.526 ======================= Grid point 248 (133/371) ======================= q-point: (-0.23 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.953 ( -9.195 2.885 1.860) 9.815 4.470 ( -10.371 5.940 1.399) 12.033 4.652 ( 4.424 -9.027 -0.254) 10.056 5.891 ( 3.436 -4.633 0.167) 5.771 6.600 ( -0.692 2.222 -6.194) 6.617 7.355 ( 3.987 1.839 5.299) 6.882 8.047 ( -8.450 15.477 -3.986) 18.078 8.247 ( 18.977 0.265 0.297) 18.981 8.799 ( -10.220 -3.998 -4.596) 11.897 9.121 ( 3.017 -6.527 3.953) 8.205 9.433 ( 3.273 -9.005 6.707) 11.696 9.738 ( -1.375 -0.881 -2.110) 2.668 11.169 ( -18.030 2.237 -9.485) 20.495 11.396 ( 10.169 4.417 5.293) 12.285 11.734 ( -13.845 -3.921 8.316) 16.620 12.635 ( 7.437 -7.476 -5.791) 12.030 12.960 ( -3.020 4.711 2.001) 5.943 13.054 ( 4.406 1.056 -0.508) 4.559 18.555 ( -2.926 -0.519 0.151) 2.975 18.760 ( 2.865 -1.417 0.365) 3.217 19.125 ( 4.536 0.078 0.396) 4.554 19.289 ( 0.921 2.679 -1.153) 3.059 20.744 ( -4.242 0.244 -0.010) 4.249 20.814 ( 2.934 -0.546 0.202) 2.991 27.751 ( -2.143 0.447 0.335) 2.214 27.775 ( 1.165 -0.730 -0.306) 1.409 37.462 ( -6.847 -0.007 0.760) 6.889 37.882 ( 7.368 -2.499 -0.320) 7.787 38.754 ( -10.691 7.610 -1.215) 13.179 40.031 ( 14.456 -0.734 -0.964) 14.507 ======================= Grid point 249 (134/371) ======================= q-point: (-0.15 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.763 ( -17.943 0.859 4.911) 18.623 4.350 ( -13.745 6.080 1.750) 15.131 4.697 ( 5.208 2.805 2.509) 6.426 5.944 ( 10.044 -7.209 -3.342) 12.808 6.561 ( -1.680 2.513 -8.979) 9.474 7.509 ( 4.725 5.950 7.418) 10.618 7.898 ( -13.627 -3.024 -2.006) 14.102 8.416 ( 2.195 -2.571 8.843) 9.467 8.563 ( -13.907 7.792 -9.743) 18.682 9.159 ( 3.070 -5.706 -4.305) 7.779 9.532 ( 14.053 -11.049 8.425) 19.763 9.689 ( -1.329 -1.853 -1.104) 2.533 10.989 ( -3.710 7.773 -1.406) 8.727 11.535 ( -9.840 -2.243 11.960) 15.649 11.654 ( 9.677 5.879 -0.842) 11.354 12.612 ( 3.888 -8.545 -8.703) 12.801 12.911 ( -7.806 4.327 2.088) 9.166 13.135 ( 5.715 -2.597 -2.102) 6.620 18.497 ( -2.057 -2.038 0.909) 3.035 18.814 ( 6.136 -4.707 -0.099) 7.734 19.233 ( 5.050 3.287 0.985) 6.106 19.320 ( 1.058 4.211 -2.374) 4.948 20.682 ( -4.067 0.962 1.077) 4.316 20.863 ( 3.368 -0.276 0.156) 3.383 27.718 ( -2.206 -0.098 0.621) 2.294 27.771 ( -0.293 -1.143 -0.794) 1.422 37.339 ( -7.542 -2.013 2.209) 8.113 37.941 ( 2.732 -2.523 -1.312) 3.943 38.598 ( -15.512 8.059 -0.290) 17.483 40.263 ( 14.923 -0.227 -4.512) 15.592 ======================= Grid point 250 (135/371) ======================= q-point: (-0.08 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.475 ( -23.363 3.981 8.505) 25.179 4.126 ( -20.790 3.478 1.659) 21.144 4.857 ( 0.530 13.940 1.593) 14.041 6.023 ( 11.270 -8.111 -7.285) 15.680 6.515 ( -1.687 2.439 -5.468) 6.220 7.480 ( -7.745 -10.994 -5.240) 14.433 7.779 ( -4.991 8.057 14.699) 17.490 8.400 ( -12.895 15.221 -7.217) 21.215 8.472 ( 4.551 -5.475 12.359) 14.263 9.048 ( -2.664 -7.749 -12.853) 15.243 9.659 ( 1.803 -2.869 5.303) 6.293 9.680 ( 7.757 -6.476 2.839) 10.496 11.135 ( 4.847 9.610 6.322) 12.482 11.436 ( -1.120 -8.503 9.874) 13.079 11.857 ( 7.658 5.421 -4.132) 10.252 12.523 ( 0.146 -6.010 -8.313) 10.259 12.837 ( -7.413 5.619 2.218) 9.562 13.173 ( 5.842 -4.499 -4.882) 8.844 18.468 ( 1.136 -4.114 1.044) 4.394 18.861 ( 6.573 -6.470 -0.391) 9.232 19.282 ( -0.618 2.183 -1.812) 2.903 19.439 ( 6.462 6.391 -0.996) 9.143 20.650 ( -2.399 1.620 3.254) 4.355 20.919 ( 3.718 -0.487 0.702) 3.815 27.689 ( -1.570 -0.016 0.724) 1.729 27.736 ( -1.875 -1.243 -1.304) 2.600 37.216 ( -6.966 -1.565 3.111) 7.788 37.892 ( -3.570 -4.431 -3.355) 6.605 38.444 ( -15.150 12.715 3.055) 20.013 40.424 ( 9.860 -1.396 -11.675) 15.345 ======================= Grid point 253 (136/371) ======================= q-point: ( 0.15 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.404 ( -19.642 14.454 11.720) 27.057 3.644 ( -19.191 20.774 3.099) 28.451 4.883 ( -15.327 6.493 -8.799) 18.828 6.007 ( 11.943 -3.038 -2.621) 12.599 6.581 ( 1.446 -1.270 8.185) 8.409 7.545 ( 12.612 3.886 4.899) 14.077 7.907 ( -19.222 -7.552 -11.728) 23.750 8.148 ( -11.122 6.469 8.481) 15.410 8.649 ( -1.823 2.148 3.017) 4.128 8.938 ( 12.982 4.636 -3.532) 14.231 9.313 ( -3.776 -9.710 -6.493) 12.276 9.827 ( 2.241 -6.719 4.477) 8.379 11.255 ( -12.101 6.048 11.913) 18.026 11.826 ( 7.103 9.476 3.775) 12.430 11.843 ( 13.452 -7.440 5.173) 16.219 12.380 ( 2.298 -3.315 -6.675) 7.800 12.831 ( -5.525 -1.757 -0.203) 5.801 13.201 ( 8.299 -0.668 -3.919) 9.202 18.480 ( 5.561 1.920 -0.733) 5.928 18.851 ( 6.575 -7.413 0.258) 9.913 19.239 ( -0.513 -0.174 -2.066) 2.136 19.541 ( -2.865 -3.443 -2.374) 5.069 20.786 ( 2.982 -3.105 5.339) 6.858 21.015 ( 3.934 -3.985 2.258) 6.038 27.609 ( -2.570 1.034 -0.733) 2.865 27.728 ( 0.633 2.202 -0.100) 2.293 37.145 ( -0.866 7.082 -5.616) 9.080 37.532 ( -12.629 0.083 7.383) 14.629 38.774 ( -7.794 14.678 2.652) 16.829 39.903 ( -7.833 0.744 -25.248) 26.446 ======================= Grid point 254 (137/371) ======================= q-point: ( 0.23 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.350 ( -12.245 17.538 14.153) 25.648 3.684 ( -8.339 27.565 6.855) 29.603 4.664 ( -12.349 4.348 -7.635) 15.155 6.192 ( 13.379 -0.883 0.057) 13.408 6.646 ( 2.115 -1.466 10.415) 10.728 7.313 ( -24.908 -4.807 -18.941) 31.658 7.852 ( 6.337 2.040 3.859) 7.696 8.080 ( -6.377 3.517 4.968) 8.816 8.552 ( -7.721 -11.990 5.047) 15.128 9.099 ( 3.714 10.832 -6.140) 12.993 9.327 ( 9.442 7.855 -1.124) 12.333 9.759 ( -4.820 -7.082 3.947) 9.432 11.197 ( -9.330 6.059 10.340) 15.188 11.900 ( 1.393 -7.618 6.874) 10.355 12.095 ( 8.214 -3.212 -2.964) 9.304 12.436 ( 14.128 3.262 1.632) 14.591 12.731 ( -3.877 -0.155 -2.141) 4.432 13.311 ( 8.877 -1.541 -4.238) 9.957 18.578 ( 4.337 -1.624 0.359) 4.645 18.880 ( 5.222 -2.871 -2.281) 6.381 19.237 ( 2.080 -4.042 -0.446) 4.567 19.421 ( -4.495 -3.790 -2.477) 6.380 20.821 ( 2.629 -5.582 5.750) 8.433 21.043 ( 3.380 -5.303 2.548) 6.785 27.582 ( -2.111 1.984 -0.370) 2.921 27.758 ( 0.305 2.383 -0.451) 2.444 37.187 ( -2.764 9.972 -5.091) 11.532 37.360 ( -11.233 1.841 5.502) 12.642 38.725 ( -16.404 11.408 4.169) 20.411 39.737 ( 1.089 7.774 -27.717) 28.807 ======================= Grid point 255 (138/371) ======================= q-point: ( 0.31 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.457 ( -4.970 17.195 13.943) 22.688 3.903 ( -2.434 24.848 7.439) 26.051 4.495 ( -7.154 2.472 -7.678) 10.782 6.384 ( 9.640 -2.155 0.815) 9.912 6.691 ( -7.699 -1.866 3.180) 8.537 6.873 ( -5.927 2.474 -7.863) 10.152 7.860 ( -15.776 9.747 7.612) 20.046 8.062 ( 4.124 -8.583 -0.028) 9.522 8.354 ( 0.988 -10.268 -6.510) 12.198 9.305 ( 4.193 20.610 -1.992) 21.127 9.540 ( -1.028 -6.013 6.852) 9.174 9.641 ( 0.457 9.681 2.545) 10.021 11.162 ( -4.054 -0.529 6.426) 7.616 11.769 ( -4.724 -15.514 6.623) 17.518 12.143 ( 0.464 6.220 -0.840) 6.294 12.654 ( -4.748 8.537 -2.426) 10.066 12.811 ( 22.367 -6.121 -0.946) 23.209 13.402 ( 7.715 -4.498 -4.394) 9.953 18.568 ( 0.256 -7.025 1.803) 7.257 18.963 ( 5.706 1.885 -6.720) 9.015 19.147 ( -4.971 -7.351 2.102) 9.119 19.384 ( 3.646 -1.719 -1.254) 4.222 20.824 ( 1.344 -6.883 5.581) 8.963 21.051 ( 2.398 -5.935 2.485) 6.866 27.576 ( -1.058 2.581 -0.113) 2.792 27.772 ( -0.796 1.973 -0.629) 2.219 37.068 ( -14.688 3.857 2.196) 15.344 37.395 ( 3.810 11.001 -3.161) 12.064 38.538 ( -19.129 9.773 3.698) 21.797 39.777 ( 7.190 11.353 -24.356) 27.817 ======================= Grid point 256 (139/371) ======================= q-point: ( 0.38 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.615 ( -1.071 12.131 9.455) 15.418 4.063 ( -5.421 16.078 4.269) 17.496 4.401 ( -1.078 -0.222 -8.589) 8.659 6.442 ( 2.483 -2.979 -3.700) 5.360 6.516 ( -5.069 1.803 0.900) 5.455 7.032 ( 5.827 8.181 8.266) 13.008 7.698 ( -15.107 8.920 9.770) 20.081 8.031 ( 2.843 -9.132 -2.588) 9.908 8.344 ( 8.729 -1.251 -11.267) 14.307 9.258 ( -12.830 -8.765 -2.799) 15.788 9.613 ( 4.451 17.604 0.371) 18.162 9.891 ( 3.949 15.771 11.238) 19.764 11.104 ( 1.186 -13.425 5.420) 14.526 11.644 ( -1.359 -6.925 8.946) 11.395 12.207 ( 0.346 7.608 -3.379) 8.332 12.639 ( -4.006 7.969 -3.739) 9.672 13.035 ( 12.385 -5.549 -3.154) 13.933 13.398 ( 1.340 -9.185 -3.758) 10.015 18.526 ( 2.446 -6.615 1.196) 7.154 18.875 ( -6.319 -7.846 -3.135) 10.551 19.144 ( 3.340 3.547 -1.239) 5.027 19.427 ( 3.564 -2.527 0.075) 4.369 20.796 ( 0.042 -6.803 4.931) 8.402 21.035 ( 1.080 -5.822 2.019) 6.257 27.595 ( 0.318 2.866 -0.062) 2.885 27.764 ( -1.675 1.377 -0.614) 2.253 36.911 ( -8.856 3.686 1.014) 9.646 37.568 ( 5.273 11.057 -1.531) 12.345 38.376 ( -13.829 10.313 3.193) 17.544 39.878 ( 5.748 10.276 -19.717) 22.965 ======================= Grid point 257 (140/371) ======================= q-point: ( 0.46 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.724 ( 1.942 3.016 3.242) 4.835 4.134 ( -2.116 10.883 2.771) 11.428 4.363 ( 1.563 1.059 -6.733) 6.992 6.411 ( 0.682 -5.810 -2.388) 6.319 6.555 ( 1.619 6.816 2.999) 7.620 7.096 ( -12.936 6.989 10.903) 18.305 7.781 ( 9.551 4.156 6.344) 12.196 7.966 ( 0.250 -3.421 -1.884) 3.914 8.448 ( 3.567 8.706 -8.901) 12.952 8.955 ( -5.344 -13.332 -6.311) 15.688 9.784 ( -2.495 15.201 -1.868) 15.517 10.145 ( 2.039 13.635 10.464) 17.308 11.031 ( 4.391 -18.772 8.956) 21.257 11.664 ( 3.550 -3.417 6.730) 8.341 12.261 ( 0.951 7.458 -6.499) 9.938 12.633 ( -3.492 7.145 -3.077) 8.527 13.088 ( 2.559 -5.316 -3.581) 6.902 13.242 ( -6.724 -8.017 -2.306) 10.715 18.534 ( 4.690 -5.861 -1.934) 7.752 18.705 ( -3.518 -6.621 1.118) 7.580 19.203 ( -0.109 4.210 -2.146) 4.727 19.439 ( 0.526 -2.713 0.675) 2.845 20.755 ( -0.526 -5.540 3.865) 6.775 21.000 ( -0.170 -4.904 1.234) 5.060 27.636 ( 1.333 2.725 -0.197) 3.040 27.745 ( -1.358 0.930 -0.441) 1.704 36.878 ( 0.763 3.003 -0.031) 3.098 37.732 ( 3.375 7.818 1.241) 8.605 38.326 ( -5.799 10.508 2.263) 12.214 39.938 ( 1.694 8.098 -14.404) 16.611 ======================= Grid point 258 (141/371) ======================= q-point: ( 0.54 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.803 ( 6.293 -1.896 2.128) 6.908 4.245 ( 4.201 7.783 0.995) 8.900 4.408 ( 3.916 2.660 -2.854) 5.528 6.339 ( -1.483 -5.075 -2.753) 5.961 6.671 ( 3.365 5.629 1.341) 6.694 6.962 ( -15.489 4.184 12.465) 20.317 7.805 ( -1.840 -5.207 -4.902) 7.384 8.153 ( 14.779 1.031 5.260) 15.721 8.417 ( -13.310 12.700 -6.084) 19.376 8.919 ( 17.106 -8.616 -5.500) 19.927 9.812 ( -7.786 11.808 -2.083) 14.296 10.278 ( -3.115 7.762 3.792) 9.183 10.957 ( 2.736 -21.283 8.917) 23.237 11.741 ( 6.420 -3.614 2.778) 7.874 12.319 ( 0.926 7.435 -2.963) 8.057 12.626 ( -2.644 5.479 -2.119) 6.442 12.932 ( -11.059 -8.581 -0.284) 14.000 13.126 ( -2.459 2.785 -3.898) 5.385 18.497 ( 0.143 -5.686 -2.420) 6.181 18.704 ( 6.772 -3.331 1.286) 7.656 19.191 ( -4.687 3.349 -1.115) 5.867 19.401 ( -2.690 -2.099 0.899) 3.529 20.723 ( -0.004 -3.550 2.503) 4.344 20.954 ( -1.099 -3.383 0.430) 3.583 27.676 ( 0.991 1.446 -0.302) 1.779 27.744 ( 0.468 1.305 -0.265) 1.412 36.984 ( 9.331 1.507 -0.605) 9.471 37.820 ( -0.742 4.041 2.172) 4.648 38.408 ( 2.753 9.138 2.308) 9.819 39.938 ( -2.389 6.038 -8.681) 10.840 ======================= Grid point 259 (142/371) ======================= q-point: ( 0.62 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.912 ( 7.080 -1.622 2.197) 7.588 4.419 ( 7.639 4.444 2.371) 9.150 4.480 ( 5.077 -0.380 -3.323) 6.080 6.234 ( -5.235 -3.303 -2.332) 6.614 6.754 ( -4.723 7.969 -3.616) 9.944 6.867 ( 0.935 -3.374 14.411) 14.830 7.697 ( -3.607 -1.137 -5.424) 6.612 8.240 ( -6.856 7.465 -1.554) 10.254 8.467 ( 13.264 -1.825 1.423) 13.465 9.140 ( 15.580 -2.430 -3.089) 16.068 9.745 ( -10.623 8.563 -2.363) 13.848 10.196 ( -12.949 0.475 -3.057) 13.313 10.866 ( 6.754 -17.390 8.597) 20.541 11.798 ( 3.795 -4.426 -1.768) 6.092 12.400 ( -1.048 7.321 2.312) 7.749 12.574 ( -10.730 -6.377 -2.195) 12.673 12.708 ( -3.523 4.362 0.098) 5.608 13.119 ( -1.610 5.071 -2.438) 5.852 18.459 ( 1.891 -3.596 -0.587) 4.105 18.813 ( 8.466 -1.173 -1.690) 8.712 19.107 ( -8.206 1.542 1.060) 8.416 19.336 ( -3.787 -0.573 0.939) 3.944 20.717 ( 1.048 -1.724 1.156) 2.325 20.907 ( -1.887 -1.705 -0.111) 2.545 27.695 ( 1.201 -0.250 -0.114) 1.232 27.773 ( 0.989 1.769 -0.284) 2.046 37.184 ( 14.199 0.157 -1.040) 14.238 37.812 ( -3.728 0.605 1.640) 4.118 38.593 ( 8.197 7.230 2.864) 11.299 39.891 ( -5.041 4.004 -3.328) 7.247 ======================= Grid point 260 (143/371) ======================= q-point: (-0.31 -0.54 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.007 ( 4.852 -1.178 0.621) 5.032 4.514 ( 3.728 -4.647 -1.153) 6.068 4.554 ( 4.392 0.470 -1.101) 4.553 6.081 ( -9.827 -1.695 0.451) 9.982 6.673 ( -6.022 3.867 -3.228) 7.850 7.084 ( 15.608 0.195 10.290) 18.696 7.653 ( 2.683 2.906 -4.455) 5.958 8.230 ( -4.404 7.952 3.870) 9.879 8.660 ( 13.977 -6.193 0.055) 15.287 9.266 ( 4.115 -4.106 -4.420) 7.303 9.589 ( -14.262 3.424 -3.833) 15.160 9.922 ( -11.360 -4.717 -1.393) 12.379 10.981 ( 13.054 -3.428 6.852) 15.136 11.746 ( -6.206 -0.775 -3.519) 7.176 12.182 ( -15.107 -7.619 -10.919) 20.137 12.478 ( -1.507 -1.358 8.309) 8.553 12.803 ( 4.887 5.622 0.913) 7.504 13.128 ( -2.581 5.202 -0.633) 5.841 18.483 ( 4.150 -1.949 -0.208) 4.589 18.900 ( -0.066 3.006 -5.367) 6.152 18.999 ( -3.036 -2.048 5.279) 6.424 19.294 ( -1.998 1.325 0.844) 2.542 20.733 ( 1.946 -0.825 0.147) 2.118 20.860 ( -2.737 -0.121 -0.311) 2.757 27.714 ( 1.992 -1.330 -0.055) 2.395 27.795 ( -0.202 1.395 -0.104) 1.414 37.413 ( 14.078 -0.358 -1.607) 14.174 37.739 ( -4.414 -3.100 1.739) 5.667 38.811 ( 7.893 6.730 1.914) 10.548 39.834 ( -3.710 1.922 1.020) 4.301 ======================= Grid point 261 (144/371) ======================= q-point: (-0.23 -0.54 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.038 ( 0.845 -2.459 -1.185) 2.858 4.481 ( 2.545 -9.590 -2.498) 10.232 4.616 ( 1.589 5.433 0.855) 5.725 5.912 ( -8.694 -1.820 1.966) 9.097 6.611 ( -2.362 2.402 -7.010) 7.778 7.351 ( 6.080 4.865 9.413) 12.216 7.887 ( 22.358 3.221 -0.133) 22.589 8.246 ( -4.577 3.604 6.179) 8.492 8.766 ( 6.475 -9.734 -2.125) 11.882 9.150 ( -7.546 0.312 -4.368) 8.724 9.369 ( -7.960 -4.893 -2.604) 9.700 9.784 ( -3.741 -2.453 1.466) 4.708 11.231 ( 11.236 4.278 1.709) 12.143 11.520 ( -18.262 5.348 -5.466) 19.799 11.897 ( -5.390 -8.132 -3.533) 10.376 12.456 ( -0.088 -5.217 0.995) 5.312 12.931 ( 5.842 0.502 1.357) 6.019 13.118 ( -4.334 4.389 0.748) 6.213 18.538 ( 3.952 -1.032 -0.664) 4.138 18.793 ( -8.141 -0.640 0.241) 8.169 19.059 ( 4.877 1.808 1.018) 5.300 19.307 ( 0.321 3.006 0.268) 3.035 20.760 ( 2.200 -1.328 -0.346) 2.592 20.815 ( -3.109 1.768 -0.214) 3.583 27.730 ( 1.956 -2.102 -0.251) 2.883 27.791 ( -1.431 0.758 0.278) 1.643 37.545 ( -1.081 -1.246 0.062) 1.651 37.694 ( 7.636 -5.318 0.097) 9.306 38.944 ( -1.467 6.816 0.218) 6.975 39.860 ( 4.970 0.950 3.149) 5.960 ======================= Grid point 262 (145/371) ======================= q-point: (-0.15 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.971 ( -5.438 -2.176 -0.956) 5.934 4.423 ( 2.291 -8.425 -2.452) 9.068 4.751 ( 2.662 13.890 5.034) 15.012 5.805 ( -2.057 -3.527 0.840) 4.169 6.564 ( -1.274 2.173 -7.767) 8.166 7.534 ( 4.572 8.646 7.246) 12.172 7.987 ( -8.570 -17.893 2.293) 19.972 8.373 ( 9.877 10.194 -1.989) 14.333 8.711 ( -0.134 -2.263 0.965) 2.464 9.136 ( -3.499 5.796 0.278) 6.776 9.202 ( 5.036 -14.726 -2.841) 15.821 9.717 ( -2.730 -3.299 2.361) 4.890 11.183 ( -11.854 7.314 -4.791) 14.730 11.562 ( 8.863 9.105 -0.216) 12.709 11.760 ( -6.514 -3.018 4.370) 8.404 12.399 ( 2.239 -8.090 -4.815) 9.677 13.006 ( 4.312 -3.308 -0.236) 5.440 13.076 ( -5.309 2.898 1.183) 6.162 18.550 ( -2.897 0.241 -0.185) 2.913 18.693 ( 0.384 -5.468 0.858) 5.548 19.183 ( 5.992 4.504 0.730) 7.531 19.345 ( 0.114 4.119 -0.892) 4.216 20.750 ( -2.065 -0.285 0.241) 2.099 20.818 ( 1.422 1.367 -0.321) 1.998 27.731 ( 0.641 -2.078 -0.409) 2.213 27.770 ( -1.618 -0.182 0.451) 1.690 37.439 ( -6.498 -4.091 2.627) 8.116 37.802 ( 8.574 -4.082 -2.537) 9.829 38.899 ( -10.612 6.877 0.467) 12.654 40.031 ( 11.688 1.471 0.876) 11.812 ======================= Grid point 263 (146/371) ======================= q-point: (-0.08 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.828 ( -11.501 1.508 2.101) 11.788 4.347 ( -4.797 -3.021 -1.276) 5.811 5.003 ( 3.944 19.265 5.586) 20.442 5.785 ( 4.679 -5.351 -1.943) 7.369 6.536 ( -0.886 2.671 -4.935) 5.681 7.509 ( -14.109 -14.662 -4.690) 20.882 7.832 ( 8.514 3.453 7.721) 12.001 8.498 ( -1.055 1.426 9.101) 9.272 8.691 ( -7.896 10.128 -7.238) 14.742 8.970 ( -5.472 -9.266 -6.834) 12.748 9.333 ( 15.908 -9.683 2.556) 18.798 9.670 ( -0.625 -3.736 3.483) 5.146 11.191 ( 1.498 12.216 3.706) 12.853 11.623 ( -8.984 0.231 5.946) 10.776 11.787 ( 5.229 6.899 -0.140) 8.657 12.337 ( 4.754 -9.037 -8.731) 13.435 12.980 ( -4.134 -0.171 -0.510) 4.169 13.051 ( 1.365 -2.064 -0.519) 2.528 18.476 ( -4.394 -0.904 0.790) 4.555 18.694 ( 5.369 -6.985 0.019) 8.810 19.313 ( 1.775 4.670 -0.106) 4.997 19.392 ( 3.551 4.329 -1.318) 5.752 20.717 ( -2.425 0.983 1.280) 2.913 20.861 ( 2.954 0.118 0.045) 2.957 27.710 ( -0.825 -1.154 -0.157) 1.427 27.742 ( -1.286 -1.027 0.015) 1.646 37.314 ( -5.935 -3.422 2.694) 7.361 37.840 ( 2.627 -4.395 -2.778) 5.826 38.786 ( -11.737 8.878 1.584) 14.801 40.217 ( 9.387 0.971 -4.439) 10.429 ======================= Grid point 266 (147/371) ======================= q-point: ( 0.15 0.54 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.808 ( -8.743 8.303 5.363) 13.197 4.089 ( -14.693 11.712 1.116) 18.823 5.094 ( -13.125 -1.231 -11.335) 17.386 5.788 ( 8.011 -2.889 0.359) 8.524 6.632 ( -1.146 1.801 8.667) 8.926 7.373 ( 15.790 6.888 4.435) 17.789 7.948 ( -8.371 -15.810 -10.802) 20.897 8.428 ( -8.681 5.192 -3.722) 10.778 8.549 ( 7.589 -1.581 -2.382) 8.110 8.898 ( 1.239 9.211 5.856) 10.985 9.332 ( -5.795 -0.019 -2.001) 6.131 9.700 ( 7.175 -7.713 7.815) 13.117 11.472 ( 4.441 -1.689 2.400) 5.323 11.728 ( -5.552 -0.973 7.548) 9.421 11.870 ( -0.459 2.022 6.428) 6.754 12.224 ( 5.731 0.295 -4.617) 7.365 12.893 ( -4.450 -0.538 -0.000) 4.482 13.078 ( 5.653 0.422 -2.482) 6.188 18.449 ( 1.653 4.635 -1.026) 5.027 18.674 ( 6.838 -5.841 0.818) 9.030 19.282 ( -5.324 0.293 -1.670) 5.587 19.514 ( 0.467 -4.136 -1.236) 4.342 20.755 ( 1.280 -0.862 2.032) 2.551 20.927 ( 3.242 -3.416 0.951) 4.804 27.657 ( -2.007 1.460 -0.030) 2.482 27.731 ( 0.972 1.300 -0.185) 1.634 37.178 ( 0.500 5.088 -5.470) 7.487 37.749 ( -8.104 1.181 7.963) 11.422 38.902 ( 3.174 6.164 -6.483) 9.492 39.997 ( -13.943 1.303 -9.285) 16.802 ======================= Grid point 267 (148/371) ======================= q-point: ( 0.23 0.54 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.752 ( -11.883 12.152 6.650) 18.251 4.062 ( -7.476 17.691 4.694) 19.771 4.835 ( -11.000 -1.803 -7.468) 13.417 5.942 ( 13.350 -2.617 1.282) 13.665 6.690 ( 0.086 1.815 10.439) 10.596 7.506 ( -15.840 -6.135 -17.387) 24.307 7.706 ( 9.510 0.196 0.380) 9.519 8.213 ( -9.957 -3.437 -6.910) 12.598 8.634 ( -3.114 -3.789 7.870) 9.273 9.079 ( 7.872 9.461 5.824) 13.615 9.303 ( 2.160 10.819 -6.397) 12.753 9.733 ( 1.309 -8.262 5.748) 10.150 11.524 ( -11.944 5.958 11.007) 17.300 11.783 ( 15.945 -5.481 6.378) 18.026 11.860 ( 0.927 -8.552 2.350) 8.917 12.315 ( 6.161 2.829 -2.989) 7.409 12.807 ( -5.365 1.895 -1.384) 5.856 13.161 ( 6.145 -0.437 -3.736) 7.205 18.532 ( 2.426 3.405 0.402) 4.200 18.734 ( 7.164 -4.281 -1.003) 8.406 19.201 ( -2.255 -2.458 -1.067) 3.502 19.438 ( -3.282 -4.740 -1.656) 5.998 20.776 ( 1.297 -2.089 2.714) 3.662 20.949 ( 3.443 -4.617 1.073) 5.858 27.639 ( -2.382 2.395 0.205) 3.384 27.763 ( 1.192 1.702 -0.538) 2.146 37.245 ( 2.470 9.727 -5.201) 11.304 37.620 ( -13.438 0.683 6.879) 15.112 38.972 ( -0.812 6.490 -3.455) 7.397 39.738 ( -10.635 3.311 -13.560) 17.548 ======================= Grid point 268 (149/371) ======================= q-point: ( 0.31 0.54 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.753 ( -7.256 12.482 7.185) 16.127 4.187 ( -2.680 17.706 6.083) 18.913 4.621 ( -10.036 -0.642 -4.383) 10.971 6.164 ( 14.457 -3.065 3.572) 15.204 6.778 ( 2.485 1.783 10.027) 10.483 7.015 ( -22.285 -3.599 -17.552) 28.594 7.837 ( 7.447 -4.406 -2.112) 8.907 8.055 ( 0.959 -2.534 -11.928) 12.232 8.468 ( -18.248 1.048 10.431) 21.045 9.371 ( 9.851 12.870 2.923) 16.469 9.519 ( 8.903 9.161 1.270) 12.838 9.665 ( -1.002 -4.187 2.826) 5.150 11.333 ( -14.916 -6.628 6.377) 17.524 11.775 ( -3.717 -5.880 7.563) 10.276 12.077 ( 14.192 0.421 1.989) 14.337 12.462 ( 12.628 -1.514 -0.569) 12.731 12.765 ( -2.892 6.216 -2.304) 7.233 13.225 ( 6.252 -2.802 -5.438) 8.747 18.544 ( -1.824 -3.243 2.724) 4.611 18.840 ( 8.153 2.065 -5.163) 9.869 19.138 ( -1.527 -6.473 1.631) 6.848 19.342 ( -1.493 -2.149 -1.994) 3.290 20.782 ( 0.633 -3.313 2.982) 4.502 20.963 ( 3.106 -4.950 1.064) 5.940 27.628 ( -2.105 2.829 0.398) 3.548 27.789 ( 0.404 1.463 -0.754) 1.695 37.352 ( -6.820 9.587 0.122) 11.766 37.438 ( -5.454 3.361 0.567) 6.432 38.894 ( -13.345 3.766 0.174) 13.867 39.657 ( 3.541 7.683 -15.177) 17.376 ======================= Grid point 269 (150/371) ======================= q-point: ( 0.38 0.54 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.783 ( -4.742 6.587 3.752) 8.942 4.302 ( -4.816 11.556 3.271) 12.940 4.462 ( -7.841 1.925 -1.169) 8.158 6.336 ( 6.888 -4.441 4.186) 9.203 6.647 ( -11.131 1.863 -8.680) 14.237 6.936 ( 10.352 1.263 6.758) 12.427 7.867 ( 5.109 -7.856 -3.187) 9.898 8.047 ( 2.204 4.061 -9.511) 10.574 8.250 ( -15.261 6.752 6.465) 17.897 9.399 ( -11.909 -9.080 1.767) 15.080 9.658 ( 7.335 15.202 -2.401) 17.049 9.944 ( 14.026 12.417 7.670) 20.241 11.039 ( -9.041 -17.233 4.808) 20.046 11.719 ( -5.335 0.086 9.000) 10.463 12.228 ( 3.118 4.813 -3.840) 6.901 12.633 ( 9.325 -3.748 -1.918) 10.232 12.827 ( 5.551 4.481 -0.287) 7.140 13.245 ( 4.513 -5.816 -6.018) 9.508 18.482 ( -1.948 -4.183 2.294) 5.153 18.881 ( -2.657 -2.890 -5.296) 6.592 19.100 ( 3.535 -0.764 2.138) 4.201 19.345 ( 3.536 -1.226 -0.970) 3.866 20.766 ( -0.142 -4.007 2.841) 4.914 20.966 ( 2.192 -4.598 0.914) 5.175 27.630 ( -1.166 2.835 0.445) 3.097 27.792 ( -0.855 0.862 -0.792) 1.450 37.154 ( -15.515 2.456 2.149) 15.854 37.577 ( 5.356 10.596 -1.032) 11.917 38.685 ( -14.384 2.955 0.243) 14.686 39.771 ( 7.450 8.717 -11.839) 16.482 ======================= Grid point 270 (151/371) ======================= q-point: ( 0.46 0.54 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.750 ( -3.144 -0.257 -0.501) 3.194 4.281 ( -6.556 5.986 -0.555) 8.895 4.408 ( -3.702 4.215 3.037) 6.379 6.344 ( 0.005 -2.817 -3.557) 4.538 6.598 ( 0.623 2.460 5.148) 5.739 7.164 ( 11.888 -2.216 4.756) 12.994 7.803 ( -3.275 -3.245 -4.222) 6.252 8.027 ( -6.970 6.410 4.341) 10.417 8.302 ( 10.003 9.095 -4.424) 14.225 9.072 ( -17.340 -7.370 -2.360) 18.988 9.868 ( 4.823 9.787 -2.504) 11.194 10.281 ( 5.567 13.887 6.109) 16.160 10.821 ( 1.537 -20.628 6.668) 21.734 11.685 ( -4.205 -0.245 7.067) 8.227 12.273 ( 1.361 5.358 -7.498) 9.316 12.686 ( 1.259 1.875 -3.124) 3.854 12.958 ( 6.862 -2.468 0.828) 7.340 13.200 ( 0.525 -5.257 -5.119) 7.357 18.447 ( 0.697 -2.598 0.710) 2.782 18.731 ( -6.215 -5.010 -1.139) 8.064 19.196 ( 4.176 2.869 -0.560) 5.097 19.389 ( 3.154 -1.594 0.177) 3.538 20.735 ( -0.559 -3.900 2.329) 4.577 20.957 ( 0.997 -3.607 0.557) 3.784 27.649 ( 0.093 2.499 0.323) 2.521 27.772 ( -1.575 0.246 -0.682) 1.734 36.978 ( -9.151 2.208 1.024) 9.469 37.747 ( 4.295 7.401 2.203) 8.837 38.519 ( -8.771 2.968 -1.117) 9.327 39.904 ( 4.700 8.160 -7.011) 11.740 ======================= Grid point 271 (152/371) ======================= q-point: ( 0.54 0.54 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.724 ( 1.956 -1.113 0.990) 2.459 4.257 ( -0.844 4.029 -0.900) 4.214 4.418 ( -1.190 1.792 3.154) 3.817 6.289 ( -0.756 -1.512 -6.578) 6.792 6.678 ( 1.908 0.071 8.939) 9.140 7.252 ( -3.250 -0.988 5.739) 6.669 7.725 ( 0.971 -1.835 -7.052) 7.352 8.039 ( 2.033 0.605 2.358) 3.172 8.599 ( 14.652 11.287 -0.482) 18.502 8.720 ( -16.486 -3.424 -2.781) 17.066 9.960 ( -0.933 5.935 -3.019) 6.724 10.416 ( -2.606 8.530 1.544) 9.052 10.738 ( 4.806 -20.845 4.586) 21.878 11.651 ( -0.303 -3.542 2.325) 4.248 12.338 ( 3.487 7.774 -3.637) 9.263 12.695 ( -0.993 2.923 -2.091) 3.729 12.961 ( -2.200 -6.550 0.096) 6.910 13.155 ( -0.330 2.095 -3.946) 4.480 18.447 ( 0.401 -1.115 -1.046) 1.581 18.627 ( -0.287 -3.089 0.712) 3.183 19.256 ( -0.030 2.653 -0.167) 2.659 19.407 ( 0.394 -1.429 0.720) 1.648 20.705 ( -0.249 -2.957 1.438) 3.297 20.939 ( -0.067 -2.057 0.068) 2.059 27.676 ( 0.458 1.271 0.052) 1.352 27.750 ( -0.541 0.346 -0.424) 0.770 36.920 ( -0.267 1.145 0.493) 1.274 37.860 ( 1.296 2.198 4.943) 5.563 38.454 ( -1.070 2.787 -2.803) 4.095 39.995 ( 0.089 7.481 -1.587) 7.649 ======================= Grid point 272 (153/371) ======================= q-point: (-0.38 -0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.797 ( 5.891 -1.484 2.629) 6.620 4.327 ( 5.973 1.920 -0.236) 6.279 4.426 ( 0.531 -1.408 1.827) 2.367 6.229 ( -1.364 0.301 -7.170) 7.305 6.743 ( 2.476 -2.546 9.009) 9.684 7.131 ( -14.210 1.643 6.117) 15.557 7.704 ( 0.955 1.101 -8.356) 8.482 8.121 ( 12.719 -9.347 -1.236) 15.832 8.485 ( -11.061 2.062 2.442) 11.514 8.939 ( 13.184 10.461 0.839) 16.852 9.928 ( -5.680 3.108 -3.155) 7.203 10.372 ( -11.294 -0.025 -8.244) 13.983 10.627 ( 7.263 -16.051 6.178) 18.670 11.636 ( 4.160 -6.545 -3.231) 8.402 12.476 ( 3.076 6.265 4.921) 8.540 12.679 ( -5.757 2.512 -1.817) 6.539 12.807 ( -6.809 -1.918 -3.751) 8.006 13.174 ( -0.249 5.178 -1.580) 5.420 18.419 ( -0.840 -1.160 -0.675) 1.584 18.681 ( 6.779 0.951 -0.230) 6.850 19.238 ( -4.932 1.423 1.352) 5.308 19.385 ( -2.188 -0.689 0.864) 2.451 20.690 ( 0.653 -1.660 0.284) 1.806 20.919 ( -0.929 -0.314 -0.349) 1.041 27.678 ( 0.032 -0.988 -0.115) 0.995 27.767 ( 1.368 1.341 -0.192) 1.925 36.991 ( 8.086 -0.383 -0.101) 8.096 37.874 ( -2.579 -2.437 5.490) 6.537 38.510 ( 6.962 1.728 -2.900) 7.737 40.029 ( -4.795 6.704 3.583) 8.987 ======================= Grid point 273 (154/371) ======================= q-point: (-0.31 -0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.867 ( 6.343 -6.888 -1.165) 9.436 4.420 ( 2.873 -6.497 0.582) 7.128 4.456 ( 5.636 2.357 -0.207) 6.113 6.179 ( -3.414 2.772 -4.117) 6.024 6.791 ( -2.956 -1.176 0.828) 3.287 6.994 ( -0.830 0.323 12.638) 12.670 7.686 ( -1.992 6.225 -6.991) 9.570 8.260 ( 18.380 -13.395 -3.154) 22.960 8.405 ( -5.896 1.823 8.915) 10.843 9.193 ( 6.310 8.389 -1.439) 10.596 9.813 ( -9.449 1.514 -3.261) 10.110 10.013 ( -13.306 -13.429 -8.795) 20.850 10.781 ( 12.919 2.204 4.928) 14.001 11.620 ( 5.948 -8.422 -7.811) 12.935 12.411 ( -20.028 -2.872 -5.870) 21.067 12.553 ( -2.133 1.349 6.854) 7.304 12.803 ( 1.837 4.461 -1.352) 5.011 13.216 ( -1.457 6.435 0.343) 6.607 18.415 ( 1.841 -0.498 -0.534) 1.981 18.826 ( 7.460 4.691 -1.609) 8.958 19.142 ( -8.646 -0.387 3.414) 9.304 19.345 ( -2.601 0.381 0.923) 2.786 20.696 ( 1.491 -0.833 -0.799) 1.885 20.899 ( -1.756 1.223 -0.554) 2.211 27.671 ( 1.077 -2.013 -0.001) 2.283 27.799 ( 0.995 1.021 -0.113) 1.430 37.159 ( 13.465 -1.645 -1.160) 13.615 37.798 ( -5.010 -5.701 5.069) 9.127 38.669 ( 12.459 0.653 -2.583) 12.740 40.006 ( -8.510 5.690 7.834) 12.891 ======================= Grid point 274 (155/371) ======================= q-point: (-0.23 -0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.867 ( 7.686 -12.520 -5.330) 15.628 4.348 ( 0.419 -11.731 -3.022) 12.121 4.593 ( 6.610 5.629 1.039) 8.744 6.096 ( -9.940 3.203 1.486) 10.548 6.654 ( -5.946 -1.063 -4.994) 7.838 7.282 ( 16.496 5.245 16.353) 23.813 7.718 ( 3.164 7.823 -4.261) 9.454 8.368 ( -5.435 -3.102 13.078) 14.498 8.410 ( 17.773 -14.538 -7.166) 24.054 9.255 ( -4.776 4.519 -4.952) 8.231 9.565 ( -15.896 1.122 -5.056) 16.718 9.777 ( -0.888 -9.342 0.339) 9.390 11.083 ( 14.410 8.479 1.620) 16.798 11.594 ( 6.254 -7.925 -10.507) 14.571 11.988 ( -23.878 0.148 -8.743) 25.428 12.530 ( -4.675 -1.397 7.317) 8.794 12.860 ( 2.976 -0.710 0.225) 3.068 13.234 ( -3.886 5.145 1.218) 6.562 18.461 ( 3.767 0.552 -0.788) 3.888 18.933 ( -4.467 3.889 -3.050) 6.662 19.036 ( -0.829 0.732 5.472) 5.582 19.333 ( -0.407 1.858 0.899) 2.104 20.711 ( 1.927 -0.846 -1.510) 2.590 20.879 ( -2.459 2.430 -0.519) 3.495 27.675 ( 1.886 -2.497 0.075) 3.130 27.812 ( -0.262 0.231 0.071) 0.356 37.363 ( 14.417 -2.303 -2.857) 14.877 37.672 ( -5.469 -7.954 5.401) 11.061 38.870 ( 12.363 0.366 -3.824) 12.946 39.961 ( -7.987 5.018 10.940) 14.444 ======================= Grid point 275 (156/371) ======================= q-point: (-0.15 -0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.851 ( 8.801 -12.478 -6.511) 16.600 4.241 ( 4.252 -12.453 -3.697) 13.668 4.795 ( 8.136 10.215 2.463) 13.290 5.949 ( -12.326 2.239 5.079) 13.518 6.562 ( -1.529 -0.202 -5.681) 5.886 7.595 ( 4.425 10.577 6.681) 13.269 7.880 ( 5.614 -9.239 3.678) 11.419 8.312 ( 3.146 2.646 0.886) 4.206 8.512 ( 13.624 -13.022 -0.428) 18.851 9.118 ( -7.590 -3.626 -2.278) 8.714 9.382 ( -11.839 9.511 -0.975) 15.218 9.709 ( -0.249 -7.099 2.447) 7.512 11.345 ( 4.263 7.271 -4.044) 9.349 11.560 ( 3.415 -3.918 -8.343) 9.829 11.659 ( -7.415 2.620 -7.700) 11.006 12.458 ( -7.419 -0.981 7.790) 10.803 12.894 ( 4.030 -4.104 0.216) 5.756 13.198 ( -5.517 2.609 1.127) 6.206 18.523 ( 3.311 0.519 -0.907) 3.472 18.776 ( -10.703 -1.971 1.614) 11.002 19.143 ( 4.566 4.975 1.255) 6.868 19.373 ( 1.097 4.020 0.162) 4.170 20.724 ( 1.879 -1.355 -1.653) 2.846 20.862 ( -2.490 3.166 -0.310) 4.040 27.683 ( 1.892 -2.472 0.068) 3.114 27.796 ( -1.399 -0.632 0.277) 1.560 37.479 ( -0.375 -4.648 -1.847) 5.016 37.597 ( 7.466 -6.596 3.369) 10.517 38.988 ( 3.861 0.004 -5.428) 6.661 39.993 ( -0.608 5.550 11.313) 12.616 ======================= Grid point 276 (157/371) ======================= q-point: (-0.08 -0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.843 ( 5.511 -7.898 -5.374) 11.029 4.237 ( 8.487 -8.422 -2.309) 12.178 5.076 ( 10.260 13.845 3.445) 17.574 5.815 ( -9.196 1.322 5.624) 10.860 6.536 ( 0.573 1.109 -3.257) 3.488 7.582 ( -15.550 -20.484 -3.661) 25.977 7.784 ( 5.193 11.139 0.967) 12.328 8.499 ( 7.484 1.012 -4.069) 8.579 8.667 ( 13.349 -4.540 6.617) 15.575 8.934 ( -7.925 -8.313 1.025) 11.531 9.312 ( -8.488 10.552 -0.110) 13.542 9.649 ( -0.651 -6.631 3.501) 7.527 11.340 ( -3.421 10.198 0.816) 10.787 11.584 ( 8.968 -8.048 -12.854) 17.618 11.706 ( 5.983 5.709 -2.589) 8.665 12.355 ( -10.055 0.673 8.175) 12.976 12.917 ( 3.486 -3.895 -0.800) 5.288 13.125 ( -5.728 0.880 0.974) 5.877 18.559 ( 1.414 -0.118 -0.851) 1.655 18.605 ( -7.636 -3.422 1.967) 8.596 19.276 ( 5.964 3.769 0.796) 7.099 19.423 ( -0.675 5.304 -0.917) 5.424 20.728 ( 1.188 -1.384 -1.085) 2.122 20.858 ( -1.224 2.718 -0.080) 2.981 27.688 ( 1.170 -1.850 0.033) 2.189 27.762 ( -1.762 -1.146 0.349) 2.130 37.365 ( -4.334 -5.884 0.899) 7.363 37.704 ( 7.993 -3.998 0.041) 8.938 38.955 ( -3.191 0.355 -5.262) 6.164 40.136 ( 3.837 5.792 7.194) 10.001 ======================= Grid point 279 (158/371) ======================= q-point: ( 0.15 -0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.838 ( 9.754 -2.224 -0.878) 10.043 4.315 ( -1.574 4.488 0.780) 4.820 5.141 ( -8.032 -12.247 -13.614) 19.996 5.778 ( -5.814 3.691 5.432) 8.771 6.714 ( -0.021 1.089 10.734) 10.789 7.233 ( 13.484 12.272 1.538) 18.297 7.838 ( -4.904 -15.709 -10.939) 19.761 8.245 ( 13.928 2.668 -11.502) 18.259 8.756 ( -13.287 7.430 0.955) 15.254 9.015 ( -1.465 7.849 4.948) 9.393 9.402 ( -0.924 -5.111 9.715) 11.016 9.590 ( 2.738 -1.409 4.299) 5.288 11.292 ( 8.510 -6.000 -7.443) 12.799 11.565 ( 10.955 -11.543 -5.994) 17.006 12.015 ( -5.954 0.162 10.543) 12.109 12.362 ( -9.347 8.871 9.996) 16.309 12.964 ( 4.911 0.300 -1.871) 5.264 12.996 ( -4.869 2.374 0.084) 5.417 18.453 ( 2.541 0.492 -1.205) 2.855 18.597 ( -1.129 2.942 1.289) 3.405 19.371 ( -5.530 -1.509 -1.561) 5.941 19.455 ( 0.817 -2.508 -0.445) 2.675 20.722 ( 2.852 -1.412 -0.442) 3.213 20.879 ( -0.104 -1.163 0.577) 1.303 27.691 ( -0.117 0.949 -0.022) 0.956 27.726 ( 0.439 0.977 0.363) 1.131 37.165 ( 2.399 2.904 -5.201) 6.422 37.890 ( -2.114 2.018 7.924) 8.446 38.762 ( 8.893 -2.302 -11.357) 14.607 40.249 ( -15.595 3.375 0.501) 15.964 ======================= Grid point 280 (159/371) ======================= q-point: ( 0.23 0.62 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.945 ( 2.115 3.194 0.932) 3.943 4.310 ( -5.857 9.503 2.065) 11.352 4.871 ( -4.292 -9.930 -8.788) 13.938 5.802 ( 2.862 1.469 4.715) 5.708 6.767 ( -1.009 0.357 10.792) 10.845 7.504 ( -0.394 -2.036 -12.531) 12.702 7.591 ( 3.776 0.990 -4.635) 6.060 8.407 ( -8.194 1.474 -5.648) 10.060 8.564 ( 0.266 5.386 -1.840) 5.698 9.136 ( 3.518 7.944 5.100) 10.075 9.343 ( -3.704 -3.916 4.302) 6.897 9.665 ( 3.435 -2.253 6.427) 7.628 11.433 ( 16.631 -3.439 3.842) 17.412 11.643 ( 12.398 -7.055 -6.892) 15.843 11.849 ( -12.251 -10.557 6.868) 17.570 12.381 ( -6.253 9.559 8.882) 14.470 12.934 ( -6.623 4.789 0.058) 8.173 13.040 ( 5.926 -1.126 -4.074) 7.279 18.535 ( 5.724 4.114 -2.345) 7.429 18.612 ( 0.058 -0.614 2.479) 2.554 19.241 ( -5.862 -3.067 -1.444) 6.772 19.421 ( -0.967 -4.183 -0.987) 4.405 20.752 ( 1.960 -0.722 0.337) 2.116 20.872 ( 1.316 -3.006 0.719) 3.359 27.697 ( -1.268 2.338 0.407) 2.691 27.749 ( 1.292 0.941 -0.295) 1.625 37.246 ( 4.401 7.549 -4.275) 9.728 37.849 ( -9.065 0.699 6.063) 10.928 38.870 ( 10.572 1.044 -8.912) 13.866 39.981 ( -18.451 2.236 -2.819) 18.798 ======================= Grid point 281 (160/371) ======================= q-point: ( 0.31 0.62 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.974 ( -4.446 6.565 1.302) 8.035 4.366 ( -0.829 9.864 3.493) 10.497 4.710 ( -4.217 -4.580 -2.505) 6.711 5.947 ( 10.888 -0.808 5.567) 12.256 6.781 ( -0.750 -4.628 3.529) 5.868 7.246 ( -12.856 -1.173 -8.499) 15.456 7.723 ( 2.883 4.928 -7.216) 9.201 8.065 ( -15.209 0.060 -8.387) 17.368 8.732 ( -1.180 4.489 6.138) 7.695 9.303 ( 6.921 2.861 6.959) 10.223 9.386 ( 12.469 1.963 -0.811) 12.649 9.693 ( -1.737 0.231 3.083) 3.546 11.513 ( -15.885 -15.782 5.577) 23.077 11.736 ( 9.999 -5.754 0.595) 11.552 11.787 ( 20.349 2.386 1.448) 20.540 12.413 ( -3.428 5.704 6.173) 9.077 12.877 ( -5.661 5.056 -0.758) 7.628 13.088 ( 4.878 -1.850 -5.872) 7.855 18.589 ( -3.442 -0.662 3.427) 4.902 18.688 ( 9.573 2.754 -3.745) 10.642 19.128 ( -3.161 -4.183 0.128) 5.245 19.344 ( -2.554 -3.282 -1.643) 4.471 20.768 ( 0.281 -0.769 1.035) 1.320 20.875 ( 2.718 -3.808 0.453) 4.700 27.695 ( -2.268 2.781 0.718) 3.660 27.779 ( 1.512 0.689 -0.735) 1.817 37.396 ( 5.727 9.995 -2.357) 11.758 37.684 ( -14.214 0.308 3.466) 14.634 38.972 ( 3.343 -0.184 -5.685) 6.598 39.731 ( -11.237 4.845 -4.359) 12.990 ======================= Grid point 282 (161/371) ======================= q-point: ( 0.38 0.62 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.937 ( -6.758 3.821 -0.348) 7.771 4.450 ( -1.503 5.886 2.252) 6.479 4.613 ( -5.907 1.186 2.645) 6.579 6.170 ( 12.889 -2.669 7.639) 15.219 6.661 ( -2.088 -7.390 -14.273) 16.208 7.042 ( -13.528 5.488 9.247) 17.281 7.709 ( 2.318 -3.513 -4.119) 5.889 7.974 ( 2.051 8.513 -10.746) 13.862 8.645 ( -15.161 4.762 6.439) 17.146 9.431 ( 1.538 -7.075 5.600) 9.153 9.651 ( 5.921 5.348 -2.321) 8.309 9.772 ( 16.986 7.944 2.437) 18.909 11.114 ( -15.782 -16.960 3.833) 23.482 11.809 ( 2.595 -0.373 1.390) 2.967 12.121 ( 12.968 2.552 -1.401) 13.291 12.463 ( 4.068 1.008 5.140) 6.633 12.841 ( -2.008 1.625 -0.682) 2.672 13.109 ( 3.718 -1.232 -6.663) 7.729 18.522 ( -4.388 -2.313 2.985) 5.789 18.831 ( 5.428 2.917 -5.774) 8.445 19.061 ( -0.489 -4.114 3.738) 5.580 19.293 ( 0.627 -1.106 -1.776) 2.184 20.757 ( -0.804 -1.832 1.307) 2.390 20.891 ( 2.865 -3.071 0.174) 4.204 27.686 ( -2.173 2.443 0.704) 3.344 27.797 ( 0.474 0.310 -0.771) 0.957 37.441 ( -15.220 -0.302 1.163) 15.268 37.588 ( 4.550 10.946 0.805) 11.882 38.867 ( -9.114 -4.002 -4.151) 10.785 39.719 ( 2.958 8.630 -3.179) 9.660 ======================= Grid point 283 (162/371) ======================= q-point: ( 0.46 0.62 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.830 ( -7.224 0.677 -2.116) 7.558 4.422 ( -5.626 0.262 -0.372) 5.645 4.560 ( -6.580 3.732 6.089) 9.711 6.313 ( 1.526 -1.901 2.518) 3.505 6.575 ( 7.110 -1.283 -7.428) 10.362 6.997 ( -0.086 -2.998 8.412) 8.931 7.721 ( 4.147 -2.674 -4.614) 6.755 8.086 ( 3.477 10.388 -5.402) 12.214 8.486 ( -12.071 6.933 5.776) 15.071 9.261 ( -13.593 -6.709 2.591) 15.378 9.801 ( 8.619 3.551 -3.794) 10.065 10.185 ( 19.420 6.550 1.238) 20.532 10.764 ( -11.033 -14.015 4.345) 18.358 11.815 ( -4.493 0.675 4.112) 6.128 12.214 ( 4.397 1.247 -10.559) 11.506 12.618 ( 6.618 2.298 3.102) 7.662 12.844 ( 4.187 -4.592 1.792) 6.468 13.122 ( 2.124 0.931 -5.561) 6.025 18.459 ( -2.581 -0.703 2.018) 3.351 18.794 ( -6.026 -1.129 -3.142) 6.889 19.125 ( 6.489 0.641 2.160) 6.869 19.320 ( 3.650 -0.452 -0.686) 3.742 20.726 ( -1.031 -2.546 1.058) 2.944 20.908 ( 1.963 -1.845 -0.028) 2.694 27.681 ( -1.225 1.818 0.538) 2.258 27.790 ( -0.912 -0.216 -0.627) 1.127 37.199 ( -14.508 0.638 0.952) 14.553 37.761 ( 4.141 7.425 3.327) 9.129 38.639 ( -9.124 -5.044 -4.685) 11.430 39.879 ( 5.834 8.968 0.399) 10.706 ======================= Grid point 284 (163/371) ======================= q-point: (-0.46 -0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.736 ( -3.237 0.744 -0.631) 3.381 4.313 ( -4.021 -3.305 -1.545) 5.429 4.523 ( -6.259 2.939 7.732) 10.373 6.280 ( -1.900 1.570 -5.854) 6.352 6.696 ( 4.009 0.587 7.898) 8.876 7.049 ( 12.169 -11.751 0.414) 16.922 7.718 ( -0.476 1.328 -7.444) 7.576 8.091 ( -7.374 0.174 -0.685) 7.407 8.563 ( 6.639 11.716 5.336) 14.485 8.970 ( -16.877 -1.907 2.543) 17.174 9.920 ( 6.208 -0.723 -3.709) 7.268 10.440 ( 9.731 -8.168 -5.135) 13.703 10.560 ( -5.535 -1.337 3.336) 6.600 11.714 ( -7.578 -2.433 1.382) 8.078 12.298 ( 7.755 6.592 -5.988) 11.809 12.689 ( 1.235 0.024 -0.836) 1.492 12.894 ( 4.299 -4.652 1.370) 6.481 13.147 ( 1.509 3.416 -3.171) 4.899 18.456 ( -0.083 2.620 1.392) 2.968 18.658 ( -6.417 -1.555 -1.443) 6.759 19.241 ( 4.532 1.464 1.476) 4.986 19.373 ( 2.934 -0.318 0.097) 2.953 20.691 ( -0.680 -2.375 0.363) 2.497 20.920 ( 0.898 -0.409 -0.302) 1.032 27.686 ( -0.289 0.855 0.306) 0.953 27.763 ( -1.278 -0.496 -0.414) 1.432 37.012 ( -9.118 0.254 1.145) 9.193 37.881 ( 1.787 2.032 6.153) 6.722 38.457 ( -3.569 -5.114 -6.088) 8.715 40.052 ( 3.301 8.482 4.782) 10.281 ======================= Grid point 285 (164/371) ======================= q-point: (-0.38 -0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.726 ( 1.543 -2.265 -0.222) 2.749 4.243 ( 2.457 -6.211 -1.712) 6.895 4.498 ( -5.407 3.353 9.154) 11.148 6.242 ( -1.968 4.318 -6.777) 8.273 6.754 ( -0.721 -2.927 11.182) 11.581 7.163 ( 12.779 -10.970 -0.096) 16.842 7.635 ( -4.751 1.165 -11.463) 12.463 7.957 ( -2.571 -4.973 -1.966) 5.933 8.741 ( -12.371 0.788 6.898) 14.186 8.865 ( 10.069 12.057 5.775) 16.736 9.941 ( 1.302 -3.866 -4.243) 5.886 10.290 ( -0.381 -23.497 -9.465) 25.334 10.579 ( -1.348 10.865 -0.990) 10.993 11.578 ( -4.667 -3.977 -2.097) 6.480 12.483 ( 5.204 4.736 4.648) 8.433 12.697 ( 3.149 -2.185 -2.109) 4.375 12.881 ( -3.687 3.786 -5.064) 7.319 13.202 ( 1.670 4.696 -0.722) 5.036 18.471 ( -4.488 3.247 0.322) 5.549 18.608 ( 3.551 1.777 -0.381) 3.990 19.299 ( -0.099 0.614 2.580) 2.654 19.400 ( 0.345 0.126 0.212) 0.424 20.668 ( 0.171 -1.468 -0.768) 1.666 20.928 ( -0.011 1.090 -0.628) 1.258 27.676 ( -1.023 -1.136 0.111) 1.533 27.755 ( 0.878 0.294 -0.192) 0.946 36.930 ( -1.150 -1.097 1.227) 2.008 37.911 ( -1.627 -3.869 7.853) 8.905 38.378 ( 4.029 -4.896 -6.826) 9.317 40.184 ( -1.210 7.805 9.145) 12.084 ======================= Grid point 286 (165/371) ======================= q-point: (-0.31 -0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.683 ( 2.743 -12.081 -5.574) 13.585 4.247 ( 6.737 -10.435 -1.199) 12.478 4.511 ( -3.776 5.420 8.699) 10.922 6.239 ( -1.323 7.583 -4.486) 8.909 6.780 ( 1.833 -4.624 11.073) 12.139 7.134 ( -7.123 -6.325 3.156) 10.035 7.602 ( 12.209 -2.676 -13.972) 18.747 7.916 ( 2.881 -3.213 -2.403) 4.939 8.616 ( -10.170 0.450 12.047) 15.773 9.156 ( 9.439 9.277 2.699) 13.507 9.841 ( -3.038 -10.936 -4.500) 12.210 9.965 ( -5.001 -17.885 -13.069) 22.709 10.730 ( 4.815 14.720 1.516) 15.562 11.466 ( -1.049 -5.327 -6.324) 8.335 12.496 ( -2.960 -10.677 6.145) 12.670 12.735 ( -0.175 1.311 -0.062) 1.324 12.819 ( -7.673 11.535 -8.052) 16.024 13.286 ( 1.455 7.310 0.297) 7.459 18.424 ( -2.601 2.021 -0.581) 3.345 18.755 ( 7.469 7.142 -0.009) 10.334 19.271 ( -5.303 -0.907 4.184) 6.815 19.391 ( -1.846 0.704 0.283) 1.996 20.661 ( 1.035 -0.515 -2.096) 2.394 20.933 ( -0.823 2.325 -0.897) 2.624 27.646 ( -0.451 -2.136 0.252) 2.197 27.781 ( 1.757 0.182 -0.191) 1.776 36.966 ( 6.941 -2.533 0.651) 7.417 37.842 ( -4.454 -8.036 7.294) 11.731 38.426 ( 11.457 -5.156 -5.751) 13.818 40.248 ( -6.366 6.859 12.869) 15.912 ======================= Grid point 287 (166/371) ======================= q-point: (-0.23 -0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.557 ( 6.043 -19.312 -9.620) 22.406 4.180 ( 2.186 -17.841 -3.328) 18.280 4.581 ( 1.970 6.135 5.177) 8.265 6.274 ( -4.151 9.025 -0.111) 9.934 6.722 ( -7.955 -7.655 1.172) 11.102 7.155 ( 12.738 1.861 15.045) 19.801 7.738 ( 7.624 6.905 -12.808) 16.427 7.951 ( 11.156 -10.646 -2.732) 15.660 8.515 ( -8.416 -4.326 11.396) 14.813 9.324 ( -0.176 5.151 -2.681) 5.810 9.625 ( 1.535 -14.760 -4.226) 15.429 9.737 ( -6.567 -5.362 -4.252) 9.484 10.988 ( 8.140 12.020 1.125) 14.560 11.400 ( 3.188 -0.754 -9.896) 10.424 12.295 ( -13.355 -5.189 -1.565) 14.413 12.659 ( -11.355 5.474 0.560) 12.618 12.799 ( 2.800 -3.584 -1.565) 4.810 13.352 ( -2.719 6.719 0.770) 7.289 18.435 ( 1.058 3.540 -0.624) 3.747 18.947 ( 5.819 8.984 -1.652) 10.831 19.163 ( -8.518 -2.236 6.107) 10.717 19.370 ( -1.786 1.399 0.754) 2.391 20.666 ( 1.490 -0.181 -3.193) 3.529 20.934 ( -1.596 3.095 -1.008) 3.625 27.630 ( 0.837 -2.410 0.490) 2.598 27.803 ( 1.071 -0.533 -0.168) 1.208 37.101 ( 12.454 -3.268 -0.738) 12.897 37.707 ( -5.480 -10.367 6.566) 13.439 38.578 ( 16.128 -5.316 -5.610) 17.884 40.245 ( -10.078 6.081 15.810) 19.710 ======================= Grid point 288 (167/371) ======================= q-point: (-0.15 -0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.460 ( 12.519 -20.752 -10.092) 26.253 4.009 ( 3.663 -19.921 -4.316) 20.710 4.744 ( 8.050 6.414 2.799) 10.666 6.228 ( -12.128 5.974 5.713) 14.677 6.550 ( -2.756 -5.228 -2.705) 6.500 7.571 ( 17.983 6.100 13.417) 23.251 7.796 ( -1.841 2.638 -4.511) 5.540 8.059 ( 17.950 -9.661 -8.495) 22.084 8.377 ( -4.908 -5.909 3.766) 8.555 9.225 ( -7.963 -1.866 -0.630) 8.203 9.581 ( -3.713 -7.370 2.016) 8.495 9.634 ( 2.338 2.541 -0.237) 3.461 11.132 ( 8.497 -6.381 -7.406) 12.953 11.498 ( 3.311 15.043 -6.356) 16.663 11.984 ( -21.195 6.116 -4.833) 22.583 12.541 ( -3.381 -5.076 3.890) 7.235 12.807 ( 3.005 -3.990 0.299) 5.004 13.329 ( -6.258 3.648 1.289) 7.357 18.499 ( 1.672 4.123 -0.304) 4.460 18.944 ( -9.804 -1.100 0.615) 9.885 19.153 ( 1.668 5.971 3.067) 6.917 19.389 ( 1.310 3.450 1.032) 3.832 20.671 ( 1.693 -0.538 -3.719) 4.121 20.929 ( -2.177 3.389 -0.927) 4.133 27.632 ( 1.718 -2.204 0.692) 2.879 27.801 ( -0.197 -1.424 -0.082) 1.440 37.279 ( 13.227 -3.124 -3.171) 13.956 37.555 ( -4.211 -11.107 6.981) 13.778 38.754 ( 14.833 -5.987 -7.837) 17.812 40.227 ( -9.126 6.808 17.821) 21.148 ======================= Grid point 289 (168/371) ======================= q-point: (-0.08 -0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.484 ( 17.494 -17.042 -8.548) 25.876 3.942 ( 11.833 -15.857 -2.545) 19.948 4.988 ( 12.705 6.767 1.746) 14.500 6.089 ( -14.111 4.040 9.117) 17.279 6.504 ( 1.547 -1.564 -1.440) 2.629 7.600 ( -11.546 -14.570 -4.288) 19.078 7.843 ( 4.898 9.579 -5.278) 11.984 8.196 ( 11.702 -12.090 -5.239) 17.622 8.489 ( 15.551 6.868 6.368) 18.154 9.067 ( -10.141 -2.871 4.436) 11.436 9.504 ( -2.158 -3.634 5.501) 6.937 9.656 ( -4.197 4.084 -0.901) 5.925 11.153 ( 11.252 -9.756 -12.399) 19.378 11.582 ( -5.835 11.772 -2.068) 13.300 11.771 ( -8.741 6.795 -3.465) 11.601 12.508 ( -1.149 -1.668 7.095) 7.378 12.829 ( 3.491 -2.417 -0.201) 4.250 13.248 ( -7.414 1.812 1.828) 7.848 18.533 ( -0.637 0.169 0.544) 0.854 18.771 ( -10.268 0.693 1.044) 10.344 19.241 ( 2.610 3.437 1.558) 4.589 19.470 ( 1.451 6.213 0.046) 6.380 20.673 ( 1.986 -1.280 -3.466) 4.195 20.918 ( -2.378 3.160 -0.692) 4.015 27.649 ( 1.870 -1.491 0.817) 2.527 27.772 ( -1.088 -2.065 -0.020) 2.334 37.340 ( 0.067 -6.719 -3.908) 7.773 37.530 ( 8.681 -5.494 6.225) 12.012 38.831 ( 8.088 -7.528 -10.369) 15.153 40.282 ( -4.424 8.762 16.806) 19.463 ======================= Grid point 292 (169/371) ======================= q-point: ( 0.15 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.502 ( 21.670 -9.452 -2.125) 23.737 4.201 ( 16.780 -2.794 1.223) 17.054 5.040 ( -5.145 -15.597 -10.389) 19.433 6.044 ( -13.562 6.878 6.765) 16.643 6.733 ( 5.330 -0.681 12.542) 13.644 7.213 ( 6.082 16.514 -0.363) 17.602 7.664 ( 3.982 -12.537 -16.051) 20.752 8.062 ( 3.546 4.782 -11.028) 12.532 8.817 ( 7.647 -8.876 6.253) 13.280 9.217 ( -4.872 9.260 7.345) 12.784 9.421 ( -4.426 -1.058 1.677) 4.850 9.607 ( 0.328 2.397 1.711) 2.963 11.073 ( 4.401 2.898 -11.678) 12.812 11.321 ( 2.563 -12.584 -1.180) 12.896 12.149 ( -3.317 -2.284 13.655) 14.236 12.587 ( -4.400 3.322 6.621) 8.616 12.845 ( 4.231 -2.114 -4.608) 6.604 13.169 ( -8.046 5.836 4.268) 10.817 18.415 ( 0.112 -0.281 -0.042) 0.306 18.729 ( -6.209 8.072 0.405) 10.192 19.361 ( 0.742 -2.908 0.710) 3.084 19.495 ( -5.875 -1.170 -2.446) 6.471 20.637 ( 4.307 -2.161 -1.447) 5.032 20.903 ( -2.368 0.500 0.139) 2.424 27.677 ( 0.991 -0.672 -0.801) 1.441 27.738 ( 0.852 1.571 1.388) 2.263 37.103 ( 4.272 1.134 -4.745) 6.485 37.931 ( 4.260 1.983 6.772) 8.242 38.490 ( 11.588 -6.804 -10.584) 17.106 40.543 ( -14.807 3.597 3.451) 15.624 ======================= Grid point 293 (170/371) ======================= q-point: ( 0.23 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.760 ( 17.975 -4.188 -0.515) 18.463 4.402 ( 7.171 2.356 1.779) 7.755 4.742 ( -4.864 -13.649 -9.835) 17.512 5.938 ( -9.989 5.738 6.143) 13.055 6.817 ( 0.027 -4.285 10.307) 11.162 7.443 ( -1.217 0.288 -8.533) 8.625 7.547 ( 5.352 10.925 -7.638) 14.364 8.212 ( 15.675 3.009 -5.177) 16.780 8.850 ( -4.921 -0.065 -2.103) 5.352 9.159 ( -8.490 5.120 0.607) 9.933 9.386 ( -1.986 -5.936 10.062) 11.850 9.664 ( 1.689 3.130 4.155) 5.469 11.155 ( 12.711 -1.347 -4.415) 13.523 11.332 ( 10.416 -6.750 -2.967) 12.762 11.975 ( -12.640 -13.963 9.163) 20.945 12.624 ( -4.438 7.995 7.377) 11.749 12.894 ( 6.749 -1.882 -5.264) 8.764 13.114 ( -8.024 5.276 3.054) 10.077 18.444 ( 3.805 0.773 -1.224) 4.071 18.717 ( -4.981 6.909 1.693) 8.684 19.290 ( -4.911 -4.675 -1.634) 6.975 19.400 ( -1.756 -2.841 -0.873) 3.453 20.687 ( 4.291 -1.287 -0.552) 4.513 20.869 ( -1.998 -0.545 0.535) 2.139 27.696 ( 2.008 0.300 -0.837) 2.196 27.764 ( -0.441 1.784 1.133) 2.159 37.201 ( 6.213 5.734 -3.263) 9.062 37.969 ( -2.630 -1.427 2.609) 3.970 38.630 ( 13.609 0.085 -5.209) 14.572 40.292 ( -18.489 0.794 -1.036) 18.535 ======================= Grid point 294 (171/371) ======================= q-point: ( 0.31 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.969 ( 9.403 -0.533 0.215) 9.421 4.488 ( -3.456 8.106 0.581) 8.831 4.603 ( 6.684 -10.276 -3.191) 12.667 5.910 ( -1.868 2.447 6.516) 7.207 6.752 ( -2.951 -9.481 -1.008) 9.981 7.333 ( -3.879 0.355 0.743) 3.965 7.733 ( 2.849 16.609 -12.232) 20.823 8.398 ( -12.993 -0.259 -0.717) 13.016 8.685 ( 3.043 8.484 -2.272) 9.295 9.175 ( 8.027 -7.460 1.401) 11.048 9.331 ( -2.186 -1.186 5.694) 6.214 9.737 ( 0.235 2.512 3.977) 4.710 11.448 ( 20.332 1.717 -8.049) 21.934 11.464 ( 15.337 -5.333 7.483) 17.879 11.637 ( -14.767 -16.283 4.946) 22.532 12.629 ( -7.589 6.066 5.758) 11.294 12.958 ( 5.703 -1.436 -5.082) 7.773 13.033 ( -7.990 3.783 1.185) 8.920 18.535 ( 6.687 0.445 -1.483) 6.864 18.705 ( -4.426 4.709 2.223) 6.834 19.154 ( -4.533 -3.936 -1.313) 6.145 19.343 ( -1.865 -2.815 -0.972) 3.513 20.742 ( 3.358 -0.122 -0.215) 3.368 20.834 ( -1.213 -1.854 0.651) 2.309 27.733 ( 1.870 1.081 -0.568) 2.233 27.769 ( -1.131 1.117 0.673) 1.726 37.366 ( 7.068 7.784 -1.067) 10.568 37.871 ( -7.530 -1.866 -0.111) 7.759 38.826 ( 10.011 1.109 -1.899) 10.249 39.987 ( -17.134 1.188 -2.728) 17.391 ======================= Grid point 295 (172/371) ======================= q-point: ( 0.38 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.033 ( -1.249 0.378 -0.632) 1.450 4.509 ( -0.802 3.675 -0.101) 3.763 4.645 ( 3.416 -1.798 1.588) 4.174 5.996 ( 8.066 -2.134 6.453) 10.548 6.570 ( -4.096 -8.409 -9.618) 13.416 7.322 ( -5.296 4.068 8.227) 10.596 7.787 ( -10.229 10.603 -7.086) 16.348 8.064 ( -11.274 5.905 -4.207) 13.404 8.827 ( -2.095 -2.081 2.327) 3.760 9.292 ( 12.363 -0.780 1.333) 12.459 9.452 ( 14.362 -0.371 3.686) 14.833 9.746 ( -2.093 2.166 -0.314) 3.028 11.239 ( -15.681 -15.976 2.692) 22.547 11.622 ( 12.858 -1.784 -5.884) 14.253 11.871 ( 20.357 2.619 4.271) 20.964 12.557 ( -6.600 0.679 2.882) 7.234 12.916 ( -6.397 -0.846 1.409) 6.605 13.032 ( 3.219 3.037 -4.416) 6.251 18.580 ( -1.961 -1.926 1.420) 3.094 18.740 ( 4.877 4.294 -1.872) 6.763 19.075 ( -2.201 -1.564 1.316) 3.004 19.281 ( -1.801 -1.725 -1.278) 2.802 20.770 ( -1.104 0.022 0.266) 1.136 20.821 ( 2.710 -2.079 0.072) 3.417 27.746 ( -2.206 1.584 0.642) 2.791 27.775 ( 1.712 -0.145 -0.600) 1.820 37.527 ( 3.199 3.249 0.174) 4.563 37.726 ( -7.960 3.481 0.510) 8.703 38.881 ( -1.557 -4.560 -2.609) 5.480 39.810 ( -5.831 6.116 -0.368) 8.458 ======================= Grid point 296 (173/371) ======================= q-point: (-0.54 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.952 ( -7.198 0.567 -2.501) 7.642 4.472 ( -4.399 -3.536 -1.647) 5.880 4.679 ( -0.425 0.771 4.372) 4.460 6.188 ( 15.051 -5.063 6.466) 17.146 6.405 ( -2.418 -2.183 -11.876) 12.315 7.228 ( -16.256 2.155 11.295) 19.912 7.662 ( -2.368 3.092 -4.203) 5.730 8.140 ( 3.047 14.284 -1.314) 14.664 8.679 ( -8.573 -7.333 2.227) 11.500 9.399 ( -3.132 -0.141 2.449) 3.979 9.651 ( 6.277 -3.201 -0.248) 7.050 9.892 ( 20.114 4.704 -2.827) 20.850 10.885 ( -13.535 -8.694 1.361) 16.144 11.776 ( 9.491 -0.761 -3.414) 10.115 12.076 ( 4.480 -2.097 -9.620) 10.817 12.568 ( 6.892 0.556 7.374) 10.109 12.810 ( -5.532 -2.435 1.686) 6.275 13.089 ( 2.361 3.333 -2.901) 5.009 18.517 ( -3.547 -0.757 1.629) 3.976 18.838 ( 1.338 3.710 -4.472) 5.962 19.064 ( 1.346 -0.454 4.831) 5.035 19.264 ( 1.928 -0.371 -1.063) 2.232 20.732 ( -1.828 -1.764 0.119) 2.543 20.860 ( 2.718 -0.003 -0.289) 2.733 27.723 ( -1.986 0.611 0.413) 2.118 27.789 ( 0.328 -0.355 -0.350) 0.597 37.419 ( -11.594 -1.958 -0.924) 11.794 37.793 ( 2.844 7.197 4.624) 9.015 38.689 ( -9.196 -9.082 -4.957) 13.843 39.894 ( 4.045 8.947 4.215) 10.685 ======================= Grid point 297 (174/371) ======================= q-point: (-0.46 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.819 ( -6.839 0.219 -3.485) 7.679 4.303 ( -5.329 -9.966 -4.092) 12.020 4.689 ( -3.441 1.283 8.569) 9.323 6.313 ( -2.564 2.584 -3.178) 4.833 6.453 ( 19.654 -6.143 -1.170) 20.625 7.029 ( -13.164 -2.642 9.609) 16.511 7.684 ( 1.856 4.993 -7.022) 8.814 8.251 ( -8.052 5.971 -0.606) 10.043 8.547 ( 3.667 -6.105 7.324) 10.216 9.256 ( -14.304 3.205 3.079) 14.979 9.731 ( 9.386 -6.303 -3.328) 11.786 10.164 ( 11.135 -6.452 -5.142) 13.858 10.696 ( -6.808 5.695 -1.211) 8.958 11.786 ( -4.222 -4.865 -2.455) 6.893 12.122 ( 13.554 3.591 -11.288) 18.000 12.703 ( -4.638 -3.114 1.505) 5.785 12.766 ( 9.131 -0.537 4.394) 10.148 13.144 ( 1.868 3.476 -0.788) 4.024 18.497 ( -0.579 2.668 1.525) 3.127 18.780 ( -8.099 2.958 -2.816) 9.071 19.167 ( 6.492 0.462 4.087) 7.685 19.313 ( 4.012 0.414 -0.538) 4.069 20.687 ( -1.334 -1.954 -0.611) 2.444 20.900 ( 1.715 1.192 -0.526) 2.153 27.703 ( -1.038 0.027 0.267) 1.072 27.774 ( -1.101 -0.992 -0.152) 1.490 37.200 ( -12.550 -1.156 0.216) 12.605 37.908 ( 1.545 2.066 7.096) 7.551 38.428 ( -6.785 -10.467 -6.578) 14.102 40.094 ( 5.457 8.559 8.337) 13.136 ======================= Grid point 298 (175/371) ======================= q-point: (-0.38 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.696 ( -3.635 -5.591 -5.292) 8.513 4.118 ( -0.541 -12.612 -4.240) 13.317 4.694 ( -4.739 2.959 12.650) 13.829 6.294 ( -2.013 5.464 -4.294) 7.235 6.711 ( 20.166 -9.218 0.815) 22.188 6.864 ( -7.939 -5.131 8.505) 12.716 7.686 ( -3.631 3.647 -12.013) 13.069 8.033 ( -10.875 -4.346 -0.895) 11.745 8.709 ( 9.652 -3.567 10.883) 14.978 9.106 ( -12.508 9.747 5.195) 16.687 9.777 ( 7.418 -9.627 -4.236) 12.870 10.058 ( -2.203 -17.718 -10.341) 20.633 10.717 ( -2.484 14.390 -4.341) 15.234 11.638 ( -6.435 -3.132 -2.715) 7.654 12.404 ( 15.015 8.042 -3.219) 17.334 12.595 ( -1.702 -9.314 0.432) 9.478 12.896 ( 5.035 4.757 -2.489) 7.360 13.214 ( 1.969 4.362 1.397) 4.986 18.569 ( 3.035 6.543 1.629) 7.394 18.646 ( -9.615 3.104 -1.895) 10.280 19.282 ( 4.290 -0.419 4.511) 6.240 19.379 ( 2.900 1.358 -0.633) 3.265 20.650 ( -0.448 -1.252 -1.855) 2.283 20.933 ( 0.815 2.246 -0.851) 2.536 27.687 ( -1.118 -0.821 0.400) 1.443 27.745 ( -0.441 -1.197 -0.218) 1.294 37.011 ( -8.933 -1.755 1.448) 9.219 37.943 ( -1.524 -4.239 9.438) 10.458 38.231 ( -0.132 -10.367 -8.096) 13.154 40.296 ( 3.108 7.530 12.248) 14.710 ======================= Grid point 299 (176/371) ======================= q-point: (-0.31 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.504 ( -2.288 -16.520 -10.059) 19.477 4.014 ( 5.187 -15.406 -3.248) 16.577 4.712 ( -5.970 3.610 13.241) 14.966 6.313 ( -0.502 7.724 -2.385) 8.100 6.773 ( 0.413 -7.394 6.706) 9.991 6.932 ( 14.635 -10.801 4.105) 18.647 7.462 ( -8.302 -6.757 -12.406) 16.386 7.950 ( -2.485 6.857 -2.255) 7.634 8.775 ( -2.901 -7.217 10.154) 12.791 9.147 ( 1.947 10.816 4.849) 12.012 9.722 ( -2.560 -15.363 -7.545) 17.306 9.767 ( 0.988 -14.658 -10.056) 17.803 10.845 ( 1.790 18.269 -1.972) 18.462 11.485 ( -7.502 -1.418 -4.011) 8.625 12.460 ( -2.701 -12.431 3.916) 13.310 12.616 ( 7.732 -2.005 -2.990) 8.528 13.031 ( -0.339 15.906 -6.509) 17.189 13.307 ( 3.461 6.169 1.432) 7.217 18.527 ( -7.015 3.478 -1.802) 8.034 18.727 ( 5.602 9.692 1.600) 11.308 19.335 ( -0.344 -1.516 6.275) 6.464 19.415 ( 0.109 1.890 -1.003) 2.143 20.631 ( 0.552 -0.136 -3.567) 3.612 20.960 ( 0.027 3.054 -1.223) 3.290 27.649 ( -1.862 -1.949 0.685) 2.781 27.747 ( 1.722 -0.885 -0.389) 1.975 36.906 ( -1.988 -3.184 2.023) 4.264 37.873 ( -4.541 -9.680 9.028) 13.994 38.160 ( 7.939 -9.777 -7.112) 14.464 40.450 ( -1.390 6.309 15.798) 17.067 ======================= Grid point 300 (177/371) ======================= q-point: (-0.23 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.236 ( 0.986 -23.643 -12.990) 26.995 3.906 ( 4.830 -22.951 -5.142) 24.011 4.687 ( -5.008 -0.324 8.975) 10.282 6.399 ( 0.090 10.365 -0.389) 10.373 6.763 ( -3.897 -9.300 6.882) 12.208 6.970 ( 11.485 -13.667 3.458) 18.184 7.420 ( 13.671 -0.211 -5.709) 14.817 7.965 ( -4.041 8.499 -4.032) 10.238 8.636 ( -8.461 -9.071 4.580) 13.223 9.320 ( 5.119 5.160 -0.146) 7.270 9.477 ( -2.216 -9.453 -2.196) 9.954 9.656 ( 1.786 -12.359 -5.604) 13.687 11.047 ( 0.986 11.179 1.729) 11.355 11.384 ( -1.073 9.380 -6.729) 11.594 12.311 ( -2.682 -12.092 2.007) 12.548 12.658 ( 5.714 -7.249 -2.157) 9.479 13.006 ( -15.966 13.484 -5.125) 21.517 13.439 ( 1.296 8.404 -0.523) 8.519 18.484 ( -2.153 5.559 -1.199) 6.080 18.929 ( 6.335 10.206 0.033) 12.012 19.300 ( -6.184 -1.990 7.876) 10.209 19.416 ( -1.397 2.022 -0.291) 2.475 20.625 ( 1.135 0.635 -5.324) 5.481 20.978 ( -0.734 3.441 -1.506) 3.828 27.611 ( -0.721 -2.218 0.945) 2.516 27.768 ( 1.971 -1.215 -0.455) 2.360 36.914 ( 6.016 -4.079 1.492) 7.420 37.725 ( -5.604 -12.367 7.381) 15.454 38.222 ( 14.602 -9.803 -5.702) 18.489 40.528 ( -6.555 5.148 18.753) 20.522 ======================= Grid point 301 (178/371) ======================= q-point: (-0.15 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.001 ( 8.553 -26.112 -13.139) 30.457 3.693 ( 4.180 -28.722 -5.192) 29.485 4.696 ( 4.017 -1.903 4.864) 6.589 6.463 ( -3.710 9.129 0.323) 9.860 6.535 ( -7.750 -13.491 2.884) 15.824 7.232 ( 24.956 -9.424 2.073) 26.757 7.719 ( 18.424 7.884 3.043) 20.270 7.902 ( -7.687 1.896 -5.112) 9.424 8.410 ( -7.915 -8.078 -3.760) 11.918 9.315 ( -3.763 -0.533 1.988) 4.289 9.494 ( 1.356 -5.825 2.924) 6.657 9.585 ( 6.483 -3.142 -3.276) 7.915 11.022 ( -3.048 -3.208 -2.610) 5.138 11.606 ( 4.183 23.895 -2.000) 24.341 12.199 ( -1.377 -3.889 1.071) 4.263 12.622 ( -3.510 -10.010 -4.292) 11.443 12.776 ( -14.191 6.299 -2.633) 15.748 13.468 ( -4.772 5.148 0.117) 7.020 18.539 ( 0.543 7.690 -0.107) 7.710 19.046 ( -2.462 1.421 -1.558) 3.242 19.242 ( -3.461 4.547 6.963) 9.008 19.420 ( -0.580 3.091 1.674) 3.563 20.621 ( 1.305 0.578 -6.527) 6.681 20.984 ( -1.444 3.394 -1.567) 4.007 27.597 ( 0.794 -1.945 1.215) 2.427 27.776 ( 1.011 -1.891 -0.477) 2.197 37.030 ( 11.653 -3.555 -0.245) 12.186 37.550 ( -5.006 -13.422 6.635) 15.787 38.369 ( 17.659 -9.870 -6.909) 21.377 40.542 ( -9.374 5.215 20.918) 23.508 ======================= Grid point 302 (179/371) ======================= q-point: (-0.08 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.935 ( 19.613 -22.875 -9.793) 31.683 3.533 ( 12.349 -26.419 -2.287) 29.252 4.830 ( 11.738 -1.765 2.437) 12.118 6.344 ( -6.835 -6.938 8.566) 12.970 6.477 ( -2.190 4.601 -1.316) 5.263 7.487 ( 20.121 -13.708 -9.694) 26.205 7.681 ( -10.266 -5.549 -9.443) 15.012 8.131 ( 4.107 8.089 13.520) 16.281 8.293 ( 12.090 2.382 -7.314) 14.330 9.217 ( -8.745 -2.270 2.075) 9.270 9.471 ( 1.378 -4.653 6.570) 8.168 9.681 ( 5.409 0.883 -4.461) 7.067 10.965 ( 1.018 -0.246 -3.655) 3.802 11.763 ( -4.241 11.156 0.299) 11.939 12.091 ( -22.832 5.872 -4.824) 24.064 12.455 ( 6.810 -2.105 4.100) 8.223 12.734 ( 3.433 -2.930 -1.995) 4.935 13.410 ( -7.380 3.532 1.823) 8.382 18.591 ( -3.071 4.260 1.140) 5.374 18.931 ( -7.728 -0.150 0.797) 7.770 19.280 ( -1.770 4.306 2.124) 5.118 19.499 ( 2.487 6.593 1.957) 7.313 20.611 ( 1.562 -0.337 -6.622) 6.812 20.978 ( -2.008 2.986 -1.378) 3.853 27.611 ( 1.873 -1.212 1.444) 2.658 27.759 ( -0.199 -2.585 -0.498) 2.640 37.182 ( 9.547 -3.381 -4.398) 11.042 37.416 ( 0.940 -11.117 8.309) 13.911 38.495 ( 14.519 -11.455 -10.036) 21.042 40.566 ( -7.892 7.550 21.009) 23.678 ======================= Grid point 305 (180/371) ======================= q-point: ( 0.15 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.987 ( 27.368 -12.682 0.695) 30.172 3.777 ( 28.644 -8.343 2.786) 29.964 4.908 ( 2.427 -12.096 -4.278) 13.058 6.334 ( -9.589 4.821 4.965) 11.825 6.683 ( 6.899 -0.059 10.241) 12.348 7.176 ( 16.583 -0.988 -8.440) 18.634 7.449 ( -0.121 7.859 -5.674) 9.694 8.040 ( 0.762 1.444 -10.330) 10.459 8.606 ( 0.875 -14.553 2.651) 14.819 9.308 ( 6.659 5.784 10.259) 13.529 9.462 ( -0.568 -0.351 -6.227) 6.262 9.594 ( 2.202 0.264 -3.592) 4.221 11.174 ( -4.218 -5.451 -4.841) 8.423 11.270 ( -13.880 13.498 -0.460) 19.366 12.185 ( 4.549 -1.930 10.503) 11.607 12.597 ( 7.307 -2.539 1.259) 7.837 12.832 ( -10.161 -5.233 3.753) 12.030 13.373 ( -7.489 4.891 3.826) 9.729 18.460 ( -4.030 2.873 0.354) 4.962 18.918 ( -6.766 7.508 0.341) 10.113 19.354 ( -1.662 -1.131 1.967) 2.812 19.553 ( -5.656 -2.543 -4.554) 7.693 20.539 ( 4.480 -1.800 -0.952) 4.922 20.953 ( -2.731 0.810 -0.020) 2.849 27.647 ( 0.983 -1.319 -1.209) 2.042 27.734 ( 2.151 1.270 1.643) 2.990 37.005 ( 5.531 0.342 -4.119) 6.905 37.851 ( 9.582 -1.189 2.863) 10.071 38.173 ( 14.051 -5.951 -5.653) 16.273 40.823 ( -13.833 2.844 2.096) 14.277 ======================= Grid point 306 (181/371) ======================= q-point: ( 0.23 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.344 ( 26.106 -6.219 1.769) 26.895 4.115 ( 21.084 -8.388 0.867) 22.708 4.744 ( -6.935 -4.287 -4.966) 9.546 6.216 ( -12.645 4.942 4.238) 14.222 6.779 ( 2.673 -7.909 4.781) 9.620 7.404 ( 7.613 -0.237 -3.003) 8.187 7.552 ( 5.121 19.570 -3.211) 20.483 8.034 ( 4.484 4.544 -10.463) 12.257 8.623 ( 13.639 -16.264 4.711) 21.742 9.384 ( -3.938 -1.132 -5.377) 6.760 9.447 ( -3.311 6.886 6.692) 10.157 9.652 ( 4.545 0.479 0.602) 4.610 11.052 ( -0.910 -3.547 -1.156) 3.840 11.222 ( -3.945 8.312 -1.200) 9.279 12.095 ( -11.989 -13.920 9.365) 20.621 12.717 ( 1.980 3.371 3.174) 5.036 12.736 ( 6.577 -4.208 -2.806) 8.297 13.307 ( -7.997 3.224 3.321) 9.240 18.439 ( -1.655 3.095 -0.696) 3.578 18.889 ( -6.212 6.933 1.509) 9.430 19.299 ( -3.024 -4.215 -1.320) 5.353 19.416 ( -4.175 -2.944 -2.260) 5.586 20.601 ( 4.650 -0.774 0.449) 4.735 20.912 ( -2.922 0.233 0.297) 2.946 27.657 ( 1.977 -0.257 -1.133) 2.293 27.780 ( 1.073 1.094 1.257) 1.981 37.123 ( 7.606 4.948 -2.151) 9.325 37.907 ( 4.880 -7.363 -4.326) 9.835 38.413 ( 14.505 4.481 3.195) 15.514 40.573 ( -17.088 -0.624 -3.347) 17.424 ======================= Grid point 307 (182/371) ======================= q-point: ( 0.31 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.708 ( 20.615 -1.759 2.514) 20.842 4.310 ( 14.190 -10.186 -0.423) 17.472 4.636 ( -5.189 7.383 -1.525) 9.152 6.077 ( -10.746 2.198 3.850) 11.625 6.686 ( -1.966 -10.478 -3.912) 11.356 7.431 ( -3.809 3.252 6.845) 8.481 7.800 ( 3.557 20.123 -11.641) 23.518 8.236 ( 17.766 0.346 1.375) 17.822 8.702 ( 9.321 -9.195 -3.321) 13.508 9.223 ( -13.731 2.906 -5.497) 15.073 9.386 ( -7.647 -3.986 6.657) 10.894 9.748 ( 4.143 1.728 1.890) 4.871 11.163 ( 14.586 2.950 2.858) 15.153 11.278 ( 4.913 1.674 1.538) 5.413 11.755 ( -14.968 -15.428 5.578) 22.208 12.736 ( 0.049 -1.626 -3.762) 4.098 12.843 ( 5.298 2.165 0.672) 5.763 13.205 ( -8.484 0.987 2.296) 8.844 18.467 ( 2.297 2.665 -0.896) 3.631 18.846 ( -6.252 2.945 2.056) 7.210 19.176 ( -4.079 -3.801 -3.025) 6.343 19.352 ( -2.000 -0.935 -0.153) 2.213 20.675 ( 4.378 0.119 0.596) 4.420 20.865 ( -2.982 -0.434 0.307) 3.029 27.691 ( 2.744 0.209 -0.881) 2.889 27.799 ( -0.378 0.591 0.810) 1.071 37.306 ( 8.177 6.590 0.436) 10.511 37.866 ( 1.579 -6.253 -5.832) 8.695 38.697 ( 10.509 5.191 5.854) 13.102 40.251 ( -17.452 -1.160 -5.735) 18.406 ======================= Grid point 308 (183/371) ======================= q-point: ( 0.38 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.957 ( 9.377 -1.778 2.483) 9.862 4.437 ( 10.974 -4.763 -0.109) 11.964 4.652 ( -3.615 8.907 -0.746) 9.641 5.963 ( -3.750 -3.286 2.047) 5.390 6.531 ( -3.715 -5.955 -4.978) 8.605 7.444 ( -3.061 4.633 6.089) 8.241 7.968 ( 1.855 18.316 -6.997) 19.695 8.308 ( -10.298 -11.287 2.964) 15.563 8.789 ( 4.037 4.928 -4.236) 7.650 9.089 ( 6.158 -0.075 0.647) 6.193 9.304 ( 2.540 -5.463 0.279) 6.031 9.796 ( -0.786 0.315 0.960) 1.281 11.289 ( -3.744 -9.611 -1.799) 10.470 11.478 ( -2.255 -0.109 -0.221) 2.268 11.588 ( 21.477 3.659 9.509) 23.771 12.623 ( -5.591 -5.973 -6.041) 10.170 12.952 ( 4.443 2.838 0.517) 5.298 13.085 ( -7.779 0.041 1.882) 8.004 18.542 ( 4.011 1.296 -0.600) 4.258 18.768 ( -3.968 -1.056 0.968) 4.219 19.106 ( -1.799 1.499 -1.121) 2.597 19.307 ( -2.927 -0.380 0.131) 2.955 20.749 ( 3.920 0.732 0.300) 3.999 20.811 ( -2.936 -0.975 0.038) 3.094 27.735 ( 2.650 -0.032 -0.484) 2.694 27.789 ( -1.498 0.052 0.396) 1.550 37.486 ( 5.831 2.899 2.225) 6.882 37.800 ( -0.641 -1.323 -4.823) 5.042 38.860 ( 1.341 -0.206 4.680) 4.873 39.984 ( -10.939 2.898 -3.748) 11.921 ======================= Grid point 309 (184/371) ======================= q-point: (-0.54 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.001 ( -0.974 -3.619 -0.476) 3.778 4.507 ( -1.842 -2.729 -1.519) 3.626 4.662 ( 0.570 2.671 -0.477) 2.773 5.953 ( 7.751 -5.003 -0.063) 9.225 6.422 ( -3.756 -0.358 -1.908) 4.228 7.467 ( -3.995 4.349 4.222) 7.260 7.918 ( -22.602 2.790 1.832) 22.848 8.188 ( 6.416 7.484 4.337) 10.770 8.703 ( -6.746 -8.757 -1.201) 11.119 9.298 ( 9.570 -0.828 -6.578) 11.643 9.484 ( 20.983 2.686 4.236) 21.575 9.748 ( -3.161 -0.359 -2.282) 3.915 11.025 ( -11.728 -6.471 -0.578) 13.407 11.584 ( 9.078 3.764 -4.906) 10.983 11.921 ( 9.146 -1.124 -2.252) 9.486 12.478 ( 2.359 -6.173 0.778) 6.654 12.949 ( -8.616 -0.002 3.200) 9.191 13.060 ( 3.680 2.064 -0.545) 4.255 18.554 ( -1.617 -1.866 0.128) 2.473 18.784 ( 5.260 2.249 -1.168) 5.838 19.114 ( -1.462 4.289 1.529) 4.782 19.257 ( -2.303 -0.437 0.382) 2.375 20.751 ( -2.437 -1.900 -0.466) 3.126 20.820 ( 2.997 1.871 -0.120) 3.535 27.751 ( -0.911 -1.140 0.090) 1.462 27.774 ( 0.601 0.032 -0.051) 0.604 37.501 ( -3.271 -4.383 -1.022) 5.564 37.831 ( 2.870 4.953 1.647) 5.956 38.752 ( -10.391 -7.549 -0.206) 12.846 39.956 ( 0.605 8.023 3.088) 8.618 ======================= Grid point 310 (185/371) ======================= q-point: (-0.46 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.878 ( -5.547 -6.592 -5.549) 10.248 4.309 ( -10.595 -8.726 -5.167) 14.666 4.713 ( 2.672 -1.442 3.701) 4.787 6.116 ( 15.315 -2.388 0.072) 15.500 6.375 ( -2.996 1.992 0.989) 3.731 7.352 ( -17.258 -0.016 9.322) 19.614 7.729 ( -5.202 8.629 -5.295) 11.382 8.407 ( 7.968 1.831 12.709) 15.112 8.446 ( -11.243 -10.443 -3.905) 15.834 9.375 ( 6.259 -3.691 -5.615) 9.183 9.600 ( -5.107 -1.625 2.976) 6.130 9.898 ( 15.159 0.073 -4.545) 15.826 10.861 ( -6.715 7.636 -3.358) 10.708 11.724 ( 4.622 -2.210 -3.724) 6.334 11.881 ( 6.839 -1.500 -14.521) 16.121 12.610 ( 9.381 -3.249 7.214) 12.272 12.814 ( -7.636 -1.387 1.985) 8.010 13.135 ( 2.957 2.334 1.284) 3.980 18.527 ( -0.102 0.800 0.176) 0.825 18.879 ( 1.090 4.654 -3.031) 5.660 19.141 ( -0.671 2.767 5.579) 6.264 19.257 ( 2.600 0.584 -0.398) 2.694 20.692 ( -2.034 -1.768 -1.366) 3.022 20.882 ( 2.299 2.411 -0.510) 3.370 27.719 ( -1.328 -1.002 0.010) 1.663 27.775 ( -0.223 -1.208 0.212) 1.247 37.351 ( -8.320 -3.935 -1.598) 9.342 37.933 ( 2.240 1.590 5.590) 6.228 38.451 ( -12.758 -11.069 -3.228) 17.196 40.127 ( 5.550 8.436 8.864) 13.436 ======================= Grid point 311 (186/371) ======================= q-point: (-0.38 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.650 ( -5.655 -13.798 -10.507) 18.242 4.022 ( -7.325 -13.175 -5.419) 16.019 4.761 ( 2.633 -3.157 7.899) 8.904 6.358 ( 6.896 -7.369 10.309) 14.427 6.363 ( 6.135 7.846 -6.847) 12.086 7.106 ( -17.042 -0.320 10.313) 19.922 7.715 ( -3.934 4.340 -12.708) 13.993 8.129 ( -8.787 -11.600 -0.803) 14.575 8.611 ( 6.599 0.351 13.196) 14.759 9.366 ( -4.461 4.443 -2.258) 6.689 9.543 ( 3.179 -9.536 0.433) 10.062 9.911 ( -1.812 -10.545 -9.048) 14.013 10.880 ( -3.417 14.890 -6.130) 16.461 11.669 ( -1.425 -0.958 -2.417) 2.965 12.133 ( 21.314 8.844 -11.094) 25.605 12.594 ( -5.439 -8.478 3.729) 10.741 12.801 ( 5.845 -2.162 0.521) 6.253 13.227 ( 3.235 4.274 3.135) 6.210 18.578 ( 2.784 4.764 -0.042) 5.518 18.849 ( -8.384 6.847 -2.119) 11.029 19.222 ( 4.513 -1.012 6.930) 8.332 19.332 ( 4.388 2.956 -0.952) 5.376 20.641 ( -1.219 -1.057 -2.812) 3.242 20.934 ( 1.520 2.966 -0.941) 3.463 27.695 ( -0.578 -0.780 0.121) 0.978 27.745 ( -1.461 -2.283 0.270) 2.724 37.161 ( -10.106 -3.032 -0.075) 10.551 37.972 ( -0.496 -3.817 7.793) 8.692 38.140 ( -8.133 -13.095 -4.888) 16.172 40.355 ( 5.880 7.044 13.216) 16.089 ======================= Grid point 312 (187/371) ======================= q-point: (-0.31 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.330 ( -5.119 -21.586 -13.994) 26.229 3.778 ( -0.539 -19.740 -5.722) 20.559 4.810 ( 1.477 -5.919 9.693) 11.453 6.351 ( -0.255 -1.250 3.406) 3.637 6.579 ( 10.265 0.805 0.489) 10.308 6.933 ( -8.894 -2.285 11.126) 14.426 7.446 ( -9.743 -14.287 -13.534) 21.959 8.054 ( -1.421 8.548 -1.877) 8.867 8.747 ( 3.135 -3.432 11.286) 12.206 9.317 ( -7.639 7.466 -0.864) 10.716 9.496 ( 6.326 -15.868 -3.147) 17.370 9.667 ( -6.779 -9.586 -8.966) 14.773 10.965 ( 1.129 14.457 -4.034) 15.052 11.614 ( -7.689 4.823 -1.173) 9.152 12.351 ( 2.833 -7.122 -8.997) 11.819 12.511 ( 2.068 -3.713 6.121) 7.452 12.979 ( 16.719 9.076 -6.181) 20.002 13.337 ( 1.923 5.800 3.226) 6.910 18.648 ( -2.791 4.853 -3.079) 6.389 18.802 ( -2.671 10.443 1.745) 10.920 19.315 ( 4.215 -2.395 7.312) 8.773 19.420 ( 2.106 3.948 -0.472) 4.499 20.605 ( -0.142 0.168 -4.965) 4.970 20.976 ( 0.778 3.341 -1.415) 3.710 27.673 ( -2.274 -1.586 1.178) 3.012 27.709 ( 0.821 -1.999 -0.655) 2.258 36.979 ( -8.582 -3.355 1.792) 9.387 37.894 ( -4.714 -13.824 5.507) 15.609 37.944 ( 1.420 -9.290 -2.417) 9.704 40.571 ( 3.520 5.368 17.091) 18.257 ======================= Grid point 313 (188/371) ======================= q-point: (-0.23 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.951 ( -3.701 -26.855 -15.221) 31.090 3.554 ( 4.155 -27.855 -8.352) 29.375 4.736 ( -3.284 -16.629 6.909) 18.304 6.404 ( 6.877 -1.004 2.928) 7.541 6.695 ( 3.583 2.010 -0.454) 4.134 6.815 ( -6.914 -15.310 6.883) 18.155 7.244 ( 6.263 -1.662 -3.044) 7.159 8.101 ( -3.607 10.290 -5.044) 12.014 8.717 ( -8.315 -4.287 5.594) 10.900 9.253 ( 3.075 -5.516 -6.032) 8.733 9.452 ( 4.029 -8.974 -2.031) 10.044 9.504 ( -4.275 -0.193 0.880) 4.369 11.124 ( 2.606 7.827 1.148) 8.329 11.533 ( -6.916 13.733 -3.363) 15.739 12.229 ( -0.810 -11.263 -1.791) 11.433 12.493 ( 2.285 -9.491 -0.269) 9.766 13.267 ( 0.289 15.832 -7.187) 17.390 13.455 ( 5.290 8.002 0.660) 9.616 18.589 ( -5.245 5.953 -2.820) 8.420 18.945 ( 4.009 10.207 1.055) 11.017 19.385 ( 0.919 -1.577 10.344) 10.504 19.455 ( -1.715 3.831 -1.126) 4.346 20.586 ( 0.730 1.365 -7.610) 7.766 21.007 ( 0.056 3.399 -1.815) 3.854 27.618 ( -2.069 -2.595 1.332) 3.576 27.718 ( 2.016 -1.203 -0.706) 2.451 36.858 ( -2.707 -4.343 2.822) 5.844 37.723 ( -3.975 -14.414 5.242) 15.845 37.897 ( 7.676 -12.229 -2.453) 14.646 40.734 ( -0.998 3.791 20.594) 20.964 ======================= Grid point 314 (189/371) ======================= q-point: (-0.15 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.578 ( 1.658 -29.926 -15.286) 33.644 3.286 ( 4.710 -34.843 -8.471) 36.166 4.546 ( 4.343 -24.787 3.529) 25.411 6.483 ( -3.288 -6.129 -5.716) 9.002 6.588 ( -0.525 -7.558 7.166) 10.429 6.810 ( 12.542 -2.460 0.178) 12.782 7.511 ( 18.779 6.341 5.441) 20.554 8.029 ( -8.971 2.957 -9.485) 13.386 8.519 ( -12.628 -1.711 3.046) 13.102 9.285 ( 9.887 -8.120 -0.239) 12.796 9.394 ( 0.038 -4.701 -3.066) 5.613 9.527 ( -0.516 5.395 3.548) 6.478 11.090 ( -7.236 -1.627 1.042) 7.490 11.753 ( 7.920 26.032 0.663) 27.219 12.112 ( -0.030 -10.004 0.796) 10.036 12.437 ( 4.805 -12.668 -3.219) 13.925 13.199 ( -19.463 13.286 -6.401) 24.419 13.571 ( -1.328 6.870 -2.113) 7.309 18.607 ( 0.340 8.577 -1.205) 8.668 19.065 ( 0.860 3.245 -0.916) 3.480 19.403 ( -5.854 3.853 8.811) 11.258 19.467 ( 0.354 3.244 2.404) 4.053 20.571 ( 1.013 1.779 -9.962) 10.170 21.023 ( -0.660 3.119 -1.961) 3.743 27.581 ( -0.341 -2.488 1.464) 2.907 27.734 ( 1.593 -1.332 -0.747) 2.207 36.854 ( 5.569 -4.061 2.237) 7.246 37.536 ( -5.443 -15.030 6.162) 17.132 37.954 ( 15.529 -12.627 -4.943) 20.616 40.822 ( -5.717 3.160 23.252) 24.152 ======================= Grid point 315 (190/371) ======================= q-point: (-0.08 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.353 ( 14.999 -28.071 -11.356) 33.793 3.031 ( 11.266 -35.971 -3.140) 37.824 4.511 ( 17.667 -23.254 0.848) 29.216 6.293 ( -1.735 -11.746 0.865) 11.905 6.604 ( -2.289 3.339 1.413) 4.288 7.013 ( 16.536 -6.298 -5.183) 18.439 7.763 ( -9.303 -7.236 -8.220) 14.369 7.978 ( 20.193 10.366 -1.136) 22.726 8.352 ( -10.043 1.370 8.212) 13.045 9.330 ( -5.326 0.472 -1.013) 5.442 9.382 ( 9.308 -6.784 0.799) 11.545 9.583 ( 0.967 3.514 -0.549) 3.686 11.004 ( -2.879 3.467 1.193) 4.662 11.934 ( -6.804 3.136 2.870) 8.023 12.243 ( 12.326 2.133 2.668) 12.791 12.369 ( 2.102 -3.897 -2.837) 5.259 12.878 ( -24.038 10.720 -5.658) 26.921 13.553 ( -5.129 4.101 -0.029) 6.567 18.700 ( -1.469 7.994 1.027) 8.193 19.015 ( -4.118 -2.263 0.032) 4.699 19.389 ( -4.494 4.697 1.773) 6.738 19.554 ( 0.821 7.089 6.150) 9.421 20.547 ( 1.133 0.817 -10.789) 10.879 21.024 ( -1.328 2.597 -1.761) 3.407 27.578 ( 1.540 -1.948 1.603) 2.956 27.732 ( 0.303 -1.744 -0.803) 1.943 36.971 ( 10.564 -2.201 -0.642) 10.810 37.352 ( -2.791 -14.182 6.327) 15.778 38.073 ( 16.634 -13.271 -7.814) 22.669 40.869 ( -7.399 5.103 23.429) 25.094 ======================= Grid point 318 (191/371) ======================= q-point: ( 0.15 -0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.408 ( 30.237 -13.493 5.839) 33.622 3.176 ( 36.300 -10.799 5.563) 38.279 4.587 ( 25.925 -10.855 -1.490) 28.145 6.403 ( 7.090 -3.468 4.714) 9.193 6.657 ( -1.941 -1.409 1.662) 2.918 6.823 ( 12.944 1.820 -5.586) 14.215 7.597 ( 0.225 17.983 -3.702) 18.361 7.917 ( 2.353 -10.381 2.861) 11.022 8.616 ( -12.905 -9.089 -9.116) 18.228 9.222 ( 15.435 5.657 8.032) 18.296 9.398 ( 1.383 -0.827 -3.879) 4.200 9.584 ( -3.329 0.886 -3.622) 4.999 11.120 ( -3.670 -9.028 -2.604) 10.087 11.787 ( -19.259 25.084 -3.298) 31.796 12.097 ( 6.880 -1.779 3.161) 7.778 12.392 ( 12.938 -4.766 1.948) 13.925 13.060 ( -20.090 -9.459 10.860) 24.719 13.535 ( -6.053 2.737 2.575) 7.124 18.593 ( -6.381 6.013 0.579) 8.787 19.056 ( -3.353 1.928 0.303) 3.879 19.412 ( -4.577 -0.208 2.278) 5.117 19.601 ( -6.764 -0.789 -8.095) 10.579 20.461 ( 3.702 -0.692 3.043) 4.842 21.004 ( -2.513 0.726 0.444) 2.653 27.603 ( 2.127 -1.405 -1.339) 2.879 27.718 ( 1.635 0.811 1.334) 2.261 36.898 ( 5.702 1.046 -3.356) 6.698 37.619 ( 11.869 -9.156 -3.878) 15.484 37.891 ( 17.064 1.644 2.509) 17.326 41.051 ( -11.973 1.185 -5.009) 13.033 ======================= Grid point 319 (192/371) ======================= q-point: ( 0.23 -0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.847 ( 30.198 -5.052 5.989) 31.198 3.633 ( 28.771 -9.345 2.458) 30.351 4.752 ( 3.579 -0.021 -2.217) 4.210 6.433 ( -5.430 2.015 2.316) 6.238 6.620 ( 4.859 -10.619 -4.261) 12.430 7.183 ( 21.515 9.583 4.726) 24.023 7.705 ( -4.597 9.013 5.832) 11.678 7.964 ( 7.482 6.672 -11.336) 15.133 8.359 ( -1.052 -12.604 1.015) 12.689 9.364 ( -0.528 -4.174 -3.649) 5.569 9.509 ( 7.583 5.742 5.933) 11.211 9.553 ( 2.916 0.005 -4.089) 5.023 10.998 ( -1.090 -6.447 0.420) 6.552 11.612 ( -21.260 17.312 -2.876) 27.567 12.181 ( -4.007 -3.433 4.153) 6.715 12.559 ( 8.586 -8.125 2.798) 12.148 12.728 ( -5.482 -5.646 3.508) 8.616 13.456 ( -6.832 0.124 1.708) 7.044 18.542 ( -6.183 5.119 -0.566) 8.047 19.022 ( -3.345 0.471 1.352) 3.639 19.317 ( -5.080 -2.635 -2.360) 6.190 19.462 ( -5.301 0.202 -3.492) 6.351 20.538 ( 3.690 0.268 3.689) 5.225 20.967 ( -3.050 0.328 0.671) 3.140 27.618 ( 1.780 -0.163 -1.453) 2.304 27.763 ( 2.232 0.119 1.140) 2.509 37.035 ( 8.085 5.677 -0.905) 9.921 37.659 ( 9.843 -10.810 -7.310) 16.346 38.255 ( 16.645 7.731 7.640) 19.879 40.788 ( -14.486 -2.173 -9.921) 17.691 ======================= Grid point 320 (193/371) ======================= q-point: ( 0.31 -0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.331 ( 26.952 0.834 5.889) 27.601 3.961 ( 19.886 -6.876 1.850) 21.122 4.774 ( -2.757 8.743 -1.097) 9.233 6.288 ( -12.600 -1.364 -0.916) 12.707 6.569 ( 3.056 -8.384 -4.936) 10.198 7.562 ( 2.305 7.860 11.386) 14.026 7.781 ( 9.820 1.573 0.400) 9.953 8.069 ( 4.036 12.744 -10.371) 16.919 8.391 ( 12.885 -7.938 1.503) 15.209 9.266 ( -2.580 -5.539 -5.272) 8.070 9.584 ( -6.180 0.345 2.145) 6.551 9.641 ( 7.656 1.022 -1.590) 7.885 11.015 ( 7.924 -1.554 7.069) 10.732 11.446 ( -14.295 11.758 0.374) 18.514 11.901 ( -16.528 -13.407 5.701) 22.032 12.605 ( 7.273 -3.633 -4.213) 9.157 12.800 ( 4.964 1.544 1.280) 5.354 13.334 ( -7.239 -2.305 0.500) 7.613 18.501 ( -2.960 3.579 -0.563) 4.678 18.941 ( -4.740 -5.413 0.645) 7.224 19.206 ( -4.413 0.662 -3.471) 5.653 19.399 ( -3.367 2.251 -0.113) 4.052 20.620 ( 3.687 0.804 2.714) 4.648 20.918 ( -3.451 -0.118 0.505) 3.490 27.647 ( 2.375 0.383 -1.093) 2.642 27.795 ( 1.254 -0.615 0.612) 1.524 37.236 ( 8.538 6.525 2.151) 10.959 37.674 ( 7.890 -7.946 -8.263) 13.916 38.617 ( 12.708 7.386 9.734) 17.630 40.460 ( -15.441 -2.525 -11.612) 19.484 ======================= Grid point 321 (194/371) ======================= q-point: ( 0.38 -0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.752 ( 17.847 1.522 5.623) 18.774 4.195 ( 14.051 -2.455 2.182) 14.430 4.823 ( -4.263 12.917 -1.067) 13.644 6.033 ( -10.316 -7.113 -4.522) 13.321 6.519 ( -1.114 -2.394 -0.712) 2.735 7.603 ( -6.172 6.810 5.368) 10.644 7.916 ( 10.038 -8.944 0.513) 13.454 8.273 ( 4.801 8.361 0.972) 9.690 8.594 ( 17.061 4.727 -7.030) 19.048 9.138 ( -2.549 -5.538 -5.282) 8.066 9.359 ( -16.868 -3.646 2.165) 17.393 9.746 ( 5.756 -2.056 -2.084) 6.458 11.295 ( 7.334 4.016 4.788) 9.636 11.379 ( 3.381 1.890 10.204) 10.914 11.602 ( -10.417 -1.710 1.138) 10.617 12.587 ( -1.971 -6.087 -8.262) 10.450 12.892 ( 5.233 1.263 0.586) 5.415 13.199 ( -6.352 -2.936 0.792) 7.042 18.516 ( 1.150 2.756 0.017) 2.986 18.793 ( -4.143 -8.515 -0.693) 9.495 19.165 ( -2.530 5.116 -1.571) 5.920 19.369 ( -3.504 2.131 0.721) 4.164 20.699 ( 3.595 1.002 1.477) 4.014 20.859 ( -3.557 -0.353 0.071) 3.575 27.688 ( 2.721 0.222 -0.520) 2.780 27.798 ( -0.077 -1.228 0.107) 1.235 37.422 ( 6.243 1.143 4.118) 7.565 37.694 ( 6.379 -1.928 -7.831) 10.282 38.869 ( 4.663 2.984 9.506) 11.001 40.160 ( -12.072 1.071 -9.561) 15.436 ======================= Grid point 322 (195/371) ======================= q-point: ( 0.46 -0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.941 ( 3.623 -3.803 2.724) 5.917 4.393 ( 9.537 -1.796 1.384) 9.802 4.819 ( -9.608 11.305 -3.544) 15.254 5.843 ( -0.746 -5.644 -3.353) 6.608 6.481 ( -2.945 0.547 2.177) 3.703 7.590 ( -4.799 6.210 0.844) 7.894 7.967 ( 9.240 -18.661 4.428) 21.289 8.334 ( -7.525 13.522 2.639) 15.698 8.763 ( -4.160 -1.770 -5.523) 7.138 9.146 ( 1.264 -9.438 -0.785) 9.554 9.184 ( 15.350 7.895 -1.118) 17.298 9.760 ( 0.620 -2.788 -2.763) 3.974 11.152 ( -10.778 -1.972 -0.908) 10.994 11.561 ( -0.428 7.168 0.713) 7.217 11.748 ( 13.359 2.985 4.814) 14.510 12.400 ( -2.612 -8.440 -4.898) 10.101 12.998 ( 5.494 0.704 0.830) 5.601 13.077 ( -6.550 -2.411 1.098) 7.065 18.548 ( -0.469 -1.497 0.018) 1.569 18.708 ( 3.678 -2.856 -0.939) 4.751 19.191 ( -1.269 7.246 -0.349) 7.364 19.326 ( -4.332 1.239 1.485) 4.744 20.752 ( 0.608 -1.091 -0.082) 1.251 20.816 ( -0.655 1.851 -0.075) 1.965 27.726 ( 2.002 -0.642 0.122) 2.106 27.776 ( -0.761 -1.407 -0.263) 1.621 37.462 ( 0.955 -6.254 -0.012) 6.327 37.790 ( 6.473 3.465 -1.429) 7.480 38.870 ( -8.569 -4.264 4.236) 10.467 40.048 ( -2.271 7.067 -1.305) 7.536 ======================= Grid point 323 (196/371) ======================= q-point: (-0.46 -0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.839 ( -5.622 -11.927 -4.442) 13.914 4.380 ( -6.859 -8.762 -2.178) 11.338 4.736 ( -6.133 6.790 -2.311) 9.438 5.906 ( 10.770 0.917 1.607) 10.928 6.455 ( -3.233 1.294 3.661) 5.053 7.559 ( -4.931 0.514 2.054) 5.367 7.892 ( -4.290 -4.044 -1.300) 6.037 8.365 ( -5.472 -1.908 13.510) 14.701 8.557 ( -7.137 -0.587 -7.584) 10.430 9.140 ( 8.263 -8.524 -1.772) 12.004 9.602 ( 20.194 6.110 -0.601) 21.106 9.706 ( -2.287 -0.575 -3.240) 4.007 11.013 ( -6.308 7.266 -4.262) 10.524 11.649 ( 2.153 3.047 -0.822) 3.821 11.738 ( -1.830 -4.335 -13.113) 13.932 12.468 ( 10.381 -1.658 9.201) 13.971 12.927 ( -7.942 -3.797 0.039) 8.803 13.101 ( 4.482 1.264 2.479) 5.275 18.511 ( 0.730 -2.184 -0.855) 2.456 18.816 ( 7.715 2.209 -0.294) 8.031 19.244 ( -0.098 5.828 -0.347) 5.839 19.276 ( -5.047 2.633 3.222) 6.541 20.704 ( -2.423 -1.786 -1.672) 3.443 20.867 ( 2.366 3.023 -0.300) 3.851 27.724 ( -0.772 -1.694 -0.131) 1.866 27.762 ( 0.489 -1.341 0.342) 1.468 37.375 ( -2.679 -6.812 -2.199) 7.643 37.907 ( 4.435 0.402 2.574) 5.143 38.601 ( -16.577 -8.124 -0.229) 18.462 40.169 ( 4.349 8.672 7.300) 12.141 ======================= Grid point 324 (197/371) ======================= q-point: (-0.38 -0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.526 ( -8.054 -20.512 -11.288) 24.759 4.057 ( -14.341 -13.719 -5.453) 20.582 4.722 ( -0.320 -0.911 3.178) 3.321 6.159 ( 13.449 2.931 6.162) 15.081 6.438 ( -2.708 1.943 3.286) 4.680 7.433 ( -13.485 -0.086 7.349) 15.357 7.758 ( -7.607 -4.198 -11.990) 14.807 8.148 ( -9.296 -8.763 5.329) 13.842 8.598 ( 5.221 3.815 1.035) 6.549 9.199 ( 8.848 -9.465 1.471) 13.040 9.624 ( -5.967 1.541 -0.423) 6.177 9.811 ( 2.414 -2.693 -6.409) 7.359 11.019 ( -3.098 10.611 -7.715) 13.480 11.643 ( 7.442 3.605 -2.138) 8.542 11.837 ( 12.881 7.507 -9.004) 17.417 12.593 ( 1.554 -6.584 6.617) 9.463 12.753 ( -6.211 -5.703 -0.692) 8.460 13.216 ( 5.032 3.438 4.349) 7.487 18.549 ( 4.637 1.963 -1.088) 5.152 18.941 ( 3.141 3.891 -0.997) 5.099 19.240 ( -1.930 0.142 4.864) 5.235 19.317 ( 0.787 7.477 0.522) 7.536 20.641 ( -1.973 -1.025 -3.372) 4.039 20.929 ( 2.044 3.214 -0.889) 3.911 27.694 ( -0.644 -1.323 -0.484) 1.549 27.747 ( -0.855 -2.415 1.000) 2.751 37.239 ( -5.047 -5.971 -1.965) 8.061 37.950 ( 1.099 -4.311 2.237) 4.979 38.231 ( -16.919 -10.566 0.731) 19.961 40.388 ( 6.263 7.327 12.872) 16.081 ======================= Grid point 325 (198/371) ======================= q-point: (-0.31 -0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.111 ( -6.410 -26.706 -15.537) 31.555 3.643 ( -11.503 -22.415 -6.493) 26.017 4.718 ( 1.729 -9.866 6.124) 11.741 6.354 ( 1.533 -6.145 12.128) 13.682 6.498 ( 6.720 10.441 -2.344) 12.636 7.186 ( -19.196 -5.514 3.920) 20.354 7.413 ( -10.402 -13.505 -6.602) 18.280 8.112 ( 1.347 5.890 -1.638) 6.261 8.726 ( 5.483 2.900 1.431) 6.365 9.244 ( 6.412 -12.960 4.720) 15.211 9.495 ( -11.084 1.084 -5.622) 12.475 9.676 ( -5.381 -3.047 -6.002) 8.618 11.023 ( 0.305 6.484 -5.611) 8.581 11.795 ( -2.700 12.146 3.950) 13.054 12.191 ( 13.531 9.499 -13.064) 21.071 12.495 ( -0.683 -5.885 6.731) 8.967 12.691 ( 10.622 -7.408 -2.849) 13.260 13.360 ( 4.176 5.444 4.082) 7.984 18.667 ( 5.131 5.568 -1.694) 7.759 18.961 ( -4.476 5.726 -1.316) 7.386 19.274 ( 2.317 -0.254 6.823) 7.210 19.422 ( 3.018 6.377 1.361) 7.185 20.588 ( -1.038 0.216 -5.941) 6.035 20.982 ( 1.420 3.255 -1.432) 3.829 27.676 ( 0.301 -1.442 -0.949) 1.752 27.701 ( -2.234 -2.611 1.647) 3.811 37.085 ( -6.830 -4.798 -0.348) 8.354 37.826 ( -7.800 -10.065 -8.519) 15.320 37.949 ( -6.072 -12.165 12.128) 18.219 40.628 ( 6.004 5.335 17.263) 19.040 ======================= Grid point 326 (199/371) ======================= q-point: (-0.23 -0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.671 ( -4.384 -30.209 -16.902) 34.892 3.210 ( -4.598 -32.148 -9.365) 33.798 4.574 ( -3.150 -28.766 4.311) 29.257 6.321 ( -0.014 -7.691 6.912) 10.340 6.698 ( 4.948 8.570 -5.479) 11.312 6.836 ( -9.227 -13.679 2.842) 16.743 7.223 ( -5.735 1.617 4.820) 7.665 8.180 ( 0.877 5.219 -5.903) 7.928 8.837 ( 2.374 3.938 2.872) 5.422 9.110 ( -7.005 -16.167 -0.863) 17.640 9.350 ( -0.203 -0.398 -4.906) 4.926 9.604 ( -3.092 3.900 0.368) 4.991 11.112 ( 5.402 4.518 -1.003) 7.113 11.813 ( -11.367 11.959 2.538) 16.694 12.130 ( -0.973 -5.616 -6.677) 8.778 12.441 ( -4.971 -7.643 3.547) 9.783 13.116 ( 28.404 13.228 -8.288) 32.411 13.483 ( 2.074 6.137 2.712) 7.023 18.727 ( -4.759 7.025 -3.250) 9.086 18.977 ( 2.140 5.484 0.207) 5.890 19.369 ( 4.231 1.162 6.632) 7.952 19.524 ( 0.362 5.458 3.947) 6.745 20.549 ( 0.011 1.623 -9.476) 9.614 21.021 ( 0.737 3.060 -1.838) 3.644 27.629 ( -1.899 -4.179 0.716) 4.646 27.687 ( 0.583 0.191 0.021) 0.614 36.928 ( -7.538 -3.962 2.040) 8.756 37.584 ( -1.261 -14.078 -5.721) 15.248 37.804 ( -4.727 -13.855 9.145) 17.261 40.849 ( 3.689 3.300 21.345) 21.912 ======================= Grid point 327 (200/371) ======================= q-point: (-0.15 -0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.226 ( -3.538 -32.442 -15.937) 36.318 2.809 ( 3.315 -38.876 -13.103) 41.159 4.144 ( -0.918 -50.118 1.298) 50.143 6.346 ( 7.673 -6.124 -2.022) 10.024 6.599 ( -7.838 -9.082 9.277) 15.165 6.787 ( -1.006 8.587 -6.916) 11.072 7.337 ( 10.625 4.199 8.559) 14.275 8.125 ( -6.084 0.029 -10.491) 12.128 8.783 ( -15.355 -3.429 10.688) 19.020 8.978 ( 11.180 -8.221 -6.192) 15.196 9.373 ( 2.209 4.081 -1.011) 4.749 9.623 ( -1.728 5.811 1.768) 6.315 11.190 ( -2.399 -0.105 3.606) 4.332 11.783 ( 3.209 4.598 -1.658) 5.847 12.125 ( 1.032 7.144 -0.257) 7.223 12.278 ( -4.902 -11.323 0.709) 12.358 13.466 ( -0.037 13.727 -7.944) 15.860 13.603 ( 4.905 8.139 -2.148) 9.742 18.691 ( -3.485 7.723 -2.627) 8.871 19.071 ( 2.372 2.075 0.376) 3.174 19.482 ( 2.840 3.958 1.161) 5.008 19.577 ( -3.417 4.998 11.393) 12.901 20.517 ( 0.678 2.547 -13.382) 13.639 21.044 ( 0.048 2.634 -1.938) 3.270 27.569 ( -0.974 -4.028 1.034) 4.271 27.703 ( 1.021 0.356 -0.393) 1.150 36.811 ( -3.104 -3.813 3.541) 6.059 37.458 ( 2.462 -15.014 -0.792) 15.235 37.653 ( 1.122 -14.728 3.171) 15.107 41.020 ( -0.499 1.991 24.804) 24.889 ======================= Grid point 328 (201/371) ======================= q-point: (-0.08 -0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.831 ( 5.380 -33.051 -13.031) 35.932 2.466 ( 9.663 -42.279 -7.611) 44.032 3.801 ( 21.782 -53.404 -1.480) 57.694 6.264 ( -5.175 -6.253 -5.653) 9.891 6.592 ( 3.978 -3.644 12.668) 13.769 6.837 ( 3.607 6.552 -8.615) 11.409 7.634 ( 14.162 -0.730 5.178) 15.096 7.916 ( -6.729 -0.419 -14.261) 15.774 8.581 ( -11.027 -4.749 14.203) 18.598 9.087 ( 12.626 -5.826 -5.557) 14.975 9.452 ( -2.289 8.870 1.348) 9.260 9.653 ( -2.053 4.939 1.235) 5.489 11.113 ( -5.871 2.417 2.785) 6.934 11.935 ( 11.114 -7.211 0.509) 13.258 12.082 ( -3.644 -12.148 -1.270) 12.746 12.327 ( 7.166 18.194 4.958) 20.173 13.375 ( -20.811 13.852 -8.075) 26.271 13.654 ( -3.111 4.835 -2.565) 6.296 18.768 ( 3.171 9.128 -0.633) 9.683 19.053 ( -4.056 -3.235 0.729) 5.239 19.504 ( -3.382 4.349 -1.449) 5.696 19.672 ( -1.009 7.003 13.092) 14.882 20.476 ( 0.825 1.728 -15.487) 15.605 21.053 ( -0.623 2.080 -1.626) 2.712 27.538 ( 0.977 -3.513 1.057) 3.797 27.715 ( 0.281 0.217 -0.580) 0.680 36.818 ( 5.507 -2.022 2.418) 6.345 37.303 ( -4.173 -15.208 4.728) 16.463 37.654 ( 14.099 -13.737 -4.919) 20.290 41.130 ( -4.381 3.263 24.808) 25.403 ======================= Grid point 370 (202/371) ======================= q-point: ( 0.15 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 371 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.186 ( -0.000 0.000 37.200) 37.200 1.186 ( -0.000 0.000 37.200) 37.200 1.959 ( -0.000 0.000 60.892) 60.892 6.194 ( -0.000 -0.000 -0.516) 0.516 6.194 ( 0.000 0.000 -0.516) 0.516 7.334 ( 0.000 -0.000 -7.175) 7.175 7.334 ( 0.000 -0.000 -7.175) 7.175 8.558 ( 0.000 -0.000 -1.825) 1.825 8.725 ( -0.000 0.000 4.584) 4.584 8.725 ( 0.000 0.000 4.584) 4.584 9.656 ( 0.000 -0.000 -8.706) 8.706 10.591 ( 0.000 -0.000 -3.789) 3.789 11.362 ( -0.000 -0.000 -0.900) 0.900 11.362 ( 0.000 0.000 -0.900) 0.900 11.611 ( -0.000 0.000 1.288) 1.288 11.611 ( 0.000 0.000 1.288) 1.288 13.671 ( 0.000 -0.000 -2.968) 2.968 13.817 ( -0.000 0.000 1.276) 1.276 19.006 ( -0.000 0.000 2.318) 2.318 19.006 ( -0.000 0.000 2.318) 2.318 19.613 ( 0.000 -0.000 -2.097) 2.097 19.613 ( 0.000 -0.000 -2.097) 2.097 21.212 ( -0.000 0.000 7.466) 7.466 22.722 ( 0.000 -0.000 -5.139) 5.139 27.431 ( -0.000 0.000 1.192) 1.192 27.765 ( 0.000 -0.000 -1.409) 1.409 36.843 ( -0.000 -0.000 -2.599) 2.599 36.843 ( 0.000 -0.000 -2.599) 2.599 37.021 ( -0.000 0.000 2.638) 2.638 37.021 ( 0.000 0.000 2.638) 2.638 ======================= Grid point 371 (203/371) ======================= q-point: ( 0.23 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.388 ( 13.882 7.916 28.789) 32.927 1.675 ( 11.699 7.107 36.772) 39.237 2.710 ( 36.842 21.139 43.109) 60.519 6.076 ( -0.928 -5.290 -3.043) 6.172 6.367 ( 8.025 7.873 -0.582) 11.258 7.224 ( -5.929 4.542 -5.095) 9.041 7.482 ( 12.868 1.085 -6.679) 14.538 8.122 ( -16.029 -21.174 11.338) 28.876 8.615 ( -11.504 4.893 1.203) 12.559 9.053 ( 12.759 5.552 2.113) 14.074 9.582 ( -2.223 0.343 -8.127) 8.433 10.202 ( -17.848 -7.676 7.472) 20.816 11.354 ( -5.833 5.207 -7.446) 10.797 11.486 ( 5.214 -5.887 3.842) 8.752 11.664 ( 10.945 4.835 -1.849) 12.107 12.111 ( 27.363 16.759 -12.243) 34.343 13.563 ( -10.792 -6.438 -2.548) 12.822 13.757 ( -4.827 -4.344 0.387) 6.505 18.946 ( -5.302 -2.903 1.929) 6.345 19.057 ( 2.253 1.769 2.877) 4.060 19.535 ( -3.256 -3.513 -3.179) 5.748 19.613 ( -1.528 0.571 -2.888) 3.317 21.233 ( -1.844 -1.109 7.837) 8.127 22.048 ( -41.949 -24.087 18.586) 51.820 27.440 ( 0.798 0.564 1.002) 1.399 27.733 ( -1.344 -1.100 -1.070) 2.039 36.871 ( -0.469 5.215 -3.592) 6.349 36.971 ( -2.276 10.688 3.362) 11.433 37.166 ( 25.167 -7.806 -0.189) 26.350 38.104 ( 73.453 47.239 -48.461) 99.877 ======================= Grid point 372 (204/371) ======================= q-point: ( 0.31 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.967 ( 25.900 16.062 17.505) 35.146 2.145 ( 15.715 9.997 30.799) 35.993 3.668 ( 33.264 17.926 19.086) 42.333 6.070 ( 4.979 -2.709 1.463) 5.853 6.620 ( 13.849 10.363 3.025) 17.560 7.095 ( -11.670 1.138 -1.304) 11.798 7.693 ( 15.159 2.278 -7.980) 17.282 7.897 ( -0.247 -14.148 9.092) 16.819 8.470 ( -10.851 5.490 -1.809) 12.295 9.197 ( 2.410 -2.295 -6.609) 7.400 9.593 ( 2.273 9.234 2.032) 9.725 9.981 ( -10.385 -2.539 8.962) 13.951 11.260 ( -8.464 9.144 -7.824) 14.713 11.522 ( 7.231 -11.433 4.627) 14.297 11.931 ( 13.074 8.950 -1.786) 15.944 12.489 ( 13.536 8.539 -9.813) 18.773 13.151 ( -23.750 -16.759 1.744) 29.120 13.618 ( -6.129 -5.612 -2.305) 8.624 18.811 ( -7.846 -4.150 1.547) 9.010 19.129 ( 1.192 3.008 2.151) 3.885 19.417 ( -3.519 -5.855 -3.289) 7.582 19.554 ( -3.096 0.571 -4.416) 5.424 21.203 ( -4.972 -2.963 7.265) 9.289 21.439 ( -23.268 -13.478 18.640) 32.718 27.481 ( 2.255 1.838 0.137) 2.912 27.700 ( -0.650 -1.160 -0.999) 1.663 36.895 ( 2.700 1.239 -3.288) 4.431 37.122 ( 2.477 14.699 4.598) 15.599 37.560 ( 27.617 -1.592 1.413) 27.699 39.121 ( 41.616 28.522 -55.046) 74.670 ======================= Grid point 373 (205/371) ======================= q-point: ( 0.38 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.633 ( 24.829 14.651 15.698) 32.826 2.702 ( 23.217 17.147 16.640) 33.316 4.278 ( 21.929 9.607 -0.366) 23.944 6.130 ( 1.762 -3.042 2.758) 4.468 6.850 ( -12.398 -3.344 8.670) 15.494 7.124 ( 24.374 14.063 4.575) 28.509 7.821 ( 1.184 -15.569 6.707) 16.994 7.919 ( 9.993 11.413 -9.887) 18.107 8.400 ( -1.034 4.644 -3.249) 5.761 9.073 ( -3.529 -8.521 -10.718) 14.140 9.746 ( -5.842 13.729 3.997) 15.447 9.902 ( -1.979 0.632 9.906) 10.121 11.188 ( -6.164 9.285 -4.074) 11.866 11.559 ( 7.739 -11.551 4.775) 14.701 12.165 ( 4.480 5.902 -3.368) 8.139 12.604 ( -19.362 -13.015 9.028) 25.015 12.686 ( 7.254 0.684 -6.768) 9.945 13.425 ( -7.813 -6.929 -4.755) 11.475 18.644 ( -8.284 -4.213 1.032) 9.351 19.133 ( -5.323 1.722 1.232) 5.728 19.286 ( -2.710 -6.457 -3.426) 7.796 19.519 ( 0.936 1.749 -4.264) 4.703 21.054 ( -11.340 -6.688 9.772) 16.396 21.204 ( -7.132 -4.414 7.829) 11.473 27.540 ( 2.306 2.592 -0.661) 3.532 27.684 ( 0.517 -1.048 -0.494) 1.268 36.952 ( 4.344 2.150 -3.864) 6.199 37.348 ( 4.838 13.798 6.178) 15.873 38.019 ( 28.026 -0.664 1.813) 28.092 39.549 ( 19.369 17.199 -42.804) 50.032 ======================= Grid point 374 (206/371) ======================= q-point: ( 0.46 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.197 ( 21.793 10.420 13.451) 27.649 3.349 ( 24.495 20.932 5.614) 32.706 4.648 ( 18.380 7.402 -8.227) 21.454 6.054 ( -6.294 -6.433 -0.253) 9.003 6.690 ( -7.026 -3.044 10.259) 12.802 7.512 ( 0.066 -5.899 4.713) 7.551 7.878 ( 17.085 7.060 4.720) 19.079 8.121 ( 5.542 14.812 -7.419) 17.468 8.479 ( 9.269 -1.134 -0.886) 9.380 8.845 ( -5.578 -12.621 -9.085) 16.521 9.654 ( -17.537 11.227 -0.056) 20.823 9.951 ( -3.094 0.641 6.080) 6.852 11.257 ( 4.434 9.291 7.608) 12.801 11.611 ( 8.108 -9.738 4.655) 13.500 12.012 ( -14.031 -6.783 2.766) 15.828 12.408 ( -3.237 -2.147 -2.060) 4.397 12.823 ( 6.169 3.213 -0.537) 6.976 13.207 ( -6.793 -6.973 -4.867) 10.884 18.491 ( -6.084 -3.238 0.467) 6.908 18.998 ( -10.031 -2.972 0.520) 10.475 19.213 ( 0.657 -1.177 -3.132) 3.410 19.548 ( 2.019 1.102 -3.024) 3.799 20.888 ( -7.305 -4.553 6.494) 10.783 21.099 ( -5.619 -3.386 3.749) 7.556 27.593 ( 1.740 2.594 -0.998) 3.279 27.692 ( 1.386 -0.696 0.111) 1.554 37.026 ( 4.351 2.783 -4.593) 6.911 37.585 ( 5.156 10.807 7.753) 14.265 38.435 ( 23.310 -2.299 -1.196) 23.454 39.729 ( 10.199 13.312 -28.639) 33.188 ======================= Grid point 375 (207/371) ======================= q-point: ( 0.54 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.649 ( 16.495 5.800 6.038) 18.498 3.900 ( 18.062 16.635 1.850) 24.625 4.944 ( 15.083 8.022 -12.078) 20.922 5.865 ( -7.866 -5.148 1.329) 9.494 6.670 ( -0.796 -1.076 11.597) 11.674 7.345 ( -7.167 -12.722 5.100) 15.467 8.113 ( 1.058 13.815 -19.330) 23.783 8.336 ( 4.051 0.005 6.146) 7.361 8.585 ( -4.498 0.009 -4.026) 6.036 8.668 ( 12.882 -7.074 1.173) 14.744 9.473 ( -11.959 8.652 -1.187) 14.808 9.878 ( -7.892 -3.396 10.323) 13.430 11.492 ( 2.530 3.324 5.568) 6.961 11.706 ( 10.470 -1.742 5.605) 12.003 11.851 ( -2.373 -1.225 8.552) 8.959 12.246 ( -8.491 -4.645 -7.427) 12.200 12.903 ( 1.557 1.384 -0.920) 2.277 13.066 ( -2.301 -3.672 -1.303) 4.524 18.406 ( -1.572 -1.229 0.049) 1.996 18.798 ( -9.996 -3.869 0.266) 10.722 19.244 ( 3.897 2.102 -2.131) 4.914 19.549 ( -0.647 -0.987 -2.198) 2.495 20.796 ( -3.452 -2.270 3.135) 5.187 20.995 ( -5.111 -2.896 1.668) 6.107 27.638 ( 1.635 1.949 -0.534) 2.600 27.709 ( 0.952 -0.262 0.254) 1.020 37.088 ( 2.918 2.653 -5.138) 6.477 37.784 ( 3.857 6.327 8.944) 11.615 38.679 ( 12.632 -3.903 -8.573) 15.758 39.896 ( 10.331 11.884 -13.392) 20.671 ======================= Grid point 376 (208/371) ======================= q-point: ( 0.62 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.839 ( 1.465 -2.339 -0.079) 2.761 4.225 ( 7.645 5.178 -0.164) 9.235 5.146 ( 8.261 9.127 -16.206) 20.351 5.786 ( -0.425 1.603 5.395) 5.644 6.737 ( 1.915 -1.266 12.508) 12.717 7.144 ( -6.131 -11.065 4.561) 13.447 8.046 ( -4.690 0.908 -23.071) 23.560 8.167 ( -11.700 -4.124 -0.718) 12.426 8.679 ( 7.844 8.237 0.634) 11.392 8.854 ( 10.322 0.356 1.996) 10.519 9.472 ( 0.932 3.014 7.815) 8.428 9.760 ( -10.484 -2.335 12.221) 16.270 11.364 ( -11.068 -4.906 -9.990) 15.696 11.767 ( -13.942 -1.735 -2.491) 14.269 11.921 ( 12.470 -5.469 9.645) 16.687 12.270 ( 11.732 7.383 9.620) 16.873 12.929 ( 1.753 -1.902 0.268) 2.600 13.007 ( -2.222 1.347 -1.456) 2.979 18.419 ( 2.574 1.543 -0.318) 3.018 18.627 ( -6.718 -2.740 0.734) 7.292 19.340 ( 5.480 3.284 -1.955) 6.681 19.491 ( -2.718 -2.603 -1.314) 3.987 20.748 ( -2.392 -1.370 0.487) 2.799 20.910 ( -2.843 -1.550 0.787) 3.332 27.675 ( 1.265 0.880 0.073) 1.543 27.718 ( 0.125 0.130 0.272) 0.327 37.112 ( 0.558 1.951 -5.364) 5.735 37.911 ( 1.461 0.970 9.526) 9.686 38.691 ( 1.138 -3.425 -14.191) 14.643 40.151 ( 12.949 9.692 -2.635) 16.387 ======================= Grid point 377 (209/371) ======================= q-point: (-0.31 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.665 ( -14.241 -8.853 -0.866) 16.791 4.229 ( -5.015 -8.028 -0.462) 9.477 5.188 ( -2.236 7.282 -15.538) 17.305 5.955 ( 10.566 7.855 6.254) 14.576 6.790 ( -1.494 -6.659 13.399) 15.037 7.032 ( 1.009 -3.285 2.293) 4.132 7.779 ( -9.185 -6.283 -21.769) 24.449 8.000 ( -6.745 2.781 -3.406) 8.052 8.908 ( 4.825 5.974 3.842) 8.586 9.036 ( 11.622 1.647 1.061) 11.786 9.548 ( -1.330 -0.933 11.260) 11.376 9.630 ( -8.442 -0.764 7.769) 11.498 11.023 ( -10.386 -7.868 -15.063) 19.916 11.549 ( -11.296 3.625 -1.694) 11.984 12.116 ( 10.721 -8.165 14.426) 19.741 12.572 ( 8.378 7.127 8.159) 13.695 12.852 ( -4.665 -3.014 -4.233) 6.983 13.096 ( 7.066 4.903 2.648) 8.998 18.460 ( -2.395 3.263 0.613) 4.094 18.597 ( 6.182 0.121 0.087) 6.184 19.403 ( -1.800 -1.288 -0.211) 2.223 19.462 ( 4.498 1.848 -2.608) 5.518 20.675 ( -4.174 -2.187 -1.052) 4.828 20.895 ( 0.858 0.512 0.505) 1.120 27.688 ( -0.365 0.313 -0.148) 0.502 27.723 ( 0.158 -0.261 0.819) 0.873 37.086 ( -2.061 1.051 -5.244) 5.732 37.944 ( -1.505 -4.523 9.380) 10.522 38.534 ( -6.968 -2.655 -15.079) 16.822 40.448 ( 13.465 7.825 1.131) 15.615 ======================= Grid point 378 (210/371) ======================= q-point: (-0.23 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.259 ( -23.168 -11.578 3.012) 26.074 3.934 ( -16.865 -15.979 2.115) 23.329 5.085 ( -7.919 2.476 -9.353) 12.503 6.250 ( 11.284 7.121 3.674) 13.840 6.711 ( -3.698 -8.712 8.056) 12.429 7.120 ( 5.178 0.755 4.251) 6.742 7.414 ( -14.424 -6.565 -19.198) 24.895 7.970 ( 1.872 3.110 -4.811) 6.027 8.895 ( -11.947 3.057 4.238) 13.040 9.195 ( 5.947 -5.348 2.438) 8.361 9.509 ( -4.529 2.101 3.638) 6.177 9.585 ( -2.265 -3.167 0.633) 3.945 10.920 ( 11.749 0.166 -6.366) 13.364 11.436 ( -8.699 8.486 -0.838) 12.182 12.214 ( 1.757 -10.289 14.498) 17.865 12.682 ( -7.227 -0.092 -1.138) 7.316 12.830 ( 10.228 3.681 3.464) 11.409 13.289 ( 8.386 4.327 2.638) 9.798 18.467 ( -0.637 4.549 1.778) 4.925 18.762 ( 10.929 2.528 -0.726) 11.241 19.374 ( -0.079 -0.557 1.656) 1.749 19.533 ( 3.549 1.970 -5.056) 6.484 20.576 ( -4.374 -2.455 -0.620) 5.054 20.934 ( 2.188 1.280 0.293) 2.552 27.674 ( -1.660 1.024 -0.821) 2.116 27.719 ( -0.169 -1.961 1.349) 2.386 37.014 ( -4.238 0.342 -4.828) 6.434 37.874 ( -4.679 -9.223 8.346) 13.289 38.276 ( -12.165 -2.848 -13.291) 18.241 40.733 ( 12.410 6.799 -0.213) 14.152 ======================= Grid point 379 (211/371) ======================= q-point: (-0.15 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.756 ( -27.892 -12.700 9.069) 31.961 3.433 ( -25.985 -20.159 7.074) 33.639 4.827 ( -19.831 -7.771 -4.664) 21.804 6.419 ( 2.109 -1.667 1.573) 3.115 6.654 ( 2.052 -3.288 5.434) 6.675 6.925 ( -20.628 -3.668 -8.455) 22.593 7.285 ( 9.596 -4.655 -7.309) 12.930 8.041 ( 1.826 5.507 1.667) 6.037 8.781 ( -6.246 10.439 -2.869) 12.499 9.160 ( -3.107 -12.081 6.629) 14.126 9.428 ( -6.493 -4.218 -0.838) 7.788 9.546 ( 2.238 2.601 -3.121) 4.638 11.165 ( 10.535 -0.655 -3.902) 11.253 11.497 ( 7.250 15.722 1.478) 17.376 12.150 ( -4.600 -7.495 7.972) 11.870 12.506 ( -10.323 -3.706 -1.683) 11.096 13.124 ( 14.430 5.688 10.373) 18.660 13.458 ( 7.553 2.412 0.608) 7.952 18.549 ( 2.908 6.263 2.295) 7.277 18.956 ( 9.715 2.037 -0.572) 9.943 19.410 ( 2.746 0.798 2.540) 3.825 19.560 ( 2.221 2.305 -9.190) 9.732 20.497 ( -2.827 -1.985 3.147) 4.673 20.987 ( 2.403 1.380 0.700) 2.859 27.639 ( -3.176 0.444 -1.218) 3.430 27.703 ( 0.213 -2.103 1.209) 2.436 36.913 ( -5.332 0.160 -4.221) 6.803 37.708 ( -8.121 -11.642 5.709) 15.299 37.964 ( -14.208 -4.447 -9.403) 17.609 40.958 ( 9.563 5.554 -7.266) 13.233 ======================= Grid point 384 (212/371) ======================= q-point: ( 0.23 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.603 ( -0.154 19.824 28.268) 34.526 1.997 ( 0.299 29.415 30.450) 42.338 2.846 ( -0.028 26.513 48.475) 55.252 6.058 ( -4.756 -2.944 -7.522) 9.374 6.333 ( 3.499 7.902 -1.620) 8.793 7.164 ( 4.939 -5.011 -0.806) 7.082 7.514 ( -3.696 16.737 -7.048) 18.533 8.113 ( -7.775 -26.722 7.542) 28.834 8.801 ( 14.334 -0.903 3.644) 14.818 8.890 ( -8.201 4.619 1.213) 9.490 9.514 ( 1.660 -4.029 -9.469) 10.424 10.190 ( 1.569 -22.460 5.229) 23.114 11.211 ( 1.929 -5.307 0.203) 5.651 11.587 ( 0.226 5.596 -1.024) 5.693 11.776 ( -5.801 11.671 -1.378) 13.106 11.982 ( 2.955 28.785 -9.491) 30.453 13.614 ( 0.423 -1.563 -4.352) 4.644 13.792 ( -1.737 -2.756 -0.674) 3.327 19.007 ( 0.576 -0.900 2.024) 2.289 19.017 ( -0.033 -3.285 3.507) 4.806 19.502 ( -0.982 -6.306 -4.306) 7.699 19.617 ( 0.797 0.387 -1.728) 1.942 21.275 ( -0.047 -2.576 8.673) 9.048 22.114 ( 0.133 -44.680 12.582) 46.418 27.446 ( 0.097 0.666 1.280) 1.446 27.728 ( -0.278 -1.463 -1.350) 2.010 36.725 ( 5.939 -3.416 -1.559) 7.027 36.944 ( -0.751 6.107 -2.255) 6.553 37.191 ( -8.860 10.790 1.813) 14.079 38.017 ( 3.660 83.604 -35.067) 90.734 ======================= Grid point 385 (213/371) ======================= q-point: ( 0.31 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.036 ( 9.324 29.387 20.270) 36.897 2.368 ( -2.966 24.978 31.139) 40.029 3.541 ( 20.712 24.963 28.150) 42.948 5.968 ( 3.092 -1.138 -4.982) 5.973 6.512 ( 10.295 7.877 -0.923) 12.996 7.226 ( 0.188 -0.955 2.801) 2.965 7.492 ( -1.148 -6.776 -2.212) 7.220 7.899 ( -2.354 2.145 3.721) 4.898 8.666 ( -10.828 -0.054 -2.880) 11.205 9.064 ( 6.609 -3.121 -5.162) 8.948 9.550 ( 9.416 1.688 1.272) 9.650 10.030 ( -1.173 -14.609 4.883) 15.448 11.234 ( 3.426 -3.653 1.176) 5.144 11.608 ( -6.116 8.042 -1.420) 10.203 11.843 ( 5.544 12.996 -1.928) 14.260 12.294 ( 12.636 10.559 -7.888) 18.259 13.441 ( -19.320 -3.712 -2.696) 19.858 13.645 ( -6.280 -7.189 -1.497) 9.662 18.921 ( -6.820 -1.505 1.562) 7.157 19.086 ( 5.399 -2.022 3.416) 6.701 19.377 ( -2.442 -8.512 -4.803) 10.074 19.591 ( -2.761 -0.206 -2.359) 3.637 21.266 ( -2.482 -4.424 7.917) 9.402 21.656 ( -15.169 -30.367 15.610) 37.363 27.475 ( 1.257 2.069 0.779) 2.543 27.697 ( -0.887 -1.138 -1.308) 1.947 36.871 ( 6.660 -0.782 0.537) 6.727 37.067 ( 15.378 4.516 -5.797) 17.044 37.277 ( 3.244 14.196 3.401) 14.954 38.757 ( 21.499 58.382 -42.912) 75.578 ======================= Grid point 386 (214/371) ======================= q-point: ( 0.38 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.632 ( 16.007 33.165 12.680) 38.948 2.743 ( 4.368 20.426 27.454) 34.497 4.089 ( 14.366 13.240 4.451) 20.037 6.055 ( 6.313 -0.900 -0.055) 6.377 6.870 ( 22.835 10.044 3.149) 25.144 7.067 ( -13.124 -6.163 10.763) 18.057 7.510 ( 11.769 -12.735 -0.880) 17.363 8.006 ( -0.168 18.370 -2.644) 18.560 8.492 ( -7.338 0.701 -5.176) 9.008 8.983 ( -2.135 -7.048 -12.062) 14.132 9.802 ( 10.664 5.733 7.140) 14.056 9.942 ( 0.427 -9.342 6.128) 11.180 11.252 ( 1.171 -1.186 1.496) 2.240 11.574 ( -6.976 10.238 -1.166) 12.444 12.092 ( 10.337 8.955 -1.770) 13.790 12.499 ( 11.076 1.111 -5.604) 12.462 12.946 ( -30.126 -9.700 4.994) 32.041 13.458 ( -7.062 -7.496 -4.375) 11.189 18.782 ( -9.756 -0.689 1.275) 9.863 19.164 ( 3.025 -2.198 3.089) 4.850 19.231 ( -1.611 -8.261 -5.468) 10.037 19.517 ( -3.097 -0.694 -3.046) 4.399 21.174 ( -7.194 -8.970 7.487) 13.721 21.310 ( -9.014 -13.805 10.926) 19.779 27.530 ( 2.049 3.060 -0.074) 3.684 27.672 ( -0.289 -0.524 -0.876) 1.060 36.942 ( 0.930 5.948 -0.615) 6.052 37.349 ( 14.454 3.973 -2.227) 15.155 37.599 ( 19.318 9.474 2.858) 21.705 39.280 ( 15.843 34.350 -38.895) 54.256 ======================= Grid point 387 (215/371) ======================= q-point: ( 0.46 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.152 ( 8.702 18.411 18.517) 27.524 3.276 ( 18.685 29.612 8.043) 35.926 4.395 ( 15.013 7.142 -6.396) 17.812 6.069 ( -1.638 -4.497 -0.553) 4.818 6.834 ( -9.168 -7.416 11.354) 16.370 7.474 ( 18.688 12.589 8.329) 24.023 7.517 ( 12.373 -15.479 -2.265) 19.945 8.173 ( 2.424 17.360 -7.470) 19.054 8.427 ( 0.583 2.183 -0.401) 2.295 8.792 ( -5.582 -5.434 -11.403) 13.810 9.898 ( -3.330 -2.760 5.112) 6.696 9.984 ( 2.331 0.349 2.964) 3.787 11.308 ( 3.363 4.332 6.768) 8.711 11.568 ( -3.761 6.975 1.184) 8.013 12.179 ( -7.986 -0.420 -5.034) 9.449 12.480 ( -12.945 -6.142 7.493) 16.169 12.683 ( 10.823 -0.844 0.319) 10.860 13.236 ( -7.867 -7.086 -5.427) 11.898 18.617 ( -10.174 -0.242 1.116) 10.238 19.074 ( -4.153 -7.874 -1.707) 9.064 19.192 ( -0.662 0.125 -1.460) 1.608 19.482 ( 2.366 -2.109 -2.851) 4.263 20.985 ( -7.714 -9.004 6.813) 13.674 21.164 ( -5.025 -6.428 4.876) 9.505 27.588 ( 1.668 3.185 -0.979) 3.726 27.673 ( 0.803 0.295 0.111) 0.863 37.017 ( 0.932 7.818 -2.096) 8.147 37.592 ( 10.158 5.414 2.193) 11.718 38.030 ( 22.689 4.661 -0.090) 23.163 39.564 ( 10.453 20.736 -28.901) 37.074 ======================= Grid point 388 (216/371) ======================= q-point: ( 0.54 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.527 ( 10.498 11.711 8.715) 17.981 3.844 ( 14.857 24.097 4.023) 28.593 4.684 ( 17.288 6.310 -8.970) 20.473 5.946 ( -6.519 -4.637 1.286) 8.102 6.743 ( -3.210 -4.837 13.559) 14.749 7.375 ( -5.337 -9.122 1.558) 10.683 7.901 ( 16.465 -2.026 -12.569) 20.813 8.311 ( 8.470 4.151 -8.869) 12.947 8.491 ( -2.312 -0.979 2.612) 3.623 8.696 ( 0.277 12.659 2.457) 12.898 9.751 ( -14.700 1.511 -3.883) 15.279 9.967 ( -1.546 -6.201 8.940) 10.990 11.518 ( 6.687 5.765 9.840) 13.221 11.593 ( 0.679 1.358 2.994) 3.357 11.964 ( -7.777 -0.868 5.089) 9.335 12.312 ( -8.819 -4.858 -2.786) 10.447 12.834 ( 6.630 -1.087 -1.192) 6.824 13.065 ( -2.904 -3.731 -1.981) 5.126 18.480 ( -7.001 0.906 0.946) 7.122 18.906 ( -7.772 -5.252 -1.126) 9.448 19.194 ( 2.034 1.074 -1.785) 2.912 19.490 ( 3.026 -4.199 -2.479) 5.739 20.848 ( -4.551 -4.866 3.895) 7.717 21.049 ( -4.752 -5.059 2.251) 7.297 27.633 ( 1.222 2.625 -1.025) 3.071 27.699 ( 1.043 1.036 0.646) 1.606 37.089 ( 0.314 8.037 -3.371) 8.721 37.797 ( 7.112 3.498 5.319) 9.545 38.376 ( 16.566 2.446 -5.502) 17.626 39.762 ( 10.294 13.054 -16.860) 23.678 ======================= Grid point 389 (217/371) ======================= q-point: ( 0.62 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.765 ( 5.959 3.400 0.314) 6.868 4.203 ( 5.369 11.973 1.643) 13.224 4.951 ( 14.033 6.185 -11.859) 19.386 5.850 ( -2.950 -0.234 5.174) 5.961 6.756 ( 0.878 -4.650 13.671) 14.467 7.213 ( -7.361 -3.912 1.803) 8.528 7.874 ( 1.180 -9.663 -19.929) 22.180 8.345 ( -0.187 -3.737 -5.915) 6.999 8.538 ( 6.054 9.657 -3.000) 11.786 8.896 ( -0.448 13.590 8.120) 15.837 9.549 ( -5.935 -1.169 2.720) 6.633 9.926 ( -4.578 -4.424 12.434) 13.969 11.460 ( -11.061 -2.897 -9.172) 14.658 11.703 ( 9.626 -8.088 9.701) 15.880 11.957 ( -12.143 -2.086 1.531) 12.416 12.217 ( 9.069 7.962 7.622) 14.274 12.880 ( 2.792 -0.571 -1.058) 3.040 13.029 ( -0.276 -1.002 -0.533) 1.168 18.431 ( -1.630 3.057 0.644) 3.524 18.730 ( -8.175 -2.860 -0.247) 8.664 19.259 ( 5.273 1.325 -1.880) 5.753 19.462 ( 0.677 -5.559 -1.989) 5.943 20.778 ( -2.459 -1.884 1.375) 3.389 20.944 ( -3.689 -3.757 0.969) 5.353 27.669 ( 0.990 1.852 -0.355) 2.130 27.725 ( 0.278 1.279 0.575) 1.430 37.135 ( -1.254 7.310 -4.209) 8.528 37.934 ( 3.338 0.228 7.611) 8.314 38.540 ( 6.640 1.749 -11.737) 13.598 39.993 ( 13.376 7.907 -6.326) 16.777 ======================= Grid point 390 (218/371) ======================= q-point: (-0.31 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.764 ( -5.611 -3.335 -1.536) 6.705 4.249 ( -5.004 -1.869 -0.095) 5.343 5.103 ( 6.865 2.536 -13.818) 15.636 5.925 ( 5.488 5.394 6.622) 10.152 6.789 ( 0.946 -8.262 11.874) 14.497 7.108 ( -6.050 5.267 1.044) 8.089 7.661 ( -2.178 -9.971 -17.330) 20.112 8.227 ( -12.150 6.179 -5.168) 14.578 8.767 ( 14.830 4.242 -2.230) 15.585 9.025 ( -0.143 10.977 4.198) 11.753 9.551 ( 2.448 -4.534 10.096) 11.335 9.852 ( -9.081 -2.229 12.720) 15.787 11.100 ( -16.793 -6.693 -16.057) 24.179 11.726 ( -9.893 -1.187 -0.346) 9.970 11.861 ( 14.170 -12.263 11.916) 22.207 12.535 ( 9.263 8.273 8.485) 15.042 12.889 ( -2.668 -1.374 -0.257) 3.012 13.049 ( 4.680 3.164 -0.466) 5.669 18.490 ( 3.686 5.119 -0.017) 6.308 18.600 ( -5.922 -0.179 0.910) 5.994 19.352 ( 5.905 0.028 -2.450) 6.393 19.404 ( -0.023 -4.792 -1.045) 4.904 20.718 ( -3.744 -1.615 -0.555) 4.115 20.890 ( -0.206 -1.331 0.789) 1.561 27.691 ( 0.235 0.688 0.155) 0.743 27.738 ( -0.503 1.403 0.437) 1.553 37.139 ( -3.369 6.139 -4.474) 8.310 37.983 ( -1.016 -3.267 9.054) 9.678 38.517 ( -2.131 1.263 -14.903) 15.107 40.269 ( 15.339 4.710 -1.368) 16.104 ======================= Grid point 391 (219/371) ======================= q-point: (-0.23 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.527 ( -17.511 -6.518 3.374) 18.987 4.050 ( -12.105 -9.294 0.378) 15.266 5.082 ( 0.046 -3.656 -10.816) 11.417 6.160 ( 10.584 7.530 3.931) 13.571 6.726 ( -3.070 -9.149 4.369) 10.593 7.132 ( -1.296 9.028 -0.737) 9.151 7.464 ( -5.391 -4.093 -10.541) 12.528 8.060 ( -10.555 5.160 -2.309) 11.973 8.957 ( 5.271 -4.031 -2.362) 7.043 9.151 ( 1.789 8.671 3.561) 9.543 9.583 ( 0.014 -4.687 6.712) 8.186 9.710 ( -13.041 -0.599 8.668) 15.670 10.799 ( -2.035 -0.696 -9.277) 9.523 11.609 ( -5.686 3.608 -0.873) 6.791 12.048 ( 14.238 -13.747 14.816) 24.723 12.707 ( 3.399 -0.439 0.021) 3.427 12.795 ( -4.763 0.810 0.969) 4.927 13.210 ( 8.144 4.265 1.423) 9.302 18.552 ( -1.940 2.427 1.950) 3.668 18.635 ( 7.139 6.646 -0.638) 9.774 19.358 ( 0.806 -3.175 0.785) 3.369 19.433 ( 5.459 -1.361 -4.455) 7.176 20.626 ( -4.630 -1.842 -0.510) 5.009 20.909 ( 2.095 0.363 0.570) 2.201 27.693 ( -0.326 -0.048 0.270) 0.426 27.734 ( -1.678 0.884 0.240) 1.912 37.096 ( -5.458 5.002 -4.151) 8.487 37.933 ( -5.461 -6.093 9.557) 12.581 38.357 ( -8.478 0.180 -15.055) 17.279 40.548 ( 15.004 3.066 -2.058) 15.452 ======================= Grid point 392 (220/371) ======================= q-point: (-0.15 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.136 ( -25.018 -9.132 10.211) 28.523 3.699 ( -20.846 -11.148 4.492) 24.063 4.940 ( -6.299 -7.761 -7.046) 12.229 6.382 ( 5.214 5.327 -0.524) 7.472 6.608 ( -0.248 -7.147 -0.874) 7.205 7.126 ( -6.121 1.862 -13.934) 15.332 7.273 ( -14.023 3.100 7.316) 16.117 8.032 ( 3.145 4.840 0.439) 5.789 8.867 ( -2.636 -6.867 -3.086) 7.977 9.247 ( -4.060 6.603 7.580) 10.841 9.472 ( -7.612 -8.132 -1.658) 11.262 9.584 ( -5.066 2.562 2.498) 6.203 10.932 ( 13.397 3.329 0.308) 13.808 11.618 ( 0.066 11.699 -1.501) 11.795 12.168 ( 2.719 -8.332 13.565) 16.150 12.611 ( -6.547 -1.994 -6.102) 9.169 12.874 ( 12.910 -8.120 7.163) 16.850 13.368 ( 6.933 2.631 -0.823) 7.461 18.601 ( 1.577 5.639 2.881) 6.526 18.822 ( 8.585 5.564 -0.939) 10.273 19.368 ( 2.374 -2.273 0.811) 3.385 19.469 ( 4.562 -1.282 -6.536) 8.073 20.547 ( -3.351 -1.156 2.281) 4.216 20.959 ( 2.775 0.840 0.788) 3.004 27.687 ( -0.352 0.096 -0.104) 0.379 27.699 ( -3.110 -0.356 0.085) 3.132 37.018 ( -6.925 4.345 -3.308) 8.819 37.794 ( -9.550 -7.386 8.770) 14.922 38.104 ( -12.617 -1.249 -13.214) 18.313 40.772 ( 12.219 1.581 -8.093) 14.742 ======================= Grid point 397 (221/371) ======================= q-point: ( 0.23 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.030 ( -8.516 27.419 21.975) 36.156 2.354 ( 3.673 24.953 29.839) 39.071 3.549 ( -21.780 25.650 27.643) 43.548 6.124 ( -4.808 6.349 -1.682) 8.140 6.413 ( -10.123 4.090 -5.382) 12.172 7.049 ( 3.361 -8.383 4.454) 10.070 7.667 ( -2.780 8.940 -8.324) 12.527 8.080 ( -4.159 -2.360 5.236) 7.091 8.526 ( 16.806 -2.972 6.886) 18.404 9.090 ( -10.596 -1.464 -4.414) 11.571 9.416 ( -2.327 -5.406 -7.017) 9.159 9.993 ( 2.691 -15.305 6.745) 16.940 11.134 ( 2.103 -5.108 0.110) 5.525 11.722 ( -5.454 8.302 -0.068) 9.934 11.855 ( 1.807 13.795 -0.921) 13.944 12.274 ( -13.839 9.354 -7.113) 18.155 13.442 ( 15.825 -3.697 -4.291) 16.808 13.710 ( 7.085 -2.428 -1.668) 7.673 18.908 ( 6.722 -3.269 1.848) 7.700 19.061 ( -3.380 -3.268 2.562) 5.354 19.425 ( -0.348 -6.083 -4.364) 7.494 19.563 ( 4.306 -1.029 -1.890) 4.814 21.269 ( 2.430 -4.331 8.013) 9.427 21.654 ( 15.082 -30.157 15.351) 37.048 27.467 ( -0.877 1.391 0.729) 1.799 27.709 ( 0.443 -0.314 -1.284) 1.395 36.769 ( -10.334 -2.083 -1.586) 10.661 36.997 ( -1.154 5.401 -0.027) 5.523 37.528 ( -16.389 14.742 2.290) 22.162 38.679 ( -18.966 58.310 -45.457) 76.329 ======================= Grid point 398 (222/371) ======================= q-point: ( 0.31 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.341 ( 0.464 29.324 20.711) 35.903 2.819 ( 0.478 28.411 20.847) 35.242 3.780 ( 0.295 27.478 27.356) 38.774 5.970 ( -9.127 4.124 -8.890) 13.392 6.433 ( 5.670 5.380 -2.906) 8.339 7.125 ( 8.775 -4.340 7.441) 12.297 7.525 ( -10.518 -12.669 1.141) 16.505 8.050 ( -3.841 15.497 -0.717) 15.982 8.723 ( 2.092 -8.202 -0.671) 8.491 8.946 ( -0.222 2.237 -3.740) 4.364 9.405 ( 7.900 1.281 -1.175) 8.089 9.889 ( 0.803 -16.135 3.843) 16.605 11.191 ( 3.883 0.344 4.746) 6.141 11.694 ( -2.277 6.848 -1.202) 7.316 11.993 ( -4.066 13.677 -3.055) 14.592 12.211 ( 2.516 3.901 -2.458) 5.253 13.517 ( 2.041 -3.647 -5.900) 7.231 13.706 ( -5.441 -3.384 -4.389) 7.767 18.957 ( 2.735 -6.992 3.808) 8.418 19.020 ( -0.272 0.855 0.627) 1.095 19.300 ( -2.348 -9.663 -4.837) 11.058 19.593 ( 0.976 -1.209 -1.345) 2.055 21.278 ( -0.135 -6.633 7.746) 10.199 21.544 ( 0.065 -30.369 13.360) 33.178 27.484 ( 0.512 2.085 0.676) 2.251 27.695 ( -0.750 -0.364 -1.304) 1.547 36.694 ( 4.134 1.075 -0.468) 4.297 37.082 ( 1.033 11.246 -2.851) 11.648 37.451 ( -8.063 14.480 2.299) 16.733 38.926 ( 2.862 54.877 -38.486) 67.088 ======================= Grid point 399 (223/371) ======================= q-point: ( 0.38 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.797 ( 8.755 30.172 16.121) 35.311 3.133 ( -3.426 25.997 19.628) 32.754 4.140 ( 1.650 17.614 7.987) 19.411 5.946 ( 4.261 4.337 -4.660) 7.661 6.635 ( 15.114 5.562 -0.009) 16.105 7.192 ( -4.072 -20.101 6.017) 21.374 7.330 ( 1.962 5.260 11.253) 12.576 8.167 ( -0.419 16.642 -6.769) 17.971 8.564 ( -6.945 -6.240 -4.051) 10.177 8.920 ( -2.243 1.866 -10.301) 10.706 9.660 ( 14.704 3.286 5.318) 15.978 9.805 ( 4.142 -12.856 5.298) 14.509 11.268 ( 0.446 1.676 7.452) 7.651 11.747 ( -1.575 8.600 -2.555) 9.109 12.048 ( 2.084 10.376 -2.350) 10.841 12.318 ( 8.489 -1.459 -1.400) 8.726 13.353 ( -21.515 -2.585 -4.076) 22.050 13.461 ( -6.601 -9.152 -3.842) 11.920 18.916 ( -4.539 -0.837 0.755) 4.677 19.064 ( 5.245 -3.448 2.867) 6.901 19.136 ( -1.919 -10.902 -5.230) 12.243 19.553 ( -3.043 -1.608 -1.570) 3.783 21.205 ( -3.846 -11.966 7.252) 14.511 21.323 ( -4.342 -17.391 10.034) 20.542 27.528 ( 1.653 2.942 0.075) 3.376 27.674 ( -0.770 0.189 -0.920) 1.214 36.872 ( 13.963 0.491 0.551) 13.983 37.189 ( 1.127 13.544 -5.188) 14.547 37.589 ( 5.034 14.657 4.575) 16.159 39.266 ( 6.533 38.528 -34.259) 51.969 ======================= Grid point 400 (224/371) ======================= q-point: ( 0.46 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.311 ( 10.407 23.285 15.078) 29.628 3.448 ( 1.993 28.329 14.007) 31.666 4.278 ( 3.301 9.117 -6.225) 11.523 6.021 ( 2.470 0.131 -2.639) 3.617 6.936 ( -2.172 -6.886 10.971) 13.134 7.026 ( 18.379 -9.317 -1.633) 20.670 7.527 ( 3.304 10.372 10.880) 15.391 8.229 ( 0.021 4.726 -9.586) 10.688 8.417 ( -0.588 -3.260 -2.987) 4.460 8.851 ( -6.078 11.148 -9.204) 15.682 9.786 ( 8.455 -11.314 2.414) 14.329 9.942 ( 6.619 2.380 6.351) 9.477 11.346 ( 1.732 3.554 10.521) 11.239 11.743 ( -6.239 8.433 -2.767) 10.849 12.176 ( 3.421 2.146 -4.841) 6.304 12.459 ( 11.678 -0.366 0.107) 11.684 12.862 ( -28.571 -5.154 4.995) 29.459 13.260 ( -6.713 -7.424 -6.108) 11.725 18.794 ( -9.974 -0.272 1.000) 10.027 19.002 ( 0.334 -7.554 -6.246) 9.807 19.139 ( 5.696 -4.368 2.845) 7.722 19.462 ( -4.121 -2.291 -1.949) 5.102 21.030 ( -5.738 -12.613 6.876) 15.469 21.189 ( -3.626 -8.588 4.972) 10.565 27.586 ( 1.816 3.214 -0.897) 3.798 27.672 ( 0.192 1.065 0.045) 1.083 37.074 ( 5.200 5.328 2.635) 7.898 37.363 ( 12.678 7.894 -8.829) 17.350 37.890 ( 10.899 12.962 7.189) 18.398 39.499 ( 5.776 24.587 -27.723) 37.503 ======================= Grid point 401 (225/371) ======================= q-point: ( 0.54 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.630 ( 0.844 14.468 12.197) 18.942 3.900 ( 11.072 26.613 5.539) 29.352 4.445 ( 13.089 6.829 -7.485) 16.553 5.998 ( -3.272 -1.157 0.519) 3.509 6.815 ( -4.587 -9.276 13.534) 17.037 7.229 ( 13.527 -10.067 -4.827) 17.539 7.674 ( 1.926 6.331 -5.130) 8.373 8.156 ( 0.602 -8.833 -8.791) 12.477 8.520 ( 8.321 6.193 5.035) 11.530 8.870 ( -4.153 19.109 -3.383) 19.846 9.840 ( 5.918 -7.983 4.659) 10.975 9.956 ( -6.276 -2.456 -1.068) 6.824 11.507 ( 5.086 2.079 12.041) 13.236 11.698 ( -5.537 5.006 -0.183) 7.467 12.096 ( -6.493 -1.142 -2.638) 7.101 12.481 ( -17.202 -2.474 6.493) 18.552 12.670 ( 11.142 -0.088 -0.956) 11.184 13.071 ( -4.539 -4.542 -4.468) 7.823 18.632 ( -9.226 -0.342 1.360) 9.332 18.917 ( -1.570 -4.079 -4.705) 6.422 19.180 ( 1.622 -1.759 1.249) 2.699 19.384 ( 0.576 -5.033 -2.256) 5.546 20.883 ( -4.067 -7.442 4.388) 9.549 21.076 ( -3.835 -6.694 2.368) 8.070 27.633 ( 1.271 2.893 -1.300) 3.416 27.700 ( 1.018 1.799 0.774) 2.207 37.183 ( -0.970 9.861 0.606) 9.927 37.614 ( 15.834 2.183 -6.397) 17.216 38.217 ( 10.765 9.931 5.825) 15.763 39.656 ( 6.738 14.608 -19.231) 25.072 ======================= Grid point 402 (226/371) ======================= q-point: ( 0.62 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.778 ( -0.209 8.201 2.771) 8.658 4.268 ( 5.172 15.968 3.022) 17.055 4.715 ( 15.252 5.379 -6.209) 17.324 5.932 ( -4.574 -0.215 5.087) 6.844 6.759 ( -0.578 -8.433 11.767) 14.488 7.266 ( 1.309 -0.900 -2.180) 2.698 7.668 ( 2.090 -3.193 -16.532) 16.967 8.082 ( 9.297 -8.986 -7.471) 14.933 8.682 ( -2.194 11.900 -0.497) 12.111 9.057 ( 3.720 14.391 8.918) 17.335 9.693 ( -14.657 -2.102 -3.228) 15.155 9.916 ( 5.007 -8.741 7.889) 12.795 11.546 ( -3.863 -8.099 2.879) 9.423 11.610 ( -4.510 -2.575 -0.166) 5.196 12.164 ( -4.523 5.103 12.961) 14.645 12.212 ( -4.117 1.384 -0.714) 4.401 12.803 ( 6.485 1.441 -2.854) 7.231 13.001 ( 0.275 -2.438 -1.334) 2.793 18.526 ( -5.447 2.079 1.447) 6.007 18.811 ( -5.152 -2.567 -2.370) 6.225 19.200 ( 1.925 0.837 -0.618) 2.188 19.351 ( 3.340 -7.636 -2.017) 8.575 20.802 ( -2.153 -3.102 2.077) 4.310 20.966 ( -3.587 -5.257 0.959) 6.436 27.672 ( 0.959 2.614 -0.743) 2.881 27.735 ( 0.646 1.679 0.711) 1.934 37.242 ( -3.065 10.346 -1.468) 10.890 37.828 ( 11.746 -0.490 -2.028) 11.930 38.451 ( 5.228 7.551 -0.004) 9.184 39.820 ( 10.676 7.373 -10.083) 16.431 ======================= Grid point 403 (227/371) ======================= q-point: (-0.31 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.809 ( -2.815 2.893 -1.254) 4.227 4.364 ( -6.252 3.792 1.744) 7.517 4.921 ( 9.866 0.725 -7.828) 12.616 5.936 ( 1.233 1.397 7.260) 7.496 6.735 ( 1.144 -9.399 6.576) 11.528 7.276 ( -3.659 10.290 -1.051) 10.972 7.532 ( -2.005 -5.832 -13.260) 14.624 8.227 ( 14.258 -0.039 -7.028) 15.896 8.707 ( -3.688 9.535 -3.238) 10.724 9.234 ( -5.353 12.811 7.904) 15.977 9.500 ( -0.496 -8.244 5.298) 9.812 9.939 ( 1.048 -6.803 8.723) 11.112 11.253 ( -17.324 -4.230 -13.891) 22.604 11.616 ( 7.775 -12.553 11.624) 18.793 11.888 ( -13.737 -4.626 2.263) 14.670 12.520 ( 9.522 10.626 9.238) 16.998 12.903 ( 2.020 3.140 -0.144) 3.736 12.979 ( 3.194 -2.314 -3.107) 5.021 18.509 ( -1.025 3.687 0.420) 3.849 18.703 ( -5.090 0.396 0.267) 5.112 19.248 ( 4.047 -0.335 -2.252) 4.644 19.322 ( 2.747 -6.708 -1.091) 7.330 20.757 ( -2.591 -1.074 0.036) 2.805 20.885 ( -1.321 -3.291 0.810) 3.638 27.700 ( 0.074 1.784 -0.178) 1.794 27.759 ( 0.110 1.450 0.524) 1.545 37.261 ( -4.735 9.133 -2.503) 10.588 37.959 ( 5.764 -2.274 2.285) 6.604 38.519 ( -2.216 5.654 -6.462) 8.868 40.041 ( 14.777 2.811 -3.845) 15.526 ======================= Grid point 404 (228/371) ======================= q-point: (-0.23 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.726 ( -9.509 -0.113 1.760) 9.672 4.200 ( -13.340 -2.745 1.771) 13.734 4.957 ( 3.041 -5.841 -7.632) 10.080 6.076 ( 8.766 2.648 5.562) 10.714 6.666 ( -0.423 -9.263 -2.272) 9.547 7.319 ( -7.516 16.949 -6.666) 19.703 7.427 ( 1.605 -2.234 -0.343) 2.772 8.291 ( -7.989 5.523 -2.640) 10.065 8.780 ( 7.687 -0.425 -5.516) 9.471 9.260 ( -3.479 7.644 3.542) 9.115 9.536 ( 4.527 -5.846 9.170) 11.780 9.904 ( -4.560 -5.157 8.992) 11.324 10.869 ( -13.602 -0.720 -11.880) 18.074 11.700 ( -5.801 -3.231 3.038) 7.302 11.736 ( 13.107 -13.108 11.998) 22.081 12.719 ( 0.724 5.288 2.867) 6.059 12.851 ( -3.305 -2.594 -1.983) 4.645 13.111 ( 8.871 3.210 0.303) 9.439 18.535 ( 1.270 0.489 -0.773) 1.565 18.696 ( -0.469 7.452 2.301) 7.813 19.281 ( 4.228 -4.417 -1.486) 6.292 19.320 ( 3.021 -2.444 -2.211) 4.471 20.684 ( -4.432 -1.152 -0.457) 4.602 20.878 ( 1.850 -0.785 0.765) 2.150 27.704 ( -0.799 0.556 0.239) 1.003 27.769 ( -0.821 1.266 0.125) 1.514 37.234 ( -6.295 7.216 -2.430) 9.879 37.996 ( -0.642 -3.040 5.823) 6.600 38.430 ( -8.168 3.361 -10.518) 13.735 40.296 ( 16.062 0.737 -3.118) 16.378 ======================= Grid point 405 (229/371) ======================= q-point: (-0.15 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.493 ( -20.139 -4.497 9.115) 22.559 3.953 ( -15.971 -1.656 3.385) 16.410 4.870 ( -0.382 -8.104 -6.079) 10.138 6.289 ( 11.688 1.159 2.908) 12.100 6.528 ( -2.899 -6.912 -10.003) 12.500 7.261 ( -8.582 12.737 -9.677) 18.152 7.521 ( -2.196 6.573 10.192) 12.325 8.131 ( -12.157 3.348 -0.729) 12.630 8.766 ( 1.676 -9.674 -5.431) 11.220 9.324 ( 1.971 2.245 2.485) 3.886 9.541 ( -4.246 -1.319 1.041) 4.566 9.775 ( -11.370 -1.382 7.728) 13.817 10.823 ( 6.683 6.851 0.905) 9.613 11.654 ( 1.655 1.664 -0.348) 2.373 11.936 ( 18.053 -13.670 13.505) 26.366 12.658 ( -7.900 -0.160 -3.607) 8.686 12.795 ( -1.976 -3.808 1.018) 4.409 13.263 ( 7.292 1.069 -1.501) 7.521 18.573 ( 4.197 -0.566 0.618) 4.280 18.820 ( 3.062 9.882 1.573) 10.465 19.309 ( 1.800 -2.939 -0.235) 3.455 19.332 ( 5.778 -2.692 -4.722) 7.933 20.607 ( -3.824 -0.419 1.363) 4.081 20.921 ( 2.982 0.164 0.733) 3.076 27.692 ( -0.904 -0.315 0.509) 1.084 27.752 ( -2.449 0.798 -0.550) 2.634 37.170 ( -7.392 5.209 -1.376) 9.147 37.945 ( -6.862 -2.089 8.177) 10.877 38.223 ( -12.013 1.082 -12.399) 17.298 40.520 ( 13.953 -0.499 -7.625) 15.909 ======================= Grid point 410 (230/371) ======================= q-point: ( 0.23 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.585 ( -14.668 27.689 16.256) 35.300 2.715 ( -4.753 21.081 24.565) 32.717 4.135 ( -15.935 16.022 3.594) 22.881 6.238 ( 2.491 6.567 6.290) 9.428 6.768 ( -29.662 7.465 -5.726) 31.118 6.924 ( 5.698 -10.022 9.084) 14.678 7.711 ( -5.490 0.293 -7.450) 9.259 8.207 ( 11.393 15.118 5.135) 19.614 8.322 ( -1.487 -2.641 2.797) 4.124 9.101 ( 0.460 -2.073 -11.723) 11.914 9.439 ( -9.265 -10.626 -2.555) 14.328 9.899 ( -0.951 -9.706 9.047) 13.303 11.079 ( -0.073 -2.641 2.816) 3.862 11.816 ( 5.145 12.782 2.289) 13.968 12.029 ( -9.541 5.818 -3.696) 11.770 12.503 ( -12.125 0.103 -1.378) 12.203 13.014 ( 27.501 -4.636 -0.996) 27.907 13.533 ( 9.549 -3.025 -3.462) 10.598 18.756 ( 8.847 -2.894 0.908) 9.353 19.065 ( -1.432 -6.733 0.449) 6.898 19.373 ( 1.256 -2.411 -1.517) 3.113 19.461 ( 2.419 -2.109 -3.437) 4.703 21.176 ( 7.291 -9.066 7.604) 13.899 21.315 ( 8.779 -12.968 10.455) 18.829 27.505 ( -1.868 1.323 -0.045) 2.290 27.701 ( 0.346 1.243 -0.898) 1.572 36.903 ( -5.405 4.317 -4.378) 8.186 37.135 ( -11.295 0.559 4.915) 12.331 37.991 ( -18.446 18.365 3.183) 26.223 39.146 ( -15.457 30.647 -42.642) 54.741 ======================= Grid point 411 (231/371) ======================= q-point: ( 0.31 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.763 ( -6.330 26.754 19.256) 33.566 3.115 ( 5.252 28.017 17.358) 33.374 4.139 ( -4.605 16.651 6.635) 18.507 6.301 ( -23.436 11.488 -1.859) 26.167 6.402 ( 1.033 3.290 -3.995) 5.277 6.983 ( 6.543 -8.672 10.890) 15.382 7.577 ( -7.062 -5.329 0.168) 8.848 8.259 ( -6.186 8.971 -1.282) 10.972 8.523 ( 10.852 -3.524 1.093) 11.463 8.986 ( -0.906 2.010 -8.366) 8.652 9.354 ( 0.595 4.933 0.059) 4.969 9.788 ( -2.910 -13.569 5.976) 15.109 11.146 ( 5.160 1.546 5.970) 8.041 11.845 ( -8.604 5.780 -1.745) 10.511 12.067 ( 5.168 7.091 -0.486) 8.788 12.311 ( -11.222 1.482 0.408) 11.327 13.308 ( 14.675 -5.330 -6.052) 16.745 13.632 ( 6.883 -2.407 -4.879) 8.774 18.835 ( 4.768 -7.427 2.293) 9.118 19.015 ( 1.486 -1.410 -1.567) 2.579 19.256 ( -5.168 -7.695 -1.833) 9.449 19.521 ( 5.019 -1.720 -1.323) 5.468 21.206 ( 3.866 -12.353 7.360) 14.890 21.330 ( 3.893 -16.304 9.601) 19.317 27.503 ( -0.295 1.867 0.204) 1.901 27.704 ( -0.713 1.163 -1.052) 1.723 36.771 ( -9.508 2.298 0.678) 9.805 37.136 ( 2.218 10.321 -2.070) 10.758 37.837 ( -18.736 15.630 2.704) 24.549 39.173 ( -0.748 38.973 -35.668) 52.836 ======================= Grid point 412 (232/371) ======================= q-point: ( 0.38 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.069 ( 1.436 26.409 16.446) 31.145 3.454 ( -0.347 22.112 9.806) 24.191 4.310 ( 1.993 11.263 1.369) 11.520 6.072 ( -11.983 13.496 -3.441) 18.373 6.508 ( 5.338 4.130 0.881) 6.806 7.054 ( 3.904 -11.796 10.826) 16.480 7.460 ( -3.135 1.855 9.505) 10.179 8.238 ( -1.852 3.448 -7.598) 8.547 8.513 ( 0.483 -9.096 -6.395) 11.130 9.040 ( -3.926 16.998 -4.845) 18.106 9.464 ( 7.638 -3.565 -1.440) 8.552 9.709 ( 3.164 -3.211 10.572) 11.493 11.292 ( 4.708 1.331 8.937) 10.188 11.795 ( -0.987 4.346 -1.491) 4.699 12.163 ( -1.162 -5.955 3.644) 7.077 12.219 ( -1.245 13.333 -4.624) 14.167 13.349 ( 3.020 -6.948 -6.738) 10.139 13.576 ( -7.743 -4.661 -6.399) 11.073 18.836 ( 5.148 -8.907 1.576) 10.408 19.034 ( 1.289 -2.692 -3.536) 4.627 19.083 ( -5.704 -5.327 0.319) 7.811 19.547 ( 0.996 -2.297 -0.847) 2.643 21.139 ( 0.006 -16.193 7.510) 17.849 21.264 ( -0.423 -11.511 6.946) 13.450 27.531 ( 1.097 2.508 -0.048) 2.738 27.693 ( -1.258 1.254 -0.810) 1.952 36.739 ( 2.544 3.446 0.098) 4.284 37.299 ( 3.038 13.523 -0.754) 13.881 37.771 ( -8.382 16.301 2.724) 18.531 39.371 ( 2.783 32.532 -30.397) 44.609 ======================= Grid point 413 (233/371) ======================= q-point: ( 0.46 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.452 ( 7.504 22.380 11.973) 26.468 3.694 ( 2.015 18.647 8.798) 20.717 4.348 ( -2.729 5.516 -8.544) 10.529 6.076 ( -5.472 12.957 1.213) 14.118 6.668 ( 12.879 -3.678 -2.087) 13.556 6.987 ( -3.640 -10.098 13.535) 17.275 7.652 ( 5.791 13.660 13.929) 20.351 8.166 ( -0.414 -4.109 -11.044) 11.791 8.364 ( -3.019 -7.704 -6.993) 10.834 9.088 ( -7.685 20.237 -5.399) 22.310 9.498 ( 11.074 -12.438 -3.523) 17.022 9.918 ( 6.819 6.930 11.403) 14.985 11.394 ( 2.180 -0.814 11.315) 11.552 11.844 ( 0.404 1.615 0.889) 1.887 12.126 ( 1.078 0.912 -2.178) 2.596 12.332 ( 4.829 7.235 -3.115) 9.239 13.238 ( -5.758 -5.900 -7.417) 11.090 13.250 ( -18.871 -6.997 -1.737) 20.201 18.851 ( 4.376 -9.082 -6.367) 11.923 18.892 ( -2.972 -6.599 3.038) 7.849 19.064 ( -0.289 0.924 0.796) 1.254 19.502 ( -3.180 -2.487 -0.774) 4.110 21.007 ( -2.636 -13.684 6.447) 15.354 21.177 ( -2.122 -8.862 4.196) 10.032 27.580 ( 1.816 2.955 -0.710) 3.540 27.687 ( -0.572 1.581 -0.139) 1.687 36.899 ( 12.759 2.250 -0.570) 12.968 37.433 ( -2.566 14.889 -0.810) 15.130 37.915 ( 5.015 14.491 4.954) 16.115 39.532 ( 2.081 23.555 -25.112) 34.493 ======================= Grid point 414 (234/371) ======================= q-point: ( 0.54 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.792 ( 4.149 12.358 9.360) 16.048 3.984 ( 8.740 17.561 5.976) 20.506 4.348 ( 3.353 7.960 -8.825) 12.349 6.101 ( -6.269 9.487 3.630) 11.936 6.750 ( 7.816 -12.734 -3.069) 15.253 6.974 ( 3.000 -4.318 11.318) 12.480 7.808 ( -8.236 9.629 -2.701) 12.956 8.043 ( -2.424 -9.116 -6.659) 11.547 8.383 ( 14.624 1.773 3.717) 15.193 9.130 ( -6.443 19.929 -6.290) 21.869 9.579 ( 13.049 -11.198 0.182) 17.196 10.055 ( -2.965 3.991 4.073) 6.427 11.484 ( 3.970 -6.134 11.609) 13.716 11.824 ( -4.035 1.590 3.242) 5.415 12.134 ( -1.221 2.763 -5.218) 6.029 12.493 ( 9.709 4.022 -2.438) 10.788 12.838 ( -22.557 -3.418 3.928) 23.150 13.075 ( -4.472 -4.378 -6.454) 8.990 18.711 ( -3.243 -8.732 -0.294) 9.320 18.890 ( 0.251 1.605 -5.880) 6.100 19.085 ( 3.660 -4.169 3.552) 6.587 19.399 ( -5.513 -2.483 -0.897) 6.113 20.883 ( -2.607 -8.882 4.482) 10.285 21.076 ( -2.866 -7.218 2.064) 8.036 27.631 ( 1.534 2.940 -1.176) 3.518 27.706 ( 0.713 1.876 0.506) 2.070 37.148 ( 14.509 1.352 0.448) 14.578 37.513 ( -1.736 13.874 -4.343) 14.641 38.199 ( 9.306 11.286 8.013) 16.679 39.629 ( 1.842 15.513 -18.990) 24.590 ======================= Grid point 415 (235/371) ======================= q-point: ( 0.62 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.904 ( -2.487 6.420 2.762) 7.418 4.324 ( 8.861 13.727 3.260) 16.660 4.522 ( 11.260 6.451 -2.966) 13.311 6.077 ( -8.252 4.428 7.135) 11.773 6.709 ( 2.102 -9.865 0.534) 10.101 7.095 ( 11.344 -2.735 3.188) 12.096 7.678 ( -8.257 5.302 -11.815) 15.359 7.894 ( -0.338 -6.690 -6.243) 9.156 8.703 ( 11.802 4.138 7.434) 14.549 9.198 ( -2.739 16.268 -2.573) 16.696 9.695 ( 12.564 -11.048 2.545) 16.923 9.932 ( -14.789 1.319 -1.614) 14.935 11.467 ( 1.610 -15.984 9.774) 18.804 11.747 ( -10.462 1.290 -2.846) 10.919 12.206 ( 5.890 9.737 4.679) 12.305 12.484 ( -20.170 -3.729 4.641) 21.031 12.665 ( 9.577 2.026 -3.742) 10.480 12.984 ( -1.408 -0.046 -3.540) 3.810 18.607 ( -2.521 -3.966 1.860) 5.055 18.846 ( -3.642 1.950 -6.137) 7.398 19.137 ( 5.892 -5.302 2.700) 8.374 19.286 ( -4.526 -2.157 -1.302) 5.180 20.807 ( -1.322 -4.424 2.516) 5.258 20.973 ( -3.094 -5.585 0.714) 6.424 27.676 ( 1.316 2.823 -0.789) 3.213 27.741 ( 0.904 1.559 0.464) 1.861 37.352 ( 4.687 5.059 2.284) 7.265 37.620 ( 7.180 7.064 -7.252) 12.412 38.469 ( 6.227 9.025 7.551) 13.313 39.707 ( 4.515 8.509 -12.232) 15.570 ======================= Grid point 416 (236/371) ======================= q-point: ( 0.69 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.911 ( -4.055 5.620 0.027) 6.930 4.493 ( -1.462 6.080 1.155) 6.359 4.730 ( 10.358 -0.205 -2.180) 10.587 6.009 ( -5.792 -1.060 8.878) 10.654 6.649 ( 0.979 -7.318 -2.177) 7.697 7.295 ( 9.079 1.493 3.091) 9.706 7.562 ( -5.792 9.575 -11.094) 15.758 7.918 ( 12.733 0.102 -6.151) 14.141 8.850 ( -1.468 5.729 0.251) 5.919 9.321 ( 4.559 2.960 5.638) 7.832 9.646 ( -16.775 -0.845 0.606) 16.807 9.792 ( 8.523 -9.091 1.529) 12.554 11.402 ( -2.711 -8.979 4.501) 10.404 11.505 ( -9.867 -5.988 -2.400) 11.789 12.120 ( -17.130 -4.635 1.584) 17.817 12.509 ( 8.928 8.559 9.919) 15.854 12.814 ( 9.248 1.537 -3.115) 9.879 12.952 ( -2.037 1.476 -2.951) 3.877 18.571 ( -1.649 0.535 1.843) 2.530 18.765 ( -3.748 0.458 -2.921) 4.774 19.187 ( 4.694 -7.199 -0.203) 8.596 19.218 ( -0.801 1.375 -0.750) 1.759 20.777 ( -0.704 -1.172 0.773) 1.571 20.882 ( -2.470 -4.201 0.365) 4.887 27.716 ( 0.606 2.587 -0.351) 2.680 27.765 ( 0.560 0.710 0.371) 0.978 37.419 ( -4.034 8.184 0.537) 9.140 37.786 ( 11.441 0.207 -4.502) 12.296 38.620 ( -1.600 8.167 3.199) 8.916 39.831 ( 10.194 2.923 -5.930) 12.150 ======================= Grid point 417 (237/371) ======================= q-point: (-0.23 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.883 ( -6.265 5.109 1.354) 8.196 4.419 ( -11.268 1.284 1.873) 11.494 4.805 ( 4.884 -6.369 -3.567) 8.783 5.999 ( 2.829 -4.057 7.154) 8.697 6.575 ( -0.227 -4.566 -7.663) 8.923 7.383 ( 2.238 -1.987 4.172) 5.134 7.590 ( -6.072 23.013 -7.528) 24.963 8.206 ( 19.143 3.783 -4.344) 19.991 8.793 ( -8.897 2.821 -4.136) 10.209 9.352 ( -0.554 -11.868 4.872) 12.841 9.518 ( -2.247 6.696 8.988) 11.431 9.821 ( 6.113 -10.938 0.842) 12.559 11.085 ( -19.685 0.923 -11.013) 22.575 11.508 ( 9.212 -10.327 11.248) 17.833 11.849 ( -13.239 -3.973 5.948) 15.048 12.712 ( 6.789 -0.413 0.555) 6.824 12.877 ( -3.527 1.745 -2.783) 4.820 13.003 ( 7.738 3.953 0.823) 8.728 18.553 ( -2.450 1.080 -0.375) 2.704 18.748 ( 1.261 2.370 1.405) 3.030 19.171 ( 2.898 -4.224 -1.619) 5.372 19.253 ( 2.285 -0.018 -0.954) 2.477 20.741 ( -3.490 -0.246 -0.396) 3.521 20.843 ( 1.294 -2.098 0.778) 2.585 27.731 ( -1.058 1.565 -0.022) 1.889 27.780 ( 0.497 0.252 0.171) 0.583 37.400 ( -6.577 6.568 -0.264) 9.299 37.922 ( 7.764 -1.870 -1.386) 8.105 38.601 ( -9.740 7.128 -1.293) 12.139 40.028 ( 14.601 0.187 -3.364) 14.984 ======================= Grid point 418 (238/371) ======================= q-point: (-0.15 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.786 ( -13.007 0.934 5.898) 14.312 4.237 ( -14.499 4.540 3.979) 15.705 4.766 ( 1.559 -7.103 -3.083) 7.898 6.083 ( 9.909 -7.456 2.542) 12.659 6.484 ( -1.923 -0.399 -10.080) 10.269 7.435 ( -0.923 6.298 0.546) 6.389 7.668 ( -4.291 17.574 -0.619) 18.101 8.393 ( -7.002 5.753 2.109) 9.304 8.601 ( -1.125 -9.033 -10.137) 13.624 9.295 ( 0.941 -7.402 4.158) 8.541 9.602 ( -1.021 4.586 3.694) 5.976 9.824 ( 5.310 -10.603 4.106) 12.549 10.853 ( -4.239 6.302 -2.526) 8.004 11.654 ( 10.979 -6.317 8.539) 15.276 11.677 ( -6.731 -4.526 7.914) 11.332 12.719 ( 0.958 -7.044 -6.520) 9.646 12.826 ( -5.798 5.120 0.480) 7.750 13.149 ( 6.475 0.300 -0.638) 6.513 18.528 ( 0.002 -0.620 0.019) 0.621 18.840 ( 4.487 3.191 2.072) 5.883 19.204 ( 5.228 -0.541 -1.800) 5.555 19.265 ( 0.515 -0.558 -2.101) 2.234 20.675 ( -3.963 0.225 0.694) 4.029 20.873 ( 3.046 -0.591 0.554) 3.152 27.717 ( -1.688 0.447 0.307) 1.773 27.780 ( -0.777 -0.083 -0.359) 0.860 37.333 ( -7.526 3.782 0.551) 8.441 37.983 ( 2.422 -2.176 -0.094) 3.257 38.445 ( -15.198 6.470 -3.084) 16.803 40.245 ( 14.400 -0.670 -6.001) 15.615 ======================= Grid point 423 (239/371) ======================= q-point: ( 0.23 0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.128 ( -14.385 14.896 18.122) 27.518 3.183 ( -15.118 27.113 9.214) 32.382 4.472 ( -13.748 10.604 -7.489) 18.909 6.204 ( 9.323 0.721 3.731) 10.067 6.790 ( 5.759 -6.973 11.801) 14.868 7.280 ( -28.293 -0.007 -11.824) 30.665 7.824 ( -4.349 1.860 1.915) 5.103 8.074 ( 5.742 3.976 7.436) 10.202 8.507 ( -4.683 14.450 -2.159) 15.343 8.991 ( 4.385 1.225 -9.233) 10.294 9.374 ( -1.563 -17.922 -5.207) 18.728 9.924 ( -3.714 -6.288 8.459) 11.176 11.162 ( -7.480 2.610 9.399) 12.293 11.857 ( 5.852 12.415 3.160) 14.085 12.116 ( 2.232 -1.198 -4.134) 4.848 12.511 ( 15.594 -8.343 5.675) 18.574 12.720 ( -5.913 1.868 -2.933) 6.860 13.321 ( 10.111 -2.313 -4.538) 11.321 18.593 ( 8.565 -1.359 0.412) 8.682 18.993 ( 1.386 -8.438 -0.351) 8.558 19.269 ( 6.384 -0.224 -1.787) 6.633 19.468 ( -5.069 -2.121 -2.508) 6.040 20.990 ( 7.612 -8.456 6.480) 13.093 21.170 ( 5.396 -6.211 4.767) 9.509 27.550 ( -2.429 1.132 -0.415) 2.712 27.711 ( 0.161 2.200 -0.441) 2.249 36.990 ( -2.239 7.190 -5.384) 9.257 37.391 ( -15.316 -1.132 7.635) 17.151 38.456 ( -13.682 19.341 1.309) 23.728 39.370 ( -12.982 13.438 -32.526) 37.511 ======================= Grid point 424 (240/371) ======================= q-point: ( 0.31 0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.205 ( -8.157 19.017 18.190) 27.551 3.412 ( -0.057 30.181 11.994) 32.477 4.341 ( -8.186 8.792 -7.146) 13.978 6.378 ( 5.843 2.291 2.197) 6.649 6.752 ( -23.733 1.159 -11.727) 26.497 6.873 ( 4.763 -7.407 13.233) 15.895 7.744 ( -12.194 6.310 5.407) 14.756 8.211 ( 8.161 -7.894 -1.533) 11.457 8.512 ( -6.793 -0.125 -0.870) 6.849 8.938 ( 3.037 8.744 -10.703) 14.150 9.409 ( 5.509 9.280 2.283) 11.031 9.792 ( -7.266 -11.095 7.300) 15.139 11.162 ( -1.461 3.084 8.416) 9.081 12.012 ( -7.545 -3.043 -3.947) 9.042 12.030 ( 3.367 5.427 3.786) 7.424 12.517 ( -9.204 2.660 1.477) 9.694 12.906 ( 23.488 -4.808 -3.771) 24.270 13.438 ( 9.871 -2.544 -5.117) 11.405 18.699 ( 5.520 -4.977 1.246) 7.537 18.941 ( 2.407 -3.855 -2.812) 5.344 19.287 ( -5.050 -6.075 0.775) 7.938 19.403 ( 5.159 -1.197 -2.287) 5.769 21.035 ( 5.423 -11.866 6.297) 14.487 21.202 ( 3.857 -8.434 4.959) 10.516 27.533 ( -1.259 1.840 -0.008) 2.229 27.727 ( -0.515 2.266 -0.807) 2.460 36.984 ( -8.885 6.428 0.017) 10.966 37.219 ( -5.356 5.464 0.223) 7.654 38.328 ( -21.000 14.325 2.993) 25.596 39.299 ( 0.515 24.560 -30.059) 38.820 ======================= Grid point 425 (241/371) ======================= q-point: ( 0.38 0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.386 ( -2.994 19.039 15.331) 24.627 3.717 ( -1.763 22.922 6.480) 23.885 4.314 ( 0.903 4.568 -8.018) 9.272 6.316 ( -7.200 5.754 -11.342) 14.615 6.590 ( -4.142 2.156 9.161) 10.282 6.987 ( 5.255 -0.825 13.896) 14.880 7.617 ( -11.469 4.288 8.137) 14.702 8.185 ( 2.113 -8.456 -6.834) 11.076 8.379 ( 1.429 -6.933 -8.506) 11.067 9.154 ( 6.612 19.545 -6.343) 21.586 9.482 ( -11.882 -2.252 2.331) 12.316 9.713 ( 5.353 5.014 10.966) 13.193 11.251 ( 4.630 -0.297 8.098) 9.332 11.846 ( -4.843 -5.585 0.524) 7.411 12.117 ( 1.374 0.457 3.979) 4.234 12.425 ( -8.149 10.368 -3.937) 13.763 13.124 ( 12.511 -6.607 -6.446) 15.548 13.508 ( 4.820 -4.804 -6.598) 9.479 18.687 ( 2.640 -9.438 1.371) 9.896 18.958 ( 2.021 -2.465 -4.676) 5.659 19.137 ( -4.947 -3.817 1.883) 6.526 19.472 ( 4.755 -2.193 -0.787) 5.296 21.011 ( 2.332 -13.005 5.900) 14.469 21.189 ( 1.653 -8.985 4.346) 10.117 27.543 ( 0.078 2.429 0.042) 2.430 27.727 ( -1.375 1.988 -0.842) 2.560 36.846 ( -9.850 3.770 1.607) 10.668 37.338 ( 5.701 12.515 -0.654) 13.768 38.155 ( -17.274 14.530 2.691) 22.732 39.441 ( 4.056 24.325 -25.246) 35.292 ======================= Grid point 426 (242/371) ======================= q-point: ( 0.46 0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.598 ( 1.975 13.964 8.265) 16.346 3.889 ( -1.471 17.219 5.091) 18.016 4.306 ( 1.597 -0.179 -11.792) 11.901 6.332 ( 0.605 12.641 -2.696) 12.939 6.552 ( -5.101 -2.685 6.816) 8.926 7.078 ( -5.503 0.515 15.534) 16.488 7.682 ( 8.823 8.679 9.889) 15.842 8.075 ( -0.778 -8.312 -8.513) 11.924 8.323 ( -0.604 -0.891 -8.736) 8.803 9.202 ( -1.572 -15.355 -4.572) 16.098 9.405 ( -3.031 22.745 -4.137) 23.316 9.967 ( 5.505 11.276 12.412) 17.650 11.346 ( 5.269 -8.003 9.722) 13.650 11.797 ( 2.908 -4.475 4.408) 6.922 12.131 ( -0.922 1.346 -0.002) 1.631 12.412 ( -3.844 12.833 -6.669) 14.964 13.146 ( 2.730 -5.877 -7.478) 9.895 13.398 ( -7.203 -7.706 -5.244) 11.780 18.660 ( 4.591 -8.659 -2.451) 10.103 18.862 ( -2.659 -8.999 1.323) 9.476 19.114 ( -1.041 3.686 -0.835) 3.920 19.495 ( 0.882 -2.637 -0.107) 2.782 20.938 ( -0.237 -11.558 5.105) 12.637 21.135 ( -0.411 -8.423 3.071) 8.975 27.579 ( 1.214 2.902 -0.273) 3.158 27.717 ( -1.311 1.687 -0.524) 2.200 36.812 ( 0.962 3.882 0.240) 4.007 37.558 ( 4.510 12.000 3.551) 13.302 38.094 ( -7.770 14.927 1.524) 16.897 39.587 ( 2.330 20.079 -20.434) 28.742 ======================= Grid point 427 (243/371) ======================= q-point: ( 0.54 0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.798 ( 7.323 5.687 3.338) 9.854 4.062 ( 2.759 12.246 3.028) 12.913 4.305 ( 3.602 5.215 -7.193) 9.587 6.435 ( -12.263 15.017 10.312) 21.959 6.481 ( 7.421 -7.424 -7.398) 12.842 7.039 ( -5.783 -2.988 15.249) 16.580 7.902 ( -2.464 -6.954 -8.121) 10.971 8.082 ( 10.096 12.555 9.988) 18.956 8.205 ( -4.167 0.082 -7.161) 8.286 9.112 ( 11.312 -12.693 -5.995) 18.028 9.507 ( -5.334 17.700 -4.227) 18.963 10.163 ( -0.114 7.675 6.815) 10.265 11.373 ( 4.486 -14.948 11.035) 19.114 11.844 ( 3.299 -4.325 5.897) 8.023 12.152 ( 0.941 6.403 -4.628) 7.956 12.457 ( -0.023 9.959 -6.017) 11.635 13.052 ( -4.291 -4.272 -7.570) 9.693 13.125 ( -13.320 -5.566 -0.262) 14.438 18.615 ( 1.770 -8.452 -4.310) 9.651 18.806 ( 3.687 -6.202 2.319) 7.579 19.113 ( -3.186 3.682 -0.333) 4.880 19.451 ( -3.180 -2.475 0.265) 4.039 20.852 ( -1.167 -8.540 3.898) 9.460 21.056 ( -1.718 -6.965 1.580) 7.345 27.628 ( 1.518 2.978 -0.698) 3.415 27.718 ( -0.071 1.477 -0.041) 1.480 36.940 ( 10.374 2.658 -0.713) 10.733 37.697 ( -3.090 10.749 3.890) 11.842 38.216 ( 4.836 12.412 3.113) 13.679 39.678 ( -0.291 15.422 -15.106) 21.590 ======================= Grid point 428 (244/371) ======================= q-point: ( 0.62 0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.934 ( 4.367 0.413 0.697) 4.441 4.282 ( 10.132 10.695 0.605) 14.745 4.433 ( 6.197 5.622 -0.182) 8.369 6.332 ( -8.840 -3.006 6.611) 11.441 6.558 ( 2.071 6.987 -6.229) 9.587 7.020 ( -0.023 -4.761 13.827) 14.624 7.731 ( -4.367 -5.474 -9.153) 11.524 7.994 ( -12.634 10.149 -6.051) 17.298 8.512 ( 17.862 1.298 8.475) 19.813 9.228 ( 14.471 -5.026 -5.130) 16.156 9.533 ( -4.762 9.940 -2.548) 11.312 10.148 ( -9.699 2.925 -0.606) 10.149 11.309 ( 2.652 -21.032 10.438) 23.629 11.863 ( -1.608 -1.948 1.431) 2.903 12.235 ( 2.252 9.167 -0.952) 9.488 12.538 ( 4.742 5.016 -5.079) 8.569 12.769 ( -16.589 -5.744 1.251) 17.600 13.011 ( -2.556 2.807 -3.547) 5.195 18.553 ( 1.716 -6.615 -0.604) 6.861 18.839 ( 3.986 -2.019 -3.809) 5.872 19.083 ( -3.082 0.655 2.441) 3.985 19.360 ( -5.384 -1.378 0.468) 5.578 20.789 ( -0.540 -5.114 2.488) 5.712 20.970 ( -2.340 -5.062 0.416) 5.592 27.674 ( 1.423 2.390 -0.549) 2.835 27.740 ( 0.942 1.418 -0.000) 1.702 37.165 ( 14.914 1.144 -1.096) 14.998 37.726 ( -5.732 9.425 1.071) 11.083 38.463 ( 9.070 8.614 5.925) 13.841 39.719 ( -1.592 10.886 -9.768) 14.712 ======================= Grid point 429 (245/371) ======================= q-point: ( 0.69 0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.988 ( 0.836 2.819 0.015) 2.940 4.502 ( 5.951 4.131 -2.371) 7.622 4.580 ( 7.449 0.052 2.931) 8.005 6.174 ( -9.373 -5.648 6.426) 12.691 6.578 ( -1.292 3.025 -6.500) 7.285 7.149 ( 11.290 -0.718 11.521) 16.147 7.599 ( -0.923 -0.550 -8.931) 8.995 7.936 ( -6.463 16.303 -4.148) 18.021 8.781 ( 12.161 -3.429 5.237) 13.677 9.351 ( 3.110 0.410 -4.302) 5.324 9.532 ( 2.627 -3.694 -0.236) 4.539 9.936 ( -14.661 0.889 -3.327) 15.060 11.247 ( 6.357 -17.003 11.405) 21.438 11.727 ( -13.944 0.820 -3.469) 14.393 12.253 ( -5.204 -5.011 -9.901) 12.256 12.550 ( -4.321 0.293 11.691) 12.467 12.688 ( 7.661 5.669 -1.125) 9.597 13.002 ( -1.855 5.546 -3.568) 6.851 18.546 ( 3.026 -4.128 1.631) 5.372 18.825 ( -2.671 2.216 -6.306) 7.197 19.071 ( 1.575 -3.715 3.422) 5.291 19.277 ( -4.204 0.848 0.504) 4.318 20.765 ( 0.589 -2.260 1.206) 2.629 20.891 ( -2.720 -3.332 -0.152) 4.304 27.716 ( 1.706 1.516 -0.026) 2.282 27.765 ( 0.420 1.127 -0.242) 1.226 37.405 ( 12.974 0.622 -0.711) 13.008 37.717 ( -3.802 5.993 -0.835) 7.146 38.695 ( 5.614 7.204 5.459) 10.640 39.748 ( 0.673 6.200 -4.994) 7.990 ======================= Grid point 430 (246/371) ======================= q-point: (-0.23 0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.014 ( -2.283 4.315 0.655) 4.925 4.542 ( -1.150 0.553 -1.863) 2.258 4.656 ( 4.182 -6.100 0.547) 7.416 6.012 ( -6.339 -6.850 6.092) 11.145 6.531 ( -1.940 1.576 -7.864) 8.251 7.357 ( 4.061 -0.479 8.855) 9.754 7.724 ( 15.766 12.896 -6.707) 21.444 8.021 ( -0.760 15.731 -1.275) 15.801 8.891 ( 1.348 -2.379 0.509) 2.782 9.259 ( -3.917 -9.659 -0.496) 10.435 9.526 ( 4.828 -12.419 0.979) 13.361 9.764 ( -6.965 4.324 -1.089) 8.270 11.320 ( 9.845 -9.414 10.037) 16.920 11.404 ( -22.384 3.081 -7.384) 23.771 12.027 ( -8.263 -6.821 -1.404) 10.806 12.567 ( 2.764 -5.474 0.529) 6.155 12.888 ( 7.639 5.168 3.753) 9.957 13.005 ( -2.648 6.298 -3.005) 7.464 18.573 ( 1.930 -1.998 1.201) 3.026 18.763 ( -3.138 2.216 -2.511) 4.589 19.084 ( 2.737 -3.341 0.819) 4.396 19.255 ( -0.961 2.483 0.123) 2.665 20.773 ( 0.667 0.082 0.163) 0.691 20.820 ( -2.162 -2.515 0.025) 3.317 27.754 ( 1.468 0.637 0.200) 1.612 27.769 ( -0.636 0.505 -0.242) 0.847 37.532 ( -0.699 2.650 0.530) 2.792 37.751 ( 6.826 -0.401 -1.873) 7.090 38.805 ( -3.812 7.799 2.365) 8.997 39.832 ( 7.374 2.371 -1.814) 7.955 ======================= Grid point 431 (247/371) ======================= q-point: (-0.15 0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.984 ( -6.483 1.683 1.724) 6.916 4.488 ( -6.882 3.383 0.996) 7.733 4.654 ( 3.524 -4.694 0.461) 5.888 5.921 ( 0.852 -8.130 3.064) 8.730 6.477 ( -1.765 2.517 -7.688) 8.279 7.454 ( 3.669 3.602 5.325) 7.402 7.971 ( -9.016 21.605 -4.899) 23.918 8.238 ( 18.214 0.666 -1.868) 18.321 8.726 ( -14.128 -2.701 -3.824) 14.883 9.200 ( 3.989 -8.952 5.944) 11.463 9.508 ( 11.191 -17.175 1.840) 20.582 9.721 ( -4.111 3.731 0.398) 5.566 11.057 ( -15.869 4.391 -4.758) 17.139 11.489 ( 10.048 -1.432 6.523) 12.065 11.853 ( -9.244 -3.602 6.496) 11.859 12.535 ( 3.942 -9.231 -5.989) 11.688 12.978 ( -5.113 6.414 -0.253) 8.207 13.051 ( 5.761 -0.197 0.271) 5.770 18.556 ( -2.641 -0.282 -0.033) 2.656 18.769 ( 3.592 -2.019 0.808) 4.200 19.128 ( 4.366 1.143 -0.193) 4.517 19.270 ( -0.570 2.878 -1.226) 3.180 20.745 ( -3.709 0.747 0.234) 3.791 20.817 ( 3.001 -1.210 0.208) 3.242 27.753 ( -1.649 0.245 -0.038) 1.668 27.773 ( 0.634 -0.575 0.024) 0.856 37.481 ( -6.647 1.044 1.441) 6.881 37.861 ( 7.917 -2.752 -2.008) 8.619 38.748 ( -12.413 8.375 0.186) 14.975 40.002 ( 11.852 1.059 -2.606) 12.182 ======================= Grid point 436 (248/371) ======================= q-point: ( 0.23 0.54 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.568 ( -14.936 11.624 9.358) 21.113 3.705 ( -15.590 20.919 4.619) 26.495 4.733 ( -13.374 6.934 -10.312) 18.256 6.013 ( 12.736 -3.360 3.115) 13.535 6.753 ( 2.068 -2.017 13.781) 14.081 7.506 ( -8.946 -3.158 -12.841) 15.965 7.762 ( 1.170 -4.982 -2.556) 5.720 8.258 ( -11.343 -0.923 3.732) 11.976 8.636 ( 3.855 9.757 -5.243) 11.728 8.915 ( 9.747 11.401 1.601) 15.085 9.219 ( -7.626 -13.133 -5.039) 16.001 9.932 ( 0.622 -7.714 8.854) 11.759 11.453 ( -12.357 6.830 12.957) 19.163 11.840 ( 12.157 4.038 -0.731) 12.831 11.963 ( 5.066 -0.205 8.521) 9.915 12.288 ( 7.276 -4.507 -5.098) 9.962 12.819 ( -6.038 -2.306 -1.098) 6.556 13.149 ( 6.691 -0.300 -2.681) 7.214 18.475 ( 5.794 1.468 0.121) 5.978 18.855 ( 5.918 -7.743 0.156) 9.746 19.207 ( -0.303 0.649 -2.000) 2.124 19.506 ( -3.210 -2.882 -2.039) 4.772 20.855 ( 4.790 -4.451 3.613) 7.471 21.049 ( 5.013 -5.127 2.073) 7.464 27.602 ( -2.646 1.501 -0.157) 3.046 27.725 ( 0.406 1.909 -0.233) 1.965 37.057 ( -1.127 6.859 -5.377) 8.788 37.662 ( -13.302 -0.732 8.783) 15.957 38.739 ( -1.712 15.188 -7.867) 17.190 39.572 ( -18.031 5.922 -16.020) 24.836 ======================= Grid point 437 (249/371) ======================= q-point: ( 0.31 0.54 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.557 ( -7.576 13.211 12.508) 19.707 3.795 ( -6.143 26.736 7.260) 28.377 4.536 ( -12.075 5.939 -8.843) 16.102 6.234 ( 13.873 -1.826 4.993) 14.857 6.840 ( 2.494 -2.569 14.048) 14.497 7.008 ( -23.688 -5.935 -19.404) 31.191 7.896 ( 8.344 -1.594 1.113) 8.567 8.083 ( -5.189 -4.332 -4.767) 8.271 8.611 ( -13.250 -8.766 2.982) 16.164 9.011 ( 0.042 18.979 -5.192) 19.677 9.333 ( 15.798 11.140 2.126) 19.447 9.849 ( -5.725 -9.937 7.230) 13.557 11.365 ( -12.158 4.929 11.047) 17.151 11.960 ( 1.435 -6.408 -1.178) 6.671 12.091 ( 3.785 1.606 4.033) 5.760 12.456 ( 19.358 -0.321 0.758) 19.376 12.690 ( -5.960 -0.486 -2.610) 6.525 13.240 ( 7.992 -1.813 -4.921) 9.559 18.590 ( 5.314 -0.179 1.241) 5.460 18.845 ( 2.675 -5.388 -2.069) 6.361 19.234 ( 4.139 -2.588 -0.220) 4.887 19.386 ( -5.062 -3.800 -1.851) 6.595 20.895 ( 4.074 -6.878 3.801) 8.852 21.081 ( 4.395 -6.746 2.241) 8.358 27.581 ( -2.171 2.295 0.223) 3.167 27.749 ( 0.151 2.244 -0.692) 2.353 37.123 ( 0.615 11.589 -2.943) 11.973 37.440 ( -16.026 -0.604 4.512) 16.660 38.749 ( -12.183 11.717 -1.776) 16.996 39.362 ( -4.900 13.881 -19.117) 24.128 ======================= Grid point 438 (250/371) ======================= q-point: ( 0.38 0.54 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.653 ( -3.631 11.156 11.188) 16.212 4.008 ( -3.407 22.186 5.661) 23.149 4.374 ( -8.405 5.215 -7.710) 12.541 6.382 ( -1.211 0.711 -4.374) 4.594 6.634 ( -3.453 -3.616 -0.815) 5.066 6.952 ( 6.313 0.098 11.398) 13.030 7.948 ( -7.039 5.357 1.122) 8.917 7.988 ( 6.083 -8.298 -7.712) 12.859 8.286 ( -11.537 -8.756 -0.607) 14.496 9.245 ( 3.447 22.512 -5.666) 23.469 9.641 ( -9.676 -11.250 5.358) 15.776 9.721 ( 11.537 15.183 7.676) 20.555 11.276 ( -5.680 -3.245 8.174) 10.469 11.848 ( -3.622 -8.870 2.771) 9.974 12.157 ( -0.167 2.997 2.882) 4.162 12.597 ( -5.699 5.502 -4.669) 9.195 12.781 ( 19.158 -2.810 -2.697) 19.550 13.315 ( 7.968 -4.405 -6.703) 11.306 18.601 ( -0.347 -6.682 2.461) 7.129 18.870 ( 4.303 -0.200 -5.154) 6.717 19.184 ( -4.436 -5.924 2.528) 7.821 19.362 ( 5.223 -1.123 -1.631) 5.586 20.896 ( 2.407 -8.201 3.722) 9.322 21.088 ( 3.142 -7.477 2.176) 8.397 27.578 ( -1.234 2.761 0.394) 3.050 27.760 ( -0.787 1.977 -0.935) 2.324 37.109 ( -15.333 4.078 2.991) 16.146 37.361 ( 4.070 10.818 -1.270) 11.627 38.575 ( -17.957 9.049 0.758) 20.123 39.447 ( 5.121 17.996 -17.481) 25.606 ======================= Grid point 439 (251/371) ======================= q-point: ( 0.46 0.54 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.727 ( -2.139 4.843 4.862) 7.188 4.103 ( -5.836 12.859 -0.116) 14.122 4.300 ( -3.818 6.929 -3.234) 8.547 6.317 ( 0.218 2.981 -8.648) 9.150 6.654 ( 0.098 -3.269 13.026) 13.430 7.183 ( 9.836 3.733 10.485) 14.853 7.806 ( -10.820 2.774 -0.327) 11.175 7.974 ( -1.375 -1.343 -0.352) 1.954 8.193 ( 8.331 -1.450 -7.499) 11.302 9.213 ( -14.816 -7.490 -3.374) 16.941 9.592 ( 1.943 15.704 -2.251) 15.983 10.058 ( 6.497 14.213 9.591) 18.336 11.210 ( 2.582 -14.017 8.064) 16.376 11.765 ( -1.446 -4.152 6.067) 7.493 12.170 ( -1.463 1.973 -0.948) 2.633 12.556 ( -4.045 9.046 -6.998) 12.131 12.968 ( 9.554 -2.405 -5.179) 11.130 13.319 ( 2.846 -7.819 -6.238) 10.400 18.538 ( 0.466 -6.772 0.248) 6.792 18.835 ( -2.613 -6.094 -1.630) 6.828 19.141 ( 0.662 1.875 0.502) 2.051 19.427 ( 4.336 -2.091 -0.057) 4.814 20.861 ( 0.696 -8.148 3.388) 8.852 21.065 ( 1.363 -7.272 1.745) 7.602 27.597 ( -0.022 3.003 0.266) 3.015 27.752 ( -1.477 1.428 -0.883) 2.236 36.931 ( -10.023 3.359 1.461) 10.672 37.582 ( 7.252 11.586 3.377) 14.080 38.399 ( -13.504 9.174 -0.366) 16.329 39.618 ( 4.463 17.083 -13.367) 22.145 ======================= Grid point 440 (252/371) ======================= q-point: ( 0.54 0.54 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.751 ( 2.406 -0.095 0.581) 2.477 4.120 ( -1.177 8.251 -4.155) 9.313 4.345 ( -0.876 8.674 3.912) 9.556 6.307 ( 2.693 -3.690 -8.562) 9.704 6.708 ( -1.756 3.124 14.115) 14.563 7.277 ( -9.891 2.723 11.560) 15.456 7.759 ( 5.557 -6.112 -9.133) 12.314 7.996 ( 4.432 5.658 6.093) 9.422 8.348 ( 5.108 10.914 -3.583) 12.572 8.866 ( -7.947 -13.445 -5.064) 16.419 9.731 ( -2.653 15.976 -4.853) 16.907 10.273 ( 0.648 9.264 5.669) 10.880 11.176 ( 6.109 -19.599 9.420) 22.587 11.762 ( 1.879 -5.446 5.637) 8.060 12.173 ( 0.950 5.569 -4.873) 7.461 12.557 ( -2.802 9.885 -6.736) 12.285 13.013 ( 1.554 -0.468 -5.376) 5.615 13.197 ( -4.589 -8.216 -3.587) 10.071 18.496 ( 1.649 -5.157 -2.670) 6.037 18.732 ( -0.845 -7.033 2.084) 7.384 19.182 ( -0.401 4.358 -0.655) 4.425 19.450 ( 0.756 -2.373 0.808) 2.618 20.808 ( -0.325 -6.914 2.816) 7.473 21.017 ( -0.269 -6.043 0.952) 6.124 27.634 ( 0.907 2.928 -0.089) 3.067 27.736 ( -1.022 0.914 -0.583) 1.490 36.883 ( -0.184 3.027 0.701) 3.113 37.803 ( 3.977 7.410 7.881) 11.525 38.324 ( -4.638 9.316 -2.745) 10.763 39.758 ( 0.922 15.216 -8.494) 17.450 ======================= Grid point 441 (253/371) ======================= q-point: ( 0.62 0.54 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.832 ( 6.668 -0.825 1.716) 6.934 4.216 ( 6.139 8.357 -3.317) 10.887 4.436 ( 1.334 3.741 5.152) 6.506 6.245 ( 1.641 -6.451 -8.708) 10.961 6.778 ( -4.117 6.104 11.867) 13.965 7.151 ( -11.920 0.045 10.660) 15.992 7.684 ( -0.888 -4.397 -9.900) 10.869 8.219 ( 9.070 1.876 3.469) 9.891 8.362 ( -8.841 8.278 -1.316) 12.183 8.855 ( 17.702 -4.320 -2.365) 18.374 9.755 ( -7.235 12.586 -5.286) 15.450 10.297 ( -6.172 3.081 -1.785) 7.126 11.097 ( 3.799 -24.235 9.273) 26.225 11.770 ( 4.601 -7.986 1.074) 9.279 12.281 ( 3.832 11.197 -2.605) 12.118 12.568 ( -2.441 8.016 -5.019) 9.768 12.917 ( -9.162 -6.001 -1.538) 11.060 13.067 ( -2.495 2.221 -3.453) 4.804 18.464 ( 1.445 -4.112 -1.804) 4.717 18.716 ( 4.355 -4.469 0.300) 6.248 19.187 ( -3.895 3.973 0.462) 5.583 19.417 ( -2.728 -1.908 1.209) 3.542 20.759 ( -0.176 -4.940 1.988) 5.328 20.958 ( -1.287 -4.076 0.117) 4.276 27.672 ( 0.906 1.769 -0.254) 2.004 27.739 ( 0.576 1.167 -0.373) 1.354 36.978 ( 8.427 1.687 0.055) 8.595 37.896 ( -3.737 3.980 7.124) 8.975 38.413 ( 6.852 6.972 -1.271) 9.858 39.843 ( -3.104 13.182 -3.592) 14.010 ======================= Grid point 442 (254/371) ======================= q-point: (-0.31 -0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.938 ( 5.737 -0.833 1.158) 5.912 4.397 ( 7.923 4.032 -2.834) 9.330 4.511 ( 3.689 -1.280 5.056) 6.389 6.165 ( 0.333 -4.982 -6.987) 8.588 6.767 ( -11.407 5.846 6.105) 14.198 7.083 ( 1.470 -2.638 12.264) 12.631 7.582 ( -2.538 0.094 -8.763) 9.124 8.234 ( -9.834 17.255 1.041) 19.888 8.487 ( 17.465 -10.354 1.023) 20.329 9.110 ( 13.888 -0.913 -0.613) 13.932 9.687 ( -10.126 8.667 -5.083) 14.265 10.114 ( -12.104 -2.999 -7.490) 14.546 11.018 ( 7.750 -19.504 11.023) 23.706 11.758 ( 3.853 -8.663 -3.348) 10.054 12.311 ( -11.906 5.021 -10.301) 16.525 12.632 ( 4.461 4.643 4.813) 8.039 12.712 ( -7.003 -1.683 1.710) 7.402 13.073 ( -1.340 7.250 -3.324) 8.088 18.457 ( 2.847 -3.719 0.423) 4.703 18.770 ( 5.253 -0.153 -3.514) 6.322 19.139 ( -6.130 1.979 2.701) 6.985 19.353 ( -3.992 -0.533 1.264) 4.221 20.734 ( 0.793 -3.033 1.020) 3.297 20.903 ( -1.955 -1.993 -0.411) 2.822 27.695 ( 1.353 -0.189 0.119) 1.372 27.767 ( 0.972 1.888 -0.552) 2.194 37.169 ( 13.444 0.100 -0.753) 13.466 37.864 ( -6.433 1.969 4.378) 8.027 38.619 ( 11.157 3.669 0.913) 11.780 39.871 ( -6.080 10.856 0.571) 12.456 ======================= Grid point 443 (255/371) ======================= q-point: (-0.23 -0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.004 ( 4.355 -3.208 -1.008) 5.502 4.483 ( 3.063 -1.258 -1.309) 3.561 4.563 ( 3.655 -4.461 0.946) 5.844 6.080 ( -4.394 -2.430 -1.773) 5.325 6.625 ( -10.132 2.447 -0.292) 10.427 7.295 ( 12.607 1.771 14.958) 19.642 7.555 ( 4.562 5.578 -8.037) 10.794 8.298 ( -6.439 18.137 4.734) 19.820 8.657 ( 16.076 -12.673 -0.384) 20.474 9.212 ( 1.593 -5.083 -2.398) 5.842 9.518 ( -12.391 1.229 -5.295) 13.531 9.881 ( -6.500 -2.606 -3.803) 7.969 11.108 ( 11.978 -8.636 9.477) 17.546 11.684 ( -4.839 -3.681 -4.374) 7.489 11.979 ( -13.608 -6.549 -14.225) 20.746 12.609 ( -5.683 -2.038 7.307) 9.478 12.824 ( 6.848 4.368 1.935) 8.350 13.104 ( -2.352 8.157 -2.251) 8.783 18.488 ( 4.340 -3.291 0.910) 5.522 18.821 ( 0.232 4.282 -4.856) 6.478 19.074 ( -3.705 -0.784 4.169) 5.633 19.308 ( -2.440 1.353 0.981) 2.957 20.736 ( 1.877 -1.965 0.179) 2.723 20.853 ( -2.623 -0.138 -0.509) 2.676 27.716 ( 1.967 -1.551 0.320) 2.525 27.790 ( -0.029 1.784 -0.476) 1.847 37.385 ( 13.691 -1.188 -1.845) 13.865 37.785 ( -6.069 -0.752 3.856) 7.229 38.822 ( 8.872 2.883 -0.286) 9.333 39.871 ( -5.391 8.290 3.582) 10.518 ======================= Grid point 444 (256/371) ======================= q-point: (-0.15 -0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.004 ( 2.266 -5.921 -3.028) 7.025 4.447 ( 2.148 -10.395 -1.556) 10.728 4.635 ( 4.098 6.233 1.359) 7.583 5.957 ( -7.924 -1.665 2.656) 8.522 6.517 ( -4.450 2.045 -3.552) 6.050 7.470 ( 2.147 5.180 3.859) 6.807 7.890 ( 23.603 7.735 1.979) 24.917 8.318 ( -11.593 7.006 2.282) 13.737 8.747 ( 8.085 -10.572 0.421) 13.316 9.105 ( -2.185 -2.071 -1.661) 3.439 9.329 ( -6.060 -5.964 -2.439) 8.846 9.800 ( -2.430 -0.761 0.427) 2.582 11.262 ( 1.907 -1.879 1.998) 3.340 11.466 ( -11.479 6.584 -1.081) 13.277 11.773 ( 6.505 -13.382 -11.386) 18.736 12.521 ( -7.479 -1.756 6.372) 9.981 12.949 ( 5.776 -1.240 0.826) 5.965 13.113 ( -4.215 6.521 -1.300) 7.872 18.535 ( 3.735 -2.187 0.211) 4.333 18.785 ( -5.612 1.681 -1.067) 5.955 19.083 ( 2.696 1.605 1.724) 3.580 19.308 ( -0.726 3.032 -0.027) 3.118 20.754 ( 2.511 -2.215 -0.347) 3.367 20.812 ( -2.831 1.832 -0.155) 3.376 27.729 ( 1.652 -2.261 0.158) 2.805 27.793 ( -1.100 1.074 -0.088) 1.540 37.524 ( 4.241 -2.095 -2.400) 5.305 37.728 ( 1.201 -3.505 3.978) 5.436 38.922 ( -0.171 3.881 -2.961) 4.885 39.919 ( 0.895 6.324 4.342) 7.724 ======================= Grid point 449 (257/371) ======================= q-point: ( 0.23 0.62 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.863 ( -4.875 6.445 1.863) 8.293 4.109 ( -12.465 12.334 1.445) 17.595 4.900 ( -9.386 0.635 -13.123) 16.147 5.836 ( 6.322 -2.266 5.482) 8.670 6.812 ( -0.762 0.795 14.174) 14.217 7.407 ( 11.627 2.057 -1.395) 11.890 7.737 ( -8.742 -12.123 -14.274) 20.667 8.375 ( 2.060 -1.796 -2.411) 3.644 8.488 ( 1.132 0.885 -5.867) 6.040 8.945 ( 2.761 14.041 -0.833) 14.334 9.370 ( -12.563 -0.305 6.982) 14.376 9.856 ( 5.122 -9.366 11.919) 16.001 11.479 ( 14.571 -2.252 -2.078) 14.890 11.791 ( 6.352 -8.261 0.174) 10.422 11.969 ( -6.888 2.027 7.343) 10.270 12.242 ( -4.649 8.946 6.310) 11.894 12.891 ( -5.815 -0.334 -0.194) 5.828 13.041 ( 5.641 -1.059 -2.197) 6.145 18.437 ( 2.121 3.826 -0.523) 4.405 18.687 ( 6.267 -5.190 0.959) 8.194 19.255 ( -5.273 0.541 -1.798) 5.597 19.491 ( -0.066 -3.526 -1.672) 3.903 20.780 ( 2.848 -1.918 1.145) 3.619 20.941 ( 3.605 -3.814 0.850) 5.316 27.659 ( -2.092 1.857 0.252) 2.809 27.729 ( 0.699 1.019 -0.086) 1.239 37.094 ( 0.482 5.434 -5.049) 7.433 37.884 ( -8.584 -0.309 8.844) 12.329 38.734 ( 6.335 7.014 -13.976) 16.872 39.894 ( -20.151 5.170 -4.502) 21.285 ======================= Grid point 450 (258/371) ======================= q-point: ( 0.31 0.62 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.835 ( -7.494 9.074 4.228) 12.505 4.132 ( -4.919 17.732 4.207) 18.876 4.713 ( -8.882 1.891 -8.060) 12.142 6.007 ( 13.131 -2.304 6.770) 14.952 6.873 ( -0.430 -1.684 11.889) 12.015 7.224 ( -18.339 -4.418 -17.581) 25.786 7.691 ( 10.006 -3.148 -2.676) 10.825 8.092 ( -11.894 -7.860 -8.040) 16.367 8.702 ( 5.675 2.322 1.348) 6.278 9.199 ( 11.663 12.138 4.997) 17.559 9.219 ( -7.888 9.824 -0.354) 12.604 9.850 ( -1.197 -10.226 8.900) 13.609 11.668 ( -5.026 2.944 5.850) 8.255 11.796 ( 5.293 -5.404 -2.428) 7.945 11.940 ( 11.232 -10.294 7.167) 16.837 12.323 ( 1.164 7.801 3.850) 8.777 12.783 ( -6.602 1.705 -1.653) 7.016 13.099 ( 5.028 -1.961 -4.233) 6.859 18.539 ( 4.407 4.696 0.387) 6.451 18.726 ( 4.321 -5.884 0.144) 7.302 19.184 ( -1.245 -1.596 -1.217) 2.362 19.411 ( -3.565 -4.602 -1.717) 6.070 20.810 ( 2.608 -3.042 1.610) 4.318 20.963 ( 3.849 -5.206 0.795) 6.523 27.645 ( -2.443 2.730 0.554) 3.705 27.754 ( 0.972 1.483 -0.560) 1.859 37.179 ( 3.160 10.760 -3.175) 11.655 37.717 ( -14.888 -1.366 5.140) 15.810 38.853 ( 5.094 8.470 -10.726) 14.585 39.597 ( -17.952 6.886 -4.908) 19.844 ======================= Grid point 451 (259/371) ======================= q-point: ( 0.38 0.62 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.843 ( -4.863 7.041 4.542) 9.688 4.269 ( -2.446 15.967 4.342) 16.727 4.561 ( -9.691 4.909 -3.214) 11.328 6.263 ( 14.163 -2.264 8.772) 16.812 6.709 ( -12.756 -5.570 -16.641) 21.695 6.991 ( -4.839 3.397 11.964) 13.345 7.772 ( 7.683 -5.649 -6.843) 11.738 7.877 ( -0.129 -4.791 -9.862) 10.965 8.611 ( -17.437 1.955 8.157) 19.350 9.342 ( 5.711 17.628 -4.943) 19.178 9.595 ( 15.661 7.458 6.519) 18.530 9.728 ( -4.353 -7.451 5.059) 10.003 11.438 ( -15.254 -10.648 7.100) 19.912 11.824 ( 2.506 -2.646 -1.639) 3.996 12.134 ( 8.369 -2.405 5.601) 10.353 12.473 ( 10.149 0.584 1.975) 10.356 12.722 ( -3.494 7.223 -3.368) 8.702 13.128 ( 5.617 -3.713 -6.829) 9.590 18.596 ( -2.048 -2.606 3.951) 5.157 18.761 ( 6.099 0.422 -4.833) 7.794 19.168 ( 1.105 -4.925 2.013) 5.434 19.307 ( -1.724 -2.004 -2.399) 3.569 20.820 ( 1.602 -4.208 1.875) 4.877 20.977 ( 3.570 -5.699 0.696) 6.761 27.637 ( -2.226 3.014 0.735) 3.819 27.776 ( 0.305 1.424 -0.903) 1.713 37.354 ( 3.497 13.675 0.694) 14.132 37.458 ( -15.834 -0.678 1.308) 15.903 38.851 ( -8.492 3.493 -5.759) 10.839 39.490 ( -1.959 13.051 -6.028) 14.509 ======================= Grid point 452 (260/371) ======================= q-point: ( 0.46 0.62 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.817 ( -4.923 0.782 0.906) 5.066 4.328 ( -7.386 9.718 0.238) 12.208 4.480 ( -7.331 8.236 3.168) 11.472 6.333 ( -5.089 -0.206 -6.799) 8.495 6.610 ( 9.314 -3.199 6.476) 11.787 7.067 ( 5.553 0.027 8.871) 10.466 7.761 ( 2.506 -3.956 -10.994) 11.950 7.911 ( 10.019 1.353 -5.268) 11.401 8.381 ( -19.264 6.875 8.968) 22.334 9.412 ( -15.972 -5.091 -0.740) 16.780 9.612 ( 8.320 10.155 -2.743) 13.412 10.042 ( 15.821 10.414 4.435) 19.453 11.139 ( -8.079 -18.174 7.992) 21.434 11.821 ( -2.281 0.709 3.460) 4.205 12.180 ( 0.064 -1.787 -1.828) 2.557 12.593 ( 3.241 1.299 -3.386) 4.864 12.809 ( 6.719 6.452 -1.866) 9.500 13.141 ( 5.546 -5.885 -7.051) 10.729 18.519 ( -3.406 -4.442 2.333) 6.064 18.806 ( 0.282 -1.482 -4.003) 4.278 19.139 ( 0.654 -1.608 2.595) 3.122 19.329 ( 5.013 -0.846 -0.976) 5.177 20.803 ( 0.504 -4.934 1.908) 5.314 20.978 ( 2.555 -5.425 0.543) 6.021 27.639 ( -1.384 2.891 0.670) 3.275 27.778 ( -0.827 0.991 -0.997) 1.631 37.183 ( -16.035 1.614 1.577) 16.193 37.592 ( 6.879 12.007 3.100) 14.181 38.655 ( -12.555 1.159 -4.024) 13.235 39.641 ( 4.944 15.221 -4.649) 16.666 ======================= Grid point 453 (261/371) ======================= q-point: ( 0.54 0.62 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.741 ( -2.375 -1.299 -0.328) 2.727 4.267 ( -7.785 7.537 -0.994) 10.881 4.485 ( -4.365 5.957 6.467) 9.817 6.233 ( -1.593 -0.664 -9.157) 9.318 6.763 ( 4.335 -1.311 14.281) 14.982 7.238 ( 13.318 -6.943 3.779) 15.487 7.673 ( -2.976 -1.154 -11.454) 11.890 8.071 ( 2.233 1.870 2.238) 3.673 8.313 ( 0.050 14.447 4.676) 15.185 9.041 ( -20.064 -5.856 -1.627) 20.964 9.807 ( 4.921 9.810 -5.277) 12.177 10.331 ( 6.385 7.798 0.039) 10.079 10.944 ( 1.687 -21.931 9.274) 23.871 11.784 ( -4.903 -2.407 5.609) 7.829 12.157 ( 2.433 2.630 -7.451) 8.268 12.624 ( 0.027 5.461 -5.063) 7.447 12.952 ( 4.932 3.357 -1.507) 6.153 13.113 ( 2.075 -6.456 -5.668) 8.838 18.454 ( -1.395 -2.053 0.169) 2.488 18.718 ( -3.721 -5.080 -0.516) 6.318 19.197 ( 2.846 3.230 0.618) 4.349 19.395 ( 3.937 -1.616 0.622) 4.302 20.767 ( -0.217 -4.980 1.729) 5.276 20.963 ( 1.121 -4.373 0.216) 4.519 27.654 ( -0.212 2.524 0.375) 2.561 27.760 ( -1.434 0.445 -0.848) 1.725 36.997 ( -9.487 2.039 1.511) 9.821 37.824 ( 6.155 7.767 7.458) 12.403 38.466 ( -8.376 1.047 -5.412) 10.027 39.841 ( 3.365 14.976 -1.313) 15.406 ======================= Grid point 454 (262/371) ======================= q-point: (-0.38 -0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.752 ( 3.659 -0.160 2.415) 4.387 4.244 ( -1.517 5.869 -0.740) 6.107 4.500 ( -2.928 1.770 7.558) 8.296 6.159 ( -0.953 -0.507 -9.333) 9.395 6.868 ( 1.094 -1.835 14.458) 14.614 7.346 ( 2.396 -6.359 6.004) 9.068 7.553 ( -0.417 -0.786 -14.312) 14.340 8.068 ( 1.719 -5.086 1.662) 5.621 8.616 ( 9.302 16.223 1.860) 18.793 8.707 ( -13.924 1.366 1.604) 14.083 9.887 ( -0.762 6.591 -6.326) 9.167 10.385 ( -3.022 2.370 -6.451) 7.508 10.828 ( 4.560 -25.465 7.998) 27.078 11.684 ( -3.095 -7.156 1.873) 8.018 12.282 ( 7.490 11.911 -4.011) 14.631 12.647 ( -0.916 6.014 -4.234) 7.411 12.956 ( -3.819 -7.270 -0.493) 8.226 13.081 ( 1.137 4.499 -5.243) 7.002 18.432 ( -0.769 0.408 -0.873) 1.233 18.637 ( 0.379 -4.381 0.461) 4.422 19.262 ( -0.067 3.913 0.864) 4.008 19.422 ( 0.716 -1.798 1.204) 2.279 20.726 ( -0.215 -4.338 1.283) 4.528 20.938 ( -0.109 -2.599 -0.244) 2.613 27.677 ( 0.173 1.305 0.039) 1.317 27.742 ( -0.350 0.578 -0.579) 0.890 36.936 ( -0.952 1.225 1.602) 2.230 37.985 ( 1.261 1.306 10.943) 11.092 38.372 ( 0.464 1.628 -7.469) 7.659 40.005 ( -0.687 14.248 2.402) 14.466 ======================= Grid point 455 (263/371) ======================= q-point: (-0.31 -0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.827 ( 5.178 -4.387 1.007) 6.861 4.326 ( 5.609 3.360 0.007) 6.539 4.502 ( -2.153 -1.065 8.132) 8.479 6.106 ( -0.484 2.230 -8.291) 8.599 6.921 ( -0.054 -3.353 13.445) 13.857 7.223 ( -12.793 -1.258 4.272) 13.546 7.535 ( 4.814 -0.361 -11.928) 12.868 8.090 ( 12.691 -13.499 -2.144) 18.652 8.557 ( -10.608 11.492 6.294) 16.858 8.964 ( 10.853 10.830 2.323) 15.508 9.854 ( -4.962 4.194 -6.410) 9.127 10.196 ( -10.102 -8.256 -13.983) 19.124 10.758 ( 8.106 -16.937 10.475) 21.501 11.585 ( 0.853 -9.531 -3.277) 10.115 12.495 ( 0.073 14.351 -4.084) 14.921 12.655 ( -2.271 3.933 -0.975) 4.645 12.767 ( -5.258 -8.724 -0.233) 10.189 13.136 ( 0.472 7.978 -3.226) 8.618 18.415 ( -0.605 -0.780 0.055) 0.989 18.670 ( 5.489 0.982 -1.194) 5.702 19.267 ( -4.342 2.900 2.296) 5.704 19.401 ( -2.009 -1.223 1.249) 2.663 20.697 ( 0.529 -3.335 0.496) 3.413 20.912 ( -0.954 -0.598 -0.601) 1.277 27.678 ( 0.076 -0.909 0.130) 0.922 27.761 ( 1.344 1.568 -0.576) 2.144 36.999 ( 6.892 -0.320 1.176) 6.999 37.987 ( -5.117 -2.719 8.208) 10.048 38.446 ( 10.284 -0.016 -4.445) 11.204 40.104 ( -5.493 13.152 5.658) 15.335 ======================= Grid point 456 (264/371) ======================= q-point: (-0.23 -0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.827 ( 5.740 -12.253 -3.529) 13.984 4.435 ( 5.651 -7.765 0.082) 9.603 4.486 ( -2.222 3.423 4.931) 6.401 6.109 ( -0.459 6.206 -4.909) 7.926 6.845 ( -13.185 -3.546 5.589) 14.753 7.192 ( 8.835 1.416 12.277) 15.191 7.545 ( 0.940 5.510 -10.270) 11.692 8.200 ( 18.170 -15.674 -3.314) 24.224 8.577 ( -5.952 8.069 11.927) 15.582 9.176 ( 3.323 7.438 -0.814) 8.187 9.727 ( -12.180 1.698 -8.198) 14.780 9.872 ( -4.393 -11.757 -8.747) 15.298 10.883 ( 12.316 -3.928 8.154) 15.284 11.495 ( 3.726 -11.229 -8.091) 14.333 12.282 ( -23.423 3.096 -9.630) 25.513 12.673 ( -0.588 -4.064 7.404) 8.466 12.778 ( 4.465 4.505 -1.845) 6.606 13.203 ( -0.919 8.915 -1.902) 9.162 18.414 ( 1.917 -1.269 0.415) 2.336 18.791 ( 5.536 5.932 -2.660) 8.539 19.202 ( -7.471 0.870 3.940) 8.491 19.361 ( -2.539 0.036 1.185) 2.802 20.686 ( 1.502 -2.595 -0.452) 3.032 20.890 ( -1.647 1.091 -0.684) 2.091 27.674 ( 1.094 -1.972 0.424) 2.294 27.794 ( 1.083 1.310 -0.609) 1.805 37.149 ( 11.842 -1.848 0.039) 11.986 37.890 ( -6.402 -4.858 6.173) 10.134 38.619 ( 13.754 -1.999 -3.373) 14.302 40.134 ( -9.342 11.802 8.140) 17.112 ======================= Grid point 457 (265/371) ======================= q-point: (-0.15 -0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.776 ( 8.408 -16.461 -5.795) 19.372 4.316 ( -0.989 -14.877 -1.160) 14.954 4.613 ( 5.864 7.573 1.435) 9.685 6.112 ( -6.084 6.795 -0.350) 9.128 6.627 ( -9.831 -2.861 1.826) 10.400 7.500 ( 6.112 5.829 6.684) 10.771 7.646 ( 15.507 9.277 0.274) 18.072 8.297 ( 13.063 -16.863 -5.896) 22.131 8.577 ( -3.706 -5.383 11.830) 13.515 9.197 ( -5.446 5.123 -1.830) 7.697 9.482 ( -11.858 4.142 -5.691) 13.789 9.772 ( 1.684 -6.258 -1.036) 6.563 11.125 ( 12.914 2.173 3.683) 13.604 11.418 ( 6.083 -10.782 -11.776) 17.086 11.858 ( -24.605 3.938 -7.690) 26.078 12.645 ( -3.308 -2.845 7.093) 8.328 12.857 ( 3.990 -1.003 -0.639) 4.163 13.233 ( -3.771 6.817 -1.119) 7.870 18.457 ( 3.612 -0.138 0.273) 3.625 18.885 ( -1.600 5.945 -2.918) 6.813 19.117 ( -4.167 0.693 4.634) 6.270 19.345 ( -0.881 1.789 0.645) 2.096 20.689 ( 2.267 -2.453 -1.207) 3.551 20.871 ( -2.169 2.300 -0.475) 3.197 27.680 ( 1.720 -2.411 0.564) 3.015 27.809 ( -0.009 0.476 -0.418) 0.634 37.325 ( 12.264 -2.992 -1.927) 12.770 37.767 ( -5.461 -6.831 6.611) 10.963 38.792 ( 12.019 -2.455 -5.994) 13.653 40.127 ( -9.432 10.937 9.847) 17.480 ======================= Grid point 462 (266/371) ======================= q-point: ( 0.23 -0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.828 ( 11.128 -2.532 -0.223) 11.415 4.323 ( -1.224 5.764 0.345) 5.902 4.908 ( -6.439 -8.444 -15.777) 19.018 5.873 ( -6.466 3.654 6.602) 9.937 6.922 ( -1.321 0.704 15.610) 15.682 7.232 ( 11.876 6.106 -2.417) 13.571 7.631 ( -2.430 -12.647 -14.390) 19.311 8.116 ( 16.444 3.085 -5.280) 17.545 8.739 ( -17.889 5.261 -3.344) 18.944 9.039 ( -1.984 9.351 -1.039) 9.615 9.572 ( -5.691 -1.730 11.154) 12.641 9.725 ( 7.823 -8.498 12.860) 17.286 11.138 ( 16.921 -3.646 -12.114) 21.128 11.516 ( 8.343 -11.434 -0.264) 14.156 12.191 ( -9.754 -0.072 11.871) 15.365 12.508 ( -7.902 8.002 8.330) 13.995 12.899 ( 6.042 -2.703 -5.299) 8.479 13.029 ( -7.007 4.718 2.991) 8.961 18.435 ( 1.327 0.213 -1.112) 1.744 18.620 ( 0.007 3.173 1.697) 3.599 19.342 ( -5.859 -1.156 -2.166) 6.353 19.442 ( 0.801 -2.399 -1.128) 2.769 20.714 ( 3.761 -1.880 -0.550) 4.240 20.889 ( 0.118 -1.239 0.750) 1.453 27.687 ( 0.430 0.353 -0.357) 0.661 27.736 ( -0.355 1.530 0.853) 1.787 37.088 ( 2.563 3.697 -4.496) 6.360 38.014 ( -2.554 -0.764 7.311) 7.782 38.568 ( 9.698 1.650 -12.557) 15.952 40.240 ( -18.362 4.270 -1.902) 18.948 ======================= Grid point 463 (267/371) ======================= q-point: ( 0.31 -0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.951 ( 3.327 2.584 0.019) 4.213 4.337 ( -4.037 9.447 1.563) 10.391 4.732 ( -0.153 -5.208 -8.801) 10.227 5.901 ( 2.593 1.647 7.792) 8.376 6.929 ( -3.661 -6.283 7.866) 10.712 7.295 ( -4.251 0.479 -11.753) 12.507 7.521 ( 5.920 -0.587 -4.828) 7.662 8.330 ( -16.146 2.631 -4.336) 16.923 8.530 ( 11.272 7.059 -2.330) 13.503 9.151 ( 6.416 8.421 -1.705) 10.723 9.457 ( -10.531 -2.673 8.933) 14.066 9.802 ( 2.524 -7.395 10.627) 13.190 11.386 ( 21.460 -1.381 -10.165) 23.786 11.617 ( 14.117 -7.500 4.158) 16.518 11.976 ( -14.388 -12.037 9.482) 21.019 12.520 ( -7.223 9.471 8.247) 14.487 12.905 ( -2.380 2.793 -4.817) 6.055 12.998 ( -0.398 -0.068 -0.156) 0.433 18.500 ( 5.631 2.800 -2.102) 6.631 18.657 ( 0.121 0.750 3.283) 3.370 19.215 ( -5.252 -2.778 -1.905) 6.240 19.400 ( -1.431 -3.944 -1.551) 4.473 20.753 ( 3.006 -1.283 -0.164) 3.273 20.884 ( 1.162 -2.971 0.757) 3.279 27.701 ( -0.303 2.007 -0.007) 2.030 27.749 ( 0.118 1.216 0.307) 1.260 37.192 ( 4.928 8.997 -2.583) 10.578 37.922 ( -9.246 -2.682 2.784) 10.021 38.730 ( 10.567 6.208 -8.039) 14.657 39.941 ( -19.735 2.752 -2.679) 20.105 ======================= Grid point 464 (268/371) ======================= q-point: ( 0.38 0.69 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.984 ( -3.245 4.405 0.243) 5.477 4.413 ( 0.519 8.156 2.722) 8.614 4.673 ( -1.372 0.153 -2.397) 2.766 6.066 ( 11.424 -1.053 9.246) 14.734 6.719 ( -8.582 -12.095 -10.421) 18.126 7.237 ( -7.041 9.562 6.351) 13.467 7.591 ( 5.621 0.843 -9.595) 11.153 7.957 ( -18.759 1.760 -5.302) 19.573 8.804 ( 3.538 4.636 3.198) 6.651 9.336 ( 5.202 2.258 -1.964) 6.002 9.429 ( 11.428 4.974 5.780) 13.738 9.769 ( -4.411 -5.707 6.132) 9.467 11.589 ( -10.945 -14.478 1.506) 18.212 11.619 ( 11.029 -4.670 -7.701) 14.239 11.917 ( 16.805 -3.228 10.602) 20.131 12.523 ( -5.609 5.399 6.985) 10.460 12.856 ( -6.166 7.268 -2.703) 9.908 12.992 ( 3.118 -2.989 -5.431) 6.939 18.630 ( 7.962 1.606 -3.593) 8.882 18.652 ( -3.263 -0.099 4.631) 5.666 19.128 ( -0.819 -2.969 -0.279) 3.092 19.316 ( -3.055 -3.195 -1.896) 4.809 20.779 ( 1.334 -1.225 0.359) 1.846 20.882 ( 2.418 -4.023 0.383) 4.709 27.706 ( -2.049 2.810 0.669) 3.541 27.768 ( 1.128 0.655 -0.552) 1.416 37.377 ( 6.412 11.308 -0.163) 13.000 37.719 ( -13.731 -1.401 0.974) 13.836 38.873 ( 3.233 3.394 -6.500) 8.014 39.690 ( -12.014 6.051 -1.074) 13.494 ======================= Grid point 465 (269/371) ======================= q-point: ( 0.46 0.69 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.925 ( -6.899 1.210 -0.897) 7.062 4.478 ( -2.378 3.897 1.442) 4.788 4.657 ( -3.260 4.098 2.766) 5.922 6.323 ( 15.554 -3.936 11.032) 19.471 6.420 ( -6.988 -6.207 -14.876) 17.569 7.213 ( -11.851 5.916 11.475) 17.524 7.612 ( 3.774 -1.532 -8.953) 9.836 7.847 ( 1.710 10.846 -4.545) 11.883 8.737 ( -13.296 1.647 5.573) 14.511 9.488 ( 8.961 -1.554 -0.019) 9.095 9.607 ( -8.570 1.428 -1.169) 8.766 9.810 ( 20.760 4.164 1.637) 21.237 11.196 ( -14.582 -18.844 6.726) 24.758 11.761 ( 10.468 -0.827 -7.121) 12.687 12.114 ( 4.263 -4.453 0.832) 6.221 12.555 ( 1.959 3.520 5.739) 7.011 12.831 ( -2.057 4.512 -0.932) 5.046 12.997 ( 3.313 -0.009 -7.189) 7.916 18.569 ( -4.767 -3.499 2.824) 6.554 18.754 ( 4.140 2.989 -3.805) 6.368 19.117 ( 1.156 -2.988 3.396) 4.669 19.262 ( 1.098 -0.364 -2.143) 2.435 20.774 ( -0.234 -2.361 0.850) 2.520 20.892 ( 2.918 -3.470 -0.124) 4.536 27.698 ( -2.234 2.306 0.749) 3.297 27.784 ( 0.387 0.531 -0.808) 1.041 37.444 ( -12.870 -1.060 -0.598) 12.928 37.629 ( 3.887 12.203 4.201) 13.478 38.784 ( -8.479 -3.420 -6.121) 11.002 39.707 ( 1.846 12.191 1.326) 12.401 ======================= Grid point 466 (270/371) ======================= q-point: (-0.46 -0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.804 ( -6.427 -0.308 -1.139) 6.534 4.412 ( -6.084 -1.734 -0.974) 6.401 4.666 ( -4.918 5.636 7.566) 10.639 6.236 ( -4.014 0.380 -10.404) 11.158 6.606 ( 17.919 -6.378 9.074) 21.074 7.122 ( -6.446 -2.208 7.580) 10.192 7.605 ( 2.449 -0.777 -9.948) 10.274 8.055 ( 5.591 13.505 1.534) 14.697 8.572 ( -10.931 4.244 5.251) 12.848 9.296 ( -16.575 -5.136 1.669) 17.433 9.719 ( 9.494 4.716 -6.643) 12.511 10.164 ( 17.153 2.202 -3.863) 17.720 10.870 ( -8.950 -17.757 9.232) 21.924 11.850 ( 0.768 -0.901 -0.033) 1.184 12.051 ( 3.193 -4.016 -10.108) 11.336 12.647 ( -0.097 5.445 0.542) 5.473 12.879 ( 5.696 -3.228 2.780) 7.113 13.024 ( 1.880 4.799 -6.696) 8.450 18.489 ( -3.280 -0.895 1.744) 3.821 18.746 ( -3.862 -0.758 -2.783) 4.820 19.166 ( 4.169 1.076 2.934) 5.210 19.312 ( 4.791 -0.292 -0.361) 4.813 20.742 ( -0.740 -3.471 0.905) 3.662 20.905 ( 2.074 -2.203 -0.391) 3.051 27.690 ( -1.346 1.611 0.505) 2.159 27.779 ( -0.944 0.185 -0.731) 1.208 37.212 ( -13.555 0.171 0.834) 13.581 37.842 ( 5.344 8.458 6.554) 11.960 38.553 ( -9.123 -5.808 -5.911) 12.325 39.912 ( 5.232 13.775 3.544) 15.155 ======================= Grid point 467 (271/371) ======================= q-point: (-0.38 -0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.735 ( -1.097 -0.828 0.423) 1.438 4.284 ( -3.051 -5.573 -1.964) 6.650 4.675 ( -6.564 5.648 11.789) 14.628 6.161 ( -2.390 3.870 -8.519) 9.657 6.865 ( 11.627 -3.808 12.024) 17.154 7.055 ( 4.738 -11.279 0.416) 12.241 7.565 ( -1.656 1.630 -10.854) 11.100 8.105 ( -7.895 -2.206 2.372) 8.534 8.645 ( 5.912 13.439 5.093) 15.540 9.013 ( -16.294 2.809 2.798) 16.769 9.837 ( 6.080 0.265 -7.009) 9.282 10.295 ( 5.387 -7.338 -12.616) 15.557 10.670 ( -3.523 -13.129 10.221) 17.008 11.725 ( -7.186 -6.659 0.224) 9.799 12.191 ( 13.563 9.557 -8.103) 18.465 12.672 ( -0.348 2.632 -1.455) 3.027 12.904 ( 1.055 -6.586 -0.030) 6.670 13.092 ( 1.861 8.056 -3.552) 8.999 18.475 ( -1.089 3.689 1.041) 3.985 18.635 ( -5.035 -2.550 -1.430) 5.822 19.271 ( 3.743 2.963 2.364) 5.327 19.378 ( 3.490 -0.938 0.537) 3.654 20.699 ( -0.611 -3.824 0.586) 3.916 20.913 ( 0.919 -0.715 -0.589) 1.305 27.690 ( -0.442 0.780 0.218) 0.922 27.755 ( -1.260 -0.120 -0.560) 1.385 37.036 ( -8.717 0.130 2.032) 8.951 38.011 ( 3.663 2.261 9.788) 10.693 38.347 ( -4.627 -5.976 -7.260) 10.480 40.140 ( 3.234 13.736 6.009) 15.338 ======================= Grid point 468 (272/371) ======================= q-point: (-0.31 -0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.708 ( 1.463 -8.357 -2.026) 8.722 4.223 ( 4.174 -7.359 -0.632) 8.484 4.683 ( -7.704 6.081 14.405) 17.431 6.137 ( -2.009 7.323 -6.477) 9.980 6.938 ( -0.765 -5.416 10.404) 11.754 7.171 ( 19.199 -12.025 0.427) 22.658 7.440 ( -8.816 0.486 -11.054) 14.148 7.940 ( -4.621 -5.412 -0.070) 7.117 8.843 ( -7.603 5.777 5.915) 11.232 8.953 ( 5.363 13.268 5.375) 15.287 9.849 ( 1.604 -2.730 -7.535) 8.173 10.080 ( -3.471 -20.752 -16.403) 26.679 10.640 ( 1.899 -0.645 7.988) 8.236 11.551 ( -6.398 -6.453 -1.384) 9.192 12.495 ( 12.457 12.531 -5.387) 18.472 12.677 ( 1.131 -4.185 1.072) 4.466 12.803 ( -6.906 -0.333 -4.359) 8.173 13.178 ( 1.410 7.945 -2.152) 8.351 18.472 ( -5.374 2.681 -0.149) 6.007 18.604 ( 4.163 2.541 -0.260) 4.884 19.345 ( -0.177 2.680 3.229) 4.200 19.406 ( 0.776 -0.861 0.571) 1.293 20.660 ( 0.052 -3.500 -0.154) 3.503 20.917 ( -0.025 0.808 -0.757) 1.108 27.679 ( -1.088 -0.900 0.259) 1.435 27.749 ( 0.883 0.446 -0.592) 1.153 36.959 ( -1.592 -1.120 2.629) 3.271 38.068 ( -3.395 -5.269 11.759) 13.325 38.255 ( 6.150 -4.424 -8.374) 11.293 40.323 ( -1.109 13.204 8.262) 15.615 ======================= Grid point 469 (273/371) ======================= q-point: (-0.23 -0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.586 ( 2.429 -18.321 -6.274) 19.518 4.233 ( 6.828 -12.951 -0.812) 14.663 4.671 ( -8.864 5.504 11.647) 15.637 6.179 ( -0.516 11.358 -3.355) 11.854 6.951 ( 0.497 -6.991 9.149) 11.525 7.196 ( -5.494 -5.352 3.495) 8.429 7.385 ( 14.476 -2.150 -10.900) 18.248 7.895 ( 3.250 -3.451 0.120) 4.742 8.785 ( -7.799 0.376 9.117) 12.003 9.194 ( 6.042 9.783 2.175) 11.703 9.722 ( -3.129 -19.047 -11.667) 22.554 9.785 ( -1.901 -4.758 -8.637) 10.042 10.788 ( 6.481 8.988 5.927) 12.567 11.381 ( -4.516 -7.116 -4.538) 9.572 12.534 ( -9.229 -9.063 -4.570) 13.719 12.704 ( 6.305 2.360 -2.462) 7.169 12.732 ( -6.111 9.269 -1.146) 11.162 13.273 ( 1.481 8.986 -1.873) 9.298 18.417 ( -2.232 1.230 -0.271) 2.563 18.749 ( 6.261 8.139 -0.624) 10.287 19.337 ( -5.080 0.980 3.642) 6.327 19.401 ( -1.433 0.184 1.443) 2.042 20.635 ( 0.986 -2.953 -1.235) 3.349 20.920 ( -0.758 2.007 -0.823) 2.298 27.653 ( -0.444 -1.837 0.602) 1.983 27.774 ( 1.797 0.317 -0.754) 1.974 36.988 ( 5.585 -2.644 2.224) 6.568 37.963 ( -5.974 -8.267 7.282) 12.532 38.341 ( 12.639 -5.907 -4.203) 14.570 40.430 ( -6.343 12.341 9.955) 17.078 ======================= Grid point 470 (274/371) ======================= q-point: (-0.15 -0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.419 ( 6.872 -23.505 -7.507) 25.614 4.138 ( 2.154 -20.947 -2.093) 21.161 4.663 ( -2.501 6.264 5.341) 8.603 6.262 ( -2.289 11.799 -1.754) 12.147 6.771 ( -11.392 -9.013 3.967) 15.058 7.367 ( 18.068 -0.943 9.938) 20.643 7.543 ( 9.882 7.547 -9.042) 15.374 7.941 ( 7.330 -7.604 1.872) 10.726 8.638 ( -8.003 -12.776 3.622) 15.505 9.309 ( -2.270 4.026 1.784) 4.954 9.553 ( 3.104 -3.194 -5.386) 6.989 9.680 ( -1.175 -5.905 -3.041) 6.745 11.019 ( 4.788 7.037 2.601) 8.900 11.269 ( 1.810 1.564 -6.549) 6.972 12.226 ( -18.893 0.498 -7.006) 20.156 12.682 ( -5.142 -1.374 2.553) 5.903 12.769 ( 4.838 -2.748 -2.363) 6.045 13.345 ( -2.006 7.714 -1.551) 8.120 18.432 ( 1.329 3.210 0.175) 3.478 18.916 ( 3.866 8.810 -2.004) 9.827 19.252 ( -7.604 -0.049 4.804) 8.995 19.385 ( -1.903 1.397 1.438) 2.764 20.623 ( 1.823 -2.696 -2.242) 3.952 20.921 ( -1.384 2.706 -0.736) 3.127 27.641 ( 0.771 -2.119 0.924) 2.437 27.796 ( 1.253 -0.398 -0.765) 1.521 37.101 ( 10.342 -3.598 0.706) 10.973 37.815 ( -5.834 -10.216 7.009) 13.694 38.487 ( 15.130 -6.678 -5.785) 17.521 40.458 ( -10.124 11.678 11.143) 19.054 ======================= Grid point 475 (275/371) ======================= q-point: ( 0.23 -0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.509 ( 20.575 -8.995 3.034) 22.659 4.219 ( 16.111 -1.879 1.033) 16.253 4.860 ( -8.423 -10.521 -12.340) 18.274 6.126 ( -12.690 6.614 3.998) 14.858 6.940 ( 7.695 -3.018 11.540) 14.195 7.196 ( 1.820 11.977 -0.955) 12.152 7.427 ( 7.885 -5.720 -12.939) 16.196 7.934 ( 4.465 2.038 -5.311) 7.232 8.869 ( 1.703 -7.289 -0.812) 7.529 9.229 ( -7.618 10.194 -2.375) 12.946 9.537 ( 6.779 -8.231 10.938) 15.276 9.671 ( 2.984 -0.483 6.282) 6.971 10.908 ( 0.813 6.867 -9.408) 11.676 11.329 ( 3.015 -10.645 2.068) 11.256 12.367 ( -4.248 -5.959 13.861) 15.675 12.669 ( -1.999 2.241 3.913) 4.933 12.768 ( 1.325 -0.435 -4.867) 5.063 13.231 ( -8.116 6.127 3.494) 10.752 18.415 ( -1.021 -0.947 0.053) 1.394 18.738 ( -5.225 8.725 0.705) 10.194 19.365 ( -1.292 -2.908 -0.332) 3.200 19.446 ( -3.798 -1.254 -3.688) 5.440 20.625 ( 4.350 -1.688 -0.043) 4.666 20.909 ( -2.088 0.368 0.560) 2.193 27.664 ( 1.154 -1.031 -0.813) 1.748 27.758 ( 0.646 1.719 1.210) 2.199 37.035 ( 4.581 2.272 -3.790) 6.365 38.012 ( 3.574 -4.236 2.125) 5.936 38.348 ( 12.344 1.382 -6.077) 13.828 40.540 ( -16.014 2.705 -3.861) 16.693 ======================= Grid point 476 (276/371) ======================= q-point: ( 0.31 -0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.776 ( 16.825 -3.408 2.540) 17.353 4.425 ( 7.935 2.472 1.153) 8.391 4.596 ( -4.279 -7.795 -8.699) 12.440 6.029 ( -8.395 5.070 5.494) 11.242 6.910 ( -2.730 -13.759 -0.154) 14.029 7.346 ( 0.762 14.833 -5.757) 15.929 7.444 ( 1.633 1.333 -1.687) 2.700 8.173 ( 20.471 5.694 -0.142) 21.249 8.751 ( -10.832 1.379 -9.777) 14.657 9.166 ( -5.116 4.132 0.548) 6.599 9.565 ( -3.764 -10.273 11.918) 16.179 9.752 ( 4.637 -1.020 6.874) 8.354 11.026 ( 13.493 4.892 -9.869) 17.418 11.378 ( 10.495 -6.204 6.490) 13.811 12.127 ( -14.794 -16.957 10.212) 24.712 12.711 ( -2.360 4.538 3.599) 6.254 12.803 ( 5.462 0.213 -6.034) 8.142 13.163 ( -8.889 4.761 3.098) 10.549 18.426 ( 2.938 0.859 -1.052) 3.237 18.750 ( -3.915 7.089 2.469) 8.466 19.256 ( -5.123 -4.990 -2.874) 7.707 19.381 ( -1.220 -2.459 -1.372) 3.069 20.682 ( 4.029 -0.782 -0.015) 4.104 20.879 ( -1.775 -0.757 0.679) 2.046 27.684 ( 2.173 0.091 -0.751) 2.301 27.781 ( -0.640 1.749 1.004) 2.116 37.162 ( 6.784 7.567 -1.703) 10.305 37.967 ( -1.134 -6.541 -3.016) 7.292 38.587 ( 11.671 7.578 -0.040) 13.916 40.242 ( -18.160 -0.328 -5.380) 18.943 ======================= Grid point 477 (277/371) ======================= q-point: ( 0.38 -0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.982 ( 7.707 0.459 1.412) 7.848 4.482 ( -1.822 4.238 -0.811) 4.684 4.575 ( 8.246 -3.773 -0.852) 9.108 6.014 ( -0.424 0.333 6.250) 6.273 6.680 ( -6.432 -12.605 -6.119) 15.417 7.416 ( -3.060 3.721 8.073) 9.401 7.527 ( 3.739 16.573 -13.831) 21.907 8.365 ( -21.439 3.655 -3.521) 22.031 8.658 ( 16.551 7.206 -0.818) 18.070 9.189 ( 6.469 -3.994 0.809) 7.645 9.427 ( -4.362 -7.326 6.355) 10.634 9.811 ( -0.608 -1.637 5.028) 5.323 11.270 ( 16.245 2.809 -11.230) 19.947 11.604 ( 10.516 -3.293 6.551) 12.820 11.767 ( -8.590 -17.770 12.134) 23.169 12.673 ( -5.094 -0.992 -0.474) 5.212 12.875 ( 4.151 4.064 -4.839) 7.560 13.065 ( -9.190 2.992 2.609) 10.011 18.509 ( 6.168 1.448 -1.654) 6.548 18.753 ( -4.347 3.390 3.844) 6.721 19.125 ( -2.888 -3.669 -2.515) 5.304 19.325 ( -2.297 -2.090 -1.244) 3.345 20.739 ( 3.228 0.148 -0.187) 3.236 20.844 ( -1.161 -2.142 0.626) 2.515 27.723 ( 2.326 0.886 -0.619) 2.565 27.780 ( -1.600 1.129 0.756) 2.099 37.363 ( 7.546 9.722 0.702) 12.327 37.844 ( -5.121 -4.700 -3.202) 7.653 38.814 ( 6.341 6.298 0.266) 8.941 39.933 ( -14.853 0.619 -4.045) 15.406 ======================= Grid point 478 (278/371) ======================= q-point: ( 0.46 -0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.024 ( -3.300 0.567 -0.581) 3.398 4.516 ( 0.234 1.305 1.177) 1.773 4.660 ( 5.073 -0.814 0.303) 5.146 6.070 ( 8.260 -6.839 0.872) 10.759 6.460 ( -6.446 -4.502 -1.619) 8.027 7.432 ( -0.799 0.511 2.743) 2.903 7.681 ( -6.158 20.148 -3.839) 21.415 8.021 ( -15.288 7.549 -1.340) 17.103 8.868 ( -0.471 -3.100 2.691) 4.132 9.279 ( 11.893 -3.534 -2.111) 12.586 9.510 ( 16.103 -0.631 2.930) 16.380 9.750 ( -6.731 -1.223 0.663) 6.873 11.301 ( -14.942 -18.701 5.379) 24.534 11.483 ( 13.746 1.914 -10.471) 17.386 11.965 ( 11.537 -2.691 6.099) 13.325 12.575 ( -0.535 -3.619 -0.217) 3.665 12.954 ( -8.516 1.422 2.658) 9.034 12.958 ( 2.583 6.679 -4.321) 8.364 18.589 ( 1.502 -1.407 -0.478) 2.112 18.732 ( -0.491 2.550 1.042) 2.798 19.089 ( 1.169 -0.614 0.349) 1.366 19.263 ( -2.463 -0.671 -0.946) 2.722 20.773 ( -0.406 0.023 0.126) 0.425 20.821 ( 2.012 -2.513 -0.035) 3.219 27.754 ( -1.524 1.564 0.275) 2.201 27.768 ( 1.011 -0.175 -0.229) 1.051 37.533 ( 0.467 2.326 0.341) 2.396 37.732 ( -2.255 4.312 0.544) 4.896 38.843 ( -5.749 -1.938 -2.433) 6.537 39.812 ( -2.314 7.594 0.717) 7.971 ======================= Grid point 479 (279/371) ======================= q-point: (-0.46 -0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.913 ( -7.849 -0.771 -2.398) 8.244 4.447 ( -5.484 -6.816 -1.687) 8.909 4.744 ( 3.654 0.932 4.146) 5.604 6.141 ( 9.118 -3.971 -10.368) 14.367 6.415 ( 2.105 -2.127 10.666) 11.077 7.383 ( -12.142 0.794 7.388) 14.235 7.570 ( -7.914 6.036 -6.032) 11.638 8.149 ( 4.342 19.054 2.531) 19.706 8.728 ( -7.486 -8.368 3.940) 11.900 9.406 ( 3.994 -4.322 -1.704) 6.126 9.620 ( -3.802 1.500 -4.089) 5.781 9.847 ( 20.598 1.290 -2.550) 20.795 10.946 ( -12.495 -13.826 6.609) 19.773 11.674 ( 13.945 1.669 -9.393) 16.897 11.948 ( -2.595 -9.604 -6.998) 12.164 12.668 ( 8.325 1.456 5.292) 9.972 12.842 ( -6.634 -1.290 2.164) 7.097 13.039 ( 1.685 7.364 -3.295) 8.241 18.540 ( -2.971 -1.699 1.257) 3.646 18.781 ( 0.134 3.607 -2.915) 4.640 19.130 ( 2.733 0.449 3.587) 4.532 19.250 ( 1.866 0.530 -0.534) 2.012 20.736 ( -1.684 -2.719 0.293) 3.211 20.853 ( 2.614 -0.003 -0.590) 2.679 27.729 ( -1.952 0.235 0.285) 1.987 27.784 ( 0.238 0.139 -0.327) 0.428 37.405 ( -10.374 -2.411 -0.750) 10.677 37.870 ( 4.710 7.656 4.792) 10.186 38.621 ( -11.231 -7.982 -3.365) 14.183 39.964 ( 5.708 11.908 4.590) 13.980 ======================= Grid point 480 (280/371) ======================= q-point: (-0.38 -0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.766 ( -5.574 -3.566 -3.197) 7.349 4.242 ( -5.093 -12.258 -3.502) 13.728 4.826 ( 1.048 1.143 8.935) 9.069 6.186 ( 1.659 5.959 -8.744) 10.710 6.560 ( 13.441 -8.039 9.520) 18.328 7.177 ( -15.179 -1.217 9.592) 17.997 7.538 ( 0.046 4.861 -10.531) 11.599 8.257 ( -9.173 0.641 1.477) 9.313 8.671 ( 4.850 1.902 8.093) 9.625 9.284 ( -11.376 2.024 0.299) 11.558 9.657 ( 7.925 -3.110 -6.289) 10.585 10.051 ( 7.842 -6.762 -9.152) 13.820 10.730 ( -6.999 -4.101 5.738) 9.936 11.742 ( -3.199 -7.387 -2.938) 8.569 11.935 ( 18.009 5.231 -12.760) 22.683 12.727 ( -5.302 -1.037 1.199) 5.534 12.819 ( 4.905 -2.260 2.498) 5.951 13.125 ( 1.924 7.666 -1.359) 8.020 18.519 ( -0.154 1.985 1.258) 2.355 18.736 ( -7.033 3.237 -2.771) 8.222 19.233 ( 5.351 2.103 4.139) 7.084 19.308 ( 4.223 0.027 -0.092) 4.224 20.681 ( -1.321 -3.530 -0.084) 3.770 20.890 ( 1.645 1.099 -0.725) 2.107 27.706 ( -0.965 -0.137 0.078) 0.978 27.772 ( -1.266 -0.541 -0.202) 1.392 37.208 ( -10.988 -1.611 1.026) 11.152 38.012 ( 3.575 2.326 4.467) 6.176 38.352 ( -8.892 -10.128 -1.410) 13.551 40.216 ( 6.526 12.548 6.912) 15.742 ======================= Grid point 481 (281/371) ======================= q-point: (-0.31 -0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.605 ( -3.235 -12.762 -6.036) 14.483 4.068 ( 1.055 -13.682 -2.096) 13.882 4.895 ( -1.514 1.887 12.947) 13.171 6.223 ( -1.651 9.614 -4.451) 10.722 6.741 ( 14.303 -11.749 1.696) 18.588 7.025 ( -6.127 -1.550 11.355) 12.996 7.490 ( -4.360 0.593 -11.103) 11.943 8.034 ( -10.197 -5.142 0.922) 11.457 8.865 ( 7.277 1.262 8.716) 11.425 9.163 ( -9.350 8.269 1.827) 12.615 9.691 ( 6.039 -7.279 -6.608) 11.538 9.878 ( -4.667 -17.421 -12.182) 21.764 10.703 ( -1.266 7.231 2.814) 7.862 11.609 ( -6.135 -3.715 -0.949) 7.235 12.267 ( 19.397 7.348 -12.724) 24.334 12.650 ( -1.508 -5.646 5.083) 7.745 12.847 ( 0.790 2.283 -3.790) 4.495 13.223 ( 1.427 7.615 -0.218) 7.751 18.577 ( 1.176 2.108 -0.822) 2.550 18.629 ( -7.046 7.344 -0.098) 10.178 19.358 ( 3.940 2.140 5.063) 6.763 19.369 ( 3.075 0.179 -0.633) 3.145 20.629 ( -0.636 -3.588 -0.809) 3.733 20.920 ( 0.745 1.973 -0.814) 2.260 27.692 ( -0.832 -0.445 0.256) 0.977 27.740 ( -0.810 -1.159 -0.409) 1.472 37.043 ( -8.017 -2.019 2.709) 8.700 38.066 ( 4.160 -5.357 -3.926) 7.837 38.149 ( -6.008 -9.338 7.895) 13.624 40.463 ( 4.045 12.297 8.631) 15.559 ======================= Grid point 482 (282/371) ======================= q-point: (-0.23 -0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.354 ( -2.060 -22.210 -8.622) 23.914 3.970 ( 5.601 -18.976 -2.537) 19.948 4.914 ( -6.660 0.104 12.407) 14.082 6.285 ( -0.307 11.254 -1.578) 11.368 6.794 ( 8.479 -10.108 -2.431) 13.416 7.106 ( 7.272 -5.337 14.709) 17.254 7.275 ( -7.595 -6.766 -9.830) 14.145 7.931 ( -3.495 4.392 0.369) 5.625 8.897 ( -5.343 -8.235 4.589) 10.836 9.196 ( 3.142 7.165 1.460) 7.959 9.586 ( -5.009 -11.410 -6.996) 14.291 9.652 ( 3.504 -9.728 -6.705) 12.324 10.850 ( 4.350 15.547 2.565) 16.347 11.442 ( -9.746 -2.702 -1.573) 10.235 12.413 ( 5.969 -8.571 -9.883) 14.380 12.627 ( 0.803 -4.796 4.170) 6.406 12.921 ( 0.043 14.966 -7.134) 16.580 13.315 ( 1.725 7.953 -0.575) 8.158 18.497 ( -5.614 2.396 -1.976) 6.416 18.748 ( 4.287 10.473 1.109) 11.370 19.397 ( 0.132 0.999 -1.300) 1.645 19.439 ( 0.024 1.370 6.746) 6.884 20.587 ( 0.298 -3.261 -1.931) 3.801 20.943 ( -0.001 2.594 -0.871) 2.737 27.661 ( -1.895 -1.447 0.857) 2.534 27.737 ( 1.745 -0.919 -0.938) 2.184 36.948 ( -2.231 -3.328 3.534) 5.342 37.980 ( -1.196 -10.785 -1.687) 10.981 38.100 ( 4.074 -9.132 5.624) 11.473 40.653 ( -0.654 11.799 9.723) 15.303 ======================= Grid point 483 (283/371) ======================= q-point: (-0.15 -0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.062 ( 1.721 -27.780 -8.686) 29.157 3.832 ( 5.576 -26.603 -4.246) 27.511 4.815 ( -7.592 -3.516 7.396) 11.167 6.384 ( -0.470 10.476 -1.856) 10.650 6.807 ( -0.568 -9.652 -3.331) 10.226 7.042 ( 9.217 -17.039 7.034) 20.610 7.392 ( 13.721 7.991 1.779) 15.978 7.940 ( -2.742 4.175 2.001) 5.381 8.651 ( -10.528 -13.351 -2.073) 17.129 9.334 ( 5.607 1.668 2.799) 6.485 9.468 ( -0.621 -0.920 -1.975) 2.266 9.576 ( 2.333 -9.424 -2.940) 10.144 11.096 ( -0.193 8.683 4.420) 9.746 11.301 ( -1.172 11.840 -3.887) 12.516 12.303 ( -1.790 -10.048 -3.894) 10.924 12.619 ( 4.546 -7.548 -2.182) 9.078 12.913 ( -13.641 12.323 -6.201) 19.401 13.419 ( 1.042 8.333 -2.070) 8.650 18.469 ( -0.927 5.136 -0.776) 5.277 18.925 ( 4.484 9.779 -0.494) 10.769 19.374 ( -4.018 1.520 0.028) 4.295 19.458 ( -3.047 1.464 6.700) 7.504 20.557 ( 1.228 -3.005 -3.119) 4.502 20.959 ( -0.652 2.864 -0.837) 3.055 27.628 ( -0.744 -1.829 1.202) 2.312 27.755 ( 2.086 -1.167 -1.108) 2.635 36.949 ( 4.521 -4.292 3.009) 6.922 37.832 ( -4.781 -12.403 5.283) 14.303 38.149 ( 12.405 -10.586 -2.717) 16.533 40.758 ( -6.024 11.302 10.146) 16.339 ======================= Grid point 553 (284/371) ======================= q-point: ( 0.23 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 371 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.744 ( -0.000 0.000 34.710) 34.710 1.744 ( -0.000 0.000 34.710) 34.710 2.866 ( -0.000 0.000 55.894) 55.894 6.139 ( 0.000 -0.000 -7.181) 7.181 6.139 ( 0.000 -0.000 -7.181) 7.181 7.263 ( 0.000 -0.000 -1.302) 1.302 7.263 ( 0.000 -0.000 -1.302) 1.302 8.515 ( 0.000 -0.000 -3.867) 3.867 8.785 ( -0.000 0.000 2.902) 2.902 8.785 ( 0.000 0.000 2.902) 2.902 9.495 ( 0.000 -0.000 -11.666) 11.666 10.530 ( 0.000 -0.000 -3.807) 3.807 11.358 ( -0.000 0.000 0.388) 0.388 11.358 ( 0.000 0.000 0.388) 0.388 11.624 ( -0.000 0.000 0.229) 0.229 11.624 ( 0.000 0.000 0.229) 0.229 13.626 ( 0.000 -0.000 -2.775) 2.775 13.832 ( -0.000 0.000 0.689) 0.689 19.049 ( -0.000 0.000 3.242) 3.242 19.049 ( -0.000 0.000 3.242) 3.242 19.573 ( 0.000 -0.000 -2.962) 2.962 19.573 ( 0.000 -0.000 -2.962) 2.962 21.351 ( -0.000 0.000 10.299) 10.299 22.624 ( 0.000 -0.000 -7.523) 7.523 27.454 ( -0.000 0.000 1.763) 1.763 27.738 ( 0.000 -0.000 -2.027) 2.027 36.806 ( 0.000 -0.000 -2.156) 2.156 36.806 ( 0.000 -0.000 -2.156) 2.156 37.059 ( -0.000 0.000 2.205) 2.205 37.059 ( 0.000 0.000 2.205) 2.205 ======================= Grid point 554 (285/371) ======================= q-point: ( 0.31 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.853 ( 6.414 3.073 30.520) 31.337 2.217 ( 11.985 7.738 32.882) 35.843 3.372 ( 19.419 11.175 40.977) 46.702 6.006 ( 3.227 -3.976 -5.860) 7.782 6.305 ( 9.147 10.200 -7.980) 15.855 7.217 ( -4.432 4.244 4.129) 7.396 7.396 ( 10.524 0.416 -3.390) 11.065 8.217 ( -12.563 -15.847 1.874) 20.309 8.642 ( -10.417 -0.926 2.067) 10.660 9.029 ( 8.590 4.392 -5.805) 11.260 9.462 ( 2.010 5.486 -6.642) 8.846 10.282 ( -13.409 -6.564 3.026) 15.233 11.272 ( -6.435 2.704 -2.842) 7.536 11.541 ( 6.306 -2.715 3.239) 7.591 11.640 ( 10.366 2.844 -1.061) 10.802 11.973 ( 21.302 14.295 -6.900) 26.566 13.526 ( -9.362 -5.079 -2.288) 10.894 13.761 ( -5.924 -4.810 0.105) 7.632 18.983 ( -5.766 -3.248 2.845) 7.204 19.108 ( 1.829 1.667 3.603) 4.371 19.483 ( -3.415 -3.569 -3.457) 6.029 19.569 ( -2.028 0.049 -2.984) 3.608 21.373 ( -2.938 -1.772 10.071) 10.639 22.203 ( -28.876 -16.489 3.478) 33.434 27.462 ( 0.200 0.244 1.786) 1.814 27.711 ( -1.049 -0.907 -1.850) 2.312 36.817 ( -1.445 5.991 -3.272) 6.978 37.012 ( 2.208 14.158 1.124) 14.373 37.147 ( 27.938 -13.076 -1.695) 30.893 37.617 ( 40.217 32.699 -18.313) 54.973 ======================= Grid point 555 (286/371) ======================= q-point: ( 0.38 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.275 ( 18.860 11.009 21.716) 30.797 2.627 ( 10.605 7.623 30.637) 33.305 3.920 ( 16.591 8.674 12.369) 22.439 6.108 ( 10.268 -3.450 3.050) 11.253 6.608 ( 18.416 18.308 -4.182) 26.302 7.166 ( -10.661 1.541 10.017) 14.709 7.566 ( 11.792 2.167 -7.176) 13.972 7.981 ( -0.050 -13.895 1.923) 14.027 8.466 ( -10.207 -0.161 0.870) 10.245 9.024 ( 0.147 -4.124 -14.378) 14.959 9.617 ( 3.233 15.600 0.124) 15.932 10.097 ( -7.329 -2.667 5.601) 9.602 11.189 ( -5.994 5.331 -0.771) 8.059 11.587 ( 6.431 -9.208 3.673) 11.816 11.907 ( 12.026 9.291 -1.195) 15.244 12.351 ( 16.294 8.727 -8.124) 20.191 13.185 ( -20.931 -12.533 2.138) 24.490 13.583 ( -7.968 -7.132 -2.095) 10.897 18.842 ( -8.468 -4.346 2.368) 9.809 19.163 ( -0.349 2.774 2.019) 3.449 19.371 ( -2.401 -6.745 -2.449) 7.567 19.495 ( -3.989 0.490 -3.437) 5.288 21.320 ( -6.221 -3.783 7.931) 10.766 21.653 ( -23.143 -13.150 9.192) 28.161 27.490 ( 1.340 1.354 1.003) 2.153 27.681 ( -0.216 -0.938 -1.473) 1.760 36.836 ( 1.267 3.358 -3.879) 5.285 37.208 ( 4.113 14.369 6.070) 16.131 37.553 ( 31.315 -4.762 -2.691) 31.789 38.434 ( 36.204 29.051 -33.744) 57.388 ======================= Grid point 556 (287/371) ======================= q-point: ( 0.46 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.840 ( 22.885 15.074 13.788) 30.677 3.036 ( 12.911 9.181 23.187) 28.083 4.238 ( 14.648 5.983 -5.168) 16.645 6.182 ( 1.479 -6.424 3.262) 7.355 6.994 ( -8.684 -1.608 10.337) 13.596 7.194 ( 18.613 20.775 2.520) 28.007 7.764 ( 14.740 4.816 -6.776) 16.923 7.898 ( 0.928 -12.286 2.109) 12.500 8.381 ( -0.590 3.039 -0.097) 3.097 8.878 ( -1.147 -8.575 -13.392) 15.943 9.730 ( -9.813 17.113 -5.497) 20.478 10.043 ( -1.343 -0.579 7.710) 7.848 11.208 ( 0.556 7.340 6.358) 9.727 11.627 ( 6.959 -9.694 3.956) 12.571 12.105 ( 3.060 4.960 -4.195) 7.181 12.594 ( 8.924 1.184 -5.229) 10.410 12.741 ( -17.130 -8.765 8.297) 20.955 13.356 ( -8.655 -7.922 -3.869) 12.355 18.665 ( -9.066 -4.282 1.733) 10.176 19.146 ( -5.888 3.134 0.271) 6.676 19.238 ( -2.897 -8.900 -2.807) 9.771 19.470 ( 1.413 1.877 -2.159) 3.191 21.167 ( -10.842 -6.359 5.682) 13.794 21.324 ( -11.468 -6.720 6.853) 14.955 27.535 ( 1.653 2.102 -0.040) 2.674 27.675 ( 1.082 -0.609 -0.629) 1.392 36.885 ( 3.100 3.648 -4.390) 6.496 37.463 ( 6.363 12.887 8.258) 16.576 38.001 ( 29.250 -3.285 -4.748) 29.814 38.980 ( 23.106 22.298 -29.375) 43.520 ======================= Grid point 557 (288/371) ======================= q-point: ( 0.54 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.379 ( 18.487 9.573 9.853) 23.033 3.471 ( 17.438 15.163 10.237) 25.275 4.509 ( 16.028 6.850 -9.666) 19.931 6.080 ( -6.279 -8.238 3.348) 10.886 6.893 ( -6.577 -2.953 15.648) 17.229 7.501 ( 0.981 6.243 -8.174) 10.332 7.817 ( 0.417 -0.384 -5.779) 5.806 8.115 ( 21.524 3.496 1.845) 21.884 8.481 ( 3.628 8.569 -2.101) 9.540 8.712 ( 1.362 -14.738 -4.178) 15.379 9.578 ( -18.416 13.924 -8.235) 24.512 10.074 ( -1.645 -0.020 8.653) 8.808 11.424 ( 8.750 8.935 12.776) 17.878 11.670 ( 6.433 -8.829 2.828) 11.284 12.032 ( -6.897 -3.665 -0.013) 7.811 12.396 ( -11.693 -5.531 -0.131) 12.936 12.815 ( 5.826 3.568 -0.112) 6.833 13.152 ( -5.043 -6.133 -1.861) 8.156 18.504 ( -6.798 -3.197 1.178) 7.604 19.001 ( -10.196 -3.673 -0.293) 10.842 19.168 ( 1.469 -0.679 -2.572) 3.038 19.510 ( 2.109 0.864 -1.855) 2.938 20.967 ( -8.772 -5.248 3.835) 10.918 21.155 ( -7.583 -4.397 3.167) 9.320 27.582 ( 1.862 2.209 -0.472) 2.927 27.693 ( 1.488 -0.176 0.096) 1.501 36.951 ( 3.460 3.714 -4.746) 6.949 37.724 ( 6.249 9.938 9.775) 15.276 38.343 ( 20.923 -4.206 -10.950) 23.986 39.368 ( 17.643 18.237 -16.969) 30.526 ======================= Grid point 558 (289/371) ======================= q-point: ( 0.62 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.714 ( 12.254 2.522 2.670) 12.793 3.937 ( 15.345 15.139 2.774) 21.734 4.755 ( 11.858 6.889 -11.995) 18.220 5.922 ( -6.436 -4.844 5.758) 9.902 6.891 ( -1.485 -1.619 16.273) 16.421 7.392 ( -5.553 -9.503 -0.062) 11.006 7.810 ( -0.139 6.537 -18.130) 19.273 8.363 ( -0.198 -4.272 -3.182) 5.330 8.485 ( 5.435 1.049 -6.894) 8.841 8.711 ( 3.381 1.748 3.164) 4.950 9.477 ( -3.141 10.595 2.119) 11.252 10.059 ( -5.912 -1.433 12.184) 13.618 11.514 ( -7.494 -7.294 -2.333) 10.715 11.803 ( 12.035 1.870 6.044) 13.597 11.996 ( -4.680 -1.363 8.218) 9.555 12.170 ( -1.400 -0.618 -0.724) 1.693 12.889 ( 2.409 1.121 -0.510) 2.705 13.061 ( -2.696 -2.662 0.637) 3.842 18.412 ( -2.285 -1.104 0.720) 2.638 18.798 ( -9.304 -4.141 -0.326) 10.190 19.214 ( 4.122 2.260 -1.727) 5.008 19.515 ( -0.283 -1.031 -2.037) 2.301 20.833 ( -4.940 -2.997 1.720) 6.028 21.018 ( -6.043 -3.308 1.159) 6.985 27.632 ( 2.156 1.783 -0.160) 2.802 27.714 ( 0.753 0.115 0.320) 0.826 37.009 ( 2.424 3.121 -4.838) 6.247 37.939 ( 4.282 5.747 10.596) 12.792 38.480 ( 9.847 -4.058 -16.118) 19.318 39.743 ( 17.053 14.412 -6.676) 23.304 ======================= Grid point 559 (290/371) ======================= q-point: (-0.31 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.825 ( 1.003 -3.730 -1.609) 4.184 4.226 ( 6.449 4.706 0.303) 7.989 4.887 ( 5.246 8.250 -16.471) 19.154 5.887 ( 0.359 1.951 7.507) 7.764 6.968 ( 2.078 -1.559 16.126) 16.333 7.198 ( -6.814 -10.692 1.916) 12.823 7.703 ( -3.755 -1.846 -20.208) 20.636 8.141 ( -12.148 -3.385 -2.512) 12.858 8.667 ( 10.783 8.431 -1.597) 13.781 8.839 ( 8.339 4.944 -3.560) 10.328 9.616 ( 4.005 3.825 10.117) 11.533 9.982 ( -10.380 -2.297 15.796) 19.040 11.185 ( -15.608 -11.055 -12.724) 22.972 11.730 ( -14.175 -0.969 -1.777) 14.318 12.074 ( 15.130 -3.876 9.427) 18.243 12.427 ( 11.624 7.906 9.849) 17.164 12.943 ( -1.086 -3.608 1.383) 4.013 12.986 ( -0.087 3.440 -0.896) 3.556 18.417 ( 1.797 1.869 0.067) 2.593 18.637 ( -5.858 -2.924 0.456) 6.563 19.309 ( 5.140 2.994 -1.972) 6.266 19.468 ( -1.935 -2.277 -1.586) 3.383 20.750 ( -3.661 -2.006 -0.173) 4.178 20.922 ( -2.929 -1.560 0.723) 3.397 27.676 ( 1.361 0.831 0.075) 1.597 27.724 ( 0.227 0.342 0.491) 0.640 37.033 ( 0.421 2.089 -4.636) 5.103 38.070 ( 1.035 0.891 10.594) 10.682 38.445 ( 1.204 -3.421 -16.770) 17.158 40.109 ( 15.864 11.016 -3.052) 19.554 ======================= Grid point 560 (291/371) ======================= q-point: (-0.23 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.674 ( -11.732 -7.775 1.837) 14.194 4.222 ( -4.220 -8.130 -0.332) 9.166 4.930 ( 0.578 9.927 -16.993) 19.688 6.044 ( 8.462 6.871 5.581) 12.246 6.986 ( -6.502 -12.868 6.774) 15.929 7.091 ( 4.671 -1.426 7.594) 9.029 7.474 ( -8.453 -3.652 -15.424) 17.964 7.956 ( -7.828 2.323 -2.133) 8.439 8.913 ( 6.037 8.101 -2.724) 10.464 9.020 ( 11.783 3.194 -2.921) 12.553 9.713 ( -0.174 -2.375 9.834) 10.118 9.821 ( -16.661 -4.153 15.857) 23.373 10.805 ( -6.389 -6.474 -12.755) 15.666 11.538 ( -10.482 2.978 0.176) 10.898 12.336 ( 14.103 -7.047 13.341) 20.653 12.672 ( 7.130 5.424 4.182) 9.887 12.787 ( -9.135 -1.477 -3.193) 9.789 13.139 ( 8.446 4.226 2.810) 9.853 18.468 ( -1.419 4.972 0.423) 5.188 18.600 ( 5.263 -1.291 0.241) 5.424 19.389 ( 1.617 1.341 -1.917) 2.844 19.423 ( 1.061 -0.774 -1.903) 2.313 20.663 ( -4.110 -2.274 -0.490) 4.722 20.905 ( 0.647 0.401 0.720) 1.048 27.684 ( -0.948 0.525 -0.327) 1.132 27.737 ( 0.680 -0.445 0.883) 1.200 37.012 ( -1.943 1.012 -4.176) 4.715 38.092 ( -3.273 -3.499 9.218) 10.388 38.299 ( -4.463 -3.928 -14.409) 15.588 40.423 ( 13.542 8.606 -4.306) 16.613 ======================= Grid point 567 (292/371) ======================= q-point: ( 0.31 0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( -0.668 11.164 29.464) 31.515 2.446 ( 0.814 23.528 26.945) 35.781 3.563 ( 0.071 14.435 42.893) 45.257 5.913 ( -4.880 -3.454 -11.118) 12.624 6.257 ( 4.201 11.263 -7.830) 14.347 7.214 ( 3.703 -2.424 6.400) 7.782 7.444 ( -2.787 13.344 -1.362) 13.699 8.176 ( -5.307 -20.971 1.349) 21.674 8.803 ( 2.283 -0.679 -3.364) 4.122 8.893 ( -1.417 2.608 -1.799) 3.470 9.380 ( 4.755 0.285 -6.840) 8.336 10.243 ( 0.577 -19.285 1.965) 19.394 11.240 ( 3.254 -3.612 3.502) 5.992 11.576 ( 0.264 5.949 -0.302) 5.963 11.734 ( -10.263 11.835 -3.811) 16.122 11.885 ( 5.901 23.731 -4.066) 24.789 13.553 ( 0.463 -3.772 -3.525) 5.184 13.782 ( -1.254 -4.996 -0.589) 5.185 19.045 ( -0.503 -1.962 2.865) 3.508 19.076 ( 1.138 -3.110 3.991) 5.186 19.439 ( -0.989 -7.322 -3.829) 8.322 19.582 ( 0.601 1.190 -2.758) 3.063 21.426 ( -0.075 -4.031 10.612) 11.352 22.206 ( 0.164 -30.476 0.729) 30.485 27.472 ( 0.119 0.078 1.986) 1.991 27.701 ( -0.254 -1.071 -2.056) 2.332 36.707 ( 5.376 -2.812 -0.635) 6.101 36.907 ( -2.608 5.863 -2.478) 6.879 37.216 ( -7.994 11.116 1.394) 13.763 37.649 ( 5.214 56.159 -15.385) 58.461 ======================= Grid point 568 (293/371) ======================= q-point: ( 0.38 0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( 5.324 21.449 22.967) 31.873 2.817 ( 1.989 19.736 25.987) 32.692 3.928 ( 4.032 11.787 20.611) 24.084 5.889 ( 10.562 -0.961 -5.009) 11.729 6.473 ( 13.212 12.519 -3.342) 18.506 7.322 ( 3.322 1.184 7.976) 8.721 7.474 ( -4.028 1.910 1.718) 4.778 7.928 ( -4.339 -6.523 0.018) 7.834 8.632 ( -10.889 -2.352 -1.390) 11.227 8.891 ( 1.332 -3.826 -15.739) 16.252 9.586 ( 13.344 7.486 1.956) 15.425 10.088 ( 0.102 -14.245 2.839) 14.526 11.279 ( -0.306 0.629 4.819) 4.869 11.588 ( -4.834 5.567 -1.413) 7.507 11.816 ( 8.106 12.080 -1.348) 14.610 12.191 ( 10.574 13.617 -5.791) 18.187 13.400 ( -13.320 -5.405 -2.633) 14.614 13.624 ( -7.625 -9.049 -1.111) 11.885 18.952 ( -6.935 -2.787 2.340) 7.832 19.140 ( 4.550 -2.117 3.322) 6.019 19.312 ( -2.014 -9.550 -3.475) 10.360 19.551 ( -3.431 0.521 -2.817) 4.469 21.398 ( -3.635 -6.402 8.903) 11.553 21.815 ( -13.182 -25.524 5.577) 29.263 27.493 ( 0.779 1.172 1.567) 2.107 27.672 ( -0.661 -0.715 -1.785) 2.034 36.877 ( 4.246 2.566 0.333) 4.972 36.977 ( 16.458 1.801 -5.695) 17.508 37.332 ( 4.753 15.119 3.719) 16.279 38.248 ( 16.365 48.927 -24.318) 57.036 ======================= Grid point 569 (294/371) ======================= q-point: ( 0.46 0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.853 ( 12.118 27.050 15.525) 33.460 3.155 ( 2.739 15.942 25.195) 29.941 4.104 ( 4.705 6.468 -2.770) 8.464 6.048 ( 9.218 -3.693 -1.500) 10.043 6.918 ( 24.083 10.963 3.893) 26.746 7.273 ( -9.708 -5.555 14.345) 18.190 7.501 ( 7.391 -4.081 -0.033) 8.442 7.933 ( -0.177 12.774 -5.248) 13.811 8.459 ( -6.063 -0.536 0.109) 6.087 8.752 ( -1.760 -5.317 -16.975) 17.875 9.853 ( 7.851 8.204 -0.666) 11.375 10.015 ( 1.666 -8.911 3.174) 9.605 11.314 ( -0.892 5.091 6.966) 8.674 11.573 ( -2.379 4.578 0.356) 5.171 12.060 ( 7.835 7.527 -2.314) 11.108 12.424 ( 11.237 5.565 -3.974) 13.154 13.017 ( -22.521 -9.122 3.872) 24.605 13.397 ( -8.106 -9.422 -3.221) 12.839 18.805 ( -9.621 -1.747 1.743) 9.932 19.150 ( -0.353 -8.043 -4.670) 9.307 19.219 ( 0.806 -3.510 3.431) 4.974 19.473 ( -3.394 -0.194 -2.638) 4.303 21.274 ( -7.603 -9.060 5.732) 13.144 21.448 ( -10.902 -15.173 6.561) 19.802 27.532 ( 1.321 2.137 0.397) 2.543 27.658 ( 0.290 0.145 -0.867) 0.926 36.923 ( -2.098 9.345 -1.655) 9.720 37.303 ( 23.917 -4.195 -4.034) 24.615 37.656 ( 13.130 15.507 4.619) 20.838 38.782 ( 16.440 34.826 -25.466) 46.170 ======================= Grid point 570 (295/371) ======================= q-point: ( 0.54 0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.386 ( 10.139 26.782 10.466) 30.490 3.460 ( 7.132 12.950 16.671) 22.282 4.273 ( 13.609 6.593 -9.415) 17.813 6.072 ( 0.509 -6.130 0.614) 6.182 7.052 ( -7.848 -6.860 16.446) 19.471 7.462 ( 23.729 -11.051 -5.337) 26.715 7.525 ( -1.489 4.994 -2.394) 5.735 8.052 ( 2.110 13.801 -4.174) 14.572 8.514 ( 7.445 6.782 8.607) 13.248 8.578 ( -4.068 -2.763 -15.309) 16.079 9.881 ( -11.023 5.655 -6.261) 13.881 10.038 ( 7.106 -5.466 3.480) 9.617 11.459 ( 5.235 8.101 11.865) 15.291 11.593 ( -0.254 2.427 1.499) 2.864 12.101 ( -4.266 0.087 -4.425) 6.148 12.557 ( -8.963 -1.233 1.306) 9.141 12.716 ( 2.921 -4.207 4.376) 6.736 13.173 ( -6.399 -7.687 -2.208) 10.243 18.636 ( -10.186 -0.694 1.354) 10.299 19.030 ( -1.515 -9.080 -3.533) 9.860 19.190 ( -3.916 1.143 0.603) 4.124 19.447 ( 2.620 -2.424 -1.629) 3.924 21.065 ( -8.684 -9.037 3.726) 13.075 21.234 ( -6.927 -8.252 3.843) 11.439 27.575 ( 1.394 2.477 -0.712) 2.930 27.676 ( 1.225 0.993 0.346) 1.615 36.977 ( -1.247 10.045 -2.720) 10.481 37.608 ( 19.291 -2.875 -1.199) 19.541 38.031 ( 13.378 12.034 1.096) 18.028 39.193 ( 15.597 23.132 -18.633) 33.549 ======================= Grid point 571 (296/371) ======================= q-point: ( 0.62 0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.645 ( 3.507 8.199 6.533) 11.055 3.907 ( 12.494 21.944 4.206) 25.599 4.544 ( 15.253 7.590 -8.876) 19.211 5.995 ( -4.129 -4.321 4.783) 7.655 6.980 ( -3.318 -6.281 15.889) 17.404 7.388 ( -3.513 -9.987 -0.123) 10.588 7.644 ( 8.878 -3.246 -17.700) 20.066 8.198 ( 10.669 -1.887 -6.129) 12.448 8.434 ( -5.692 6.007 -8.721) 12.022 8.825 ( 5.922 14.458 11.942) 19.665 9.667 ( -12.508 3.920 -5.940) 14.391 10.104 ( 3.504 -5.601 7.748) 10.183 11.568 ( -6.285 -1.597 -3.146) 7.208 11.684 ( 6.963 1.639 7.701) 10.510 12.070 ( 3.465 5.745 8.921) 11.162 12.287 ( -16.033 -4.908 -1.079) 16.802 12.815 ( 5.728 -2.483 -0.672) 6.279 13.065 ( -0.683 -3.932 1.918) 4.428 18.497 ( -7.242 0.884 1.193) 7.393 18.881 ( -6.102 -5.838 -1.958) 8.668 19.174 ( 0.983 1.647 -0.871) 2.107 19.457 ( 2.879 -4.381 -1.780) 5.536 20.893 ( -5.784 -5.314 2.000) 8.105 21.079 ( -5.782 -5.882 1.480) 8.380 27.619 ( 1.660 2.434 -0.709) 3.031 27.710 ( 0.933 1.317 0.757) 1.782 37.035 ( -1.218 9.474 -3.377) 10.131 37.857 ( 14.505 -2.886 0.955) 14.820 38.287 ( 6.503 9.106 -4.112) 11.921 39.557 ( 16.766 14.657 -9.639) 24.266 ======================= Grid point 572 (297/371) ======================= q-point: ( 0.69 0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.758 ( 2.549 1.787 -0.940) 3.252 4.229 ( 4.045 11.960 1.578) 12.723 4.766 ( 9.318 7.679 -11.485) 16.664 5.952 ( -1.896 0.256 7.802) 8.033 6.977 ( 1.255 -8.139 12.485) 14.957 7.232 ( -5.908 -6.124 0.152) 8.510 7.581 ( 0.603 -5.764 -15.143) 16.215 8.239 ( 3.213 -5.050 -7.510) 9.603 8.483 ( 5.786 10.294 -4.371) 12.592 8.983 ( -7.233 16.059 3.489) 17.955 9.614 ( 3.318 -0.124 5.624) 6.531 10.122 ( -1.228 -5.625 12.056) 13.360 11.292 ( -15.847 -7.587 -11.953) 21.250 11.833 ( 9.180 -3.742 5.834) 11.502 11.967 ( -14.585 -3.919 1.641) 15.192 12.374 ( 11.448 9.812 10.821) 18.559 12.881 ( 5.407 -0.651 1.288) 5.596 13.025 ( -2.154 -3.030 0.166) 3.721 18.442 ( -2.199 2.969 0.720) 3.765 18.724 ( -7.035 -2.570 -0.535) 7.508 19.232 ( 4.762 1.026 -1.525) 5.104 19.433 ( 1.001 -5.223 -1.764) 5.603 20.791 ( -3.705 -2.432 0.300) 4.442 20.957 ( -3.871 -3.853 0.641) 5.499 27.664 ( 1.479 1.835 -0.268) 2.372 27.735 ( 0.083 1.342 0.718) 1.525 37.074 ( -2.221 8.257 -3.585) 9.272 38.027 ( 9.136 -4.026 2.264) 10.237 38.374 ( -1.000 6.616 -7.184) 9.817 39.910 ( 17.199 8.825 -4.510) 19.850 ======================= Grid point 573 (298/371) ======================= q-point: (-0.23 0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.746 ( -3.292 -1.958 -0.910) 3.938 4.258 ( -6.367 -1.423 1.236) 6.640 4.880 ( 4.376 7.159 -14.358) 16.630 6.034 ( 4.160 4.585 7.632) 9.828 6.937 ( 0.753 -17.583 4.948) 18.281 7.104 ( -5.792 2.990 -3.964) 7.629 7.469 ( -1.428 -2.461 -2.918) 4.075 8.157 ( -9.363 5.751 -4.076) 11.719 8.717 ( 15.407 3.175 -4.051) 16.244 9.046 ( -2.331 14.336 -0.946) 14.555 9.707 ( 3.416 -4.706 9.567) 11.196 10.074 ( -7.686 -5.789 15.159) 17.955 10.862 ( -16.186 -6.320 -14.229) 22.459 11.725 ( -10.661 0.668 0.127) 10.683 12.042 ( 16.064 -10.372 10.997) 22.058 12.633 ( 5.656 5.278 4.088) 8.750 12.895 ( -5.602 -2.639 0.885) 6.256 13.052 ( 8.296 3.257 1.262) 9.001 18.487 ( 3.188 4.207 -0.451) 5.298 18.615 ( -5.271 1.224 1.127) 5.527 19.311 ( 5.389 -0.542 -2.701) 6.052 19.389 ( 0.469 -4.290 -0.860) 4.401 20.709 ( -4.103 -1.749 -0.647) 4.507 20.902 ( -0.275 -1.283 0.770) 1.521 27.692 ( 0.378 0.792 -0.042) 0.879 27.746 ( -0.574 1.214 0.570) 1.459 37.078 ( -3.908 6.916 -3.341) 8.618 38.098 ( 3.285 -5.354 3.063) 6.989 38.317 ( -6.811 3.736 -7.870) 11.058 40.224 ( 15.829 5.177 -4.452) 17.239 ======================= Grid point 580 (299/371) ======================= q-point: ( 0.31 0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.389 ( -4.922 21.166 24.054) 32.416 2.786 ( -1.163 18.517 25.054) 31.176 3.929 ( -5.041 11.781 20.206) 23.926 6.108 ( -21.162 8.292 -1.430) 22.774 6.286 ( -2.754 6.371 -8.458) 10.941 7.176 ( 2.290 -5.942 10.639) 12.399 7.577 ( -0.547 8.442 -2.580) 8.845 8.110 ( -2.414 -1.679 -0.595) 3.000 8.585 ( 13.729 -2.843 -0.900) 14.049 8.979 ( -3.142 -0.870 -8.966) 9.540 9.339 ( -6.218 -4.139 -2.236) 7.797 10.079 ( 0.373 -14.095 4.153) 14.699 11.169 ( 4.096 -1.650 4.370) 6.212 11.725 ( -8.296 6.246 0.228) 10.387 11.838 ( 2.495 13.169 -1.143) 13.451 12.173 ( -13.425 14.593 -6.092) 20.744 13.383 ( 12.630 -6.508 -3.269) 14.579 13.681 ( 6.785 -4.808 -1.989) 8.550 18.945 ( 7.605 -3.911 2.843) 9.011 19.098 ( -2.713 -5.085 1.978) 6.093 19.373 ( -1.578 -5.903 -2.323) 6.537 19.527 ( 5.037 -0.085 -2.782) 5.755 21.401 ( 3.531 -6.220 8.993) 11.490 21.810 ( 13.246 -25.591 5.448) 29.327 27.485 ( -0.395 0.499 1.537) 1.663 27.685 ( 0.202 0.120 -1.832) 1.847 36.750 ( -7.286 0.036 -0.745) 7.324 36.996 ( -6.216 3.033 -0.360) 6.926 37.554 ( -16.900 15.678 1.151) 23.081 38.134 ( -11.464 49.709 -26.025) 57.269 ======================= Grid point 581 (300/371) ======================= q-point: ( 0.38 0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.672 ( -0.863 23.808 21.805) 32.296 3.097 ( 1.550 21.809 14.187) 26.063 4.138 ( 0.970 10.488 17.207) 20.175 5.845 ( -9.045 7.344 -6.615) 13.398 6.398 ( 6.104 8.955 -0.573) 10.852 7.264 ( 6.607 -2.830 9.856) 12.198 7.574 ( -4.765 -5.268 5.840) 9.196 8.018 ( -6.535 8.187 -3.651) 11.093 8.649 ( 2.507 -7.442 -9.593) 12.397 8.843 ( -6.018 0.882 -7.663) 9.784 9.427 ( 11.871 4.975 2.839) 13.181 9.948 ( 0.164 -14.823 4.033) 15.363 11.298 ( 5.062 2.248 8.869) 10.456 11.670 ( -2.909 5.933 -2.117) 6.939 11.928 ( -4.880 13.487 -5.018) 15.195 12.186 ( 1.755 9.640 -1.134) 9.864 13.421 ( 1.765 -4.998 -6.133) 8.106 13.644 ( -3.880 -6.970 -3.588) 8.747 19.004 ( -0.552 -7.342 1.644) 7.544 19.043 ( 3.918 -1.733 2.561) 4.991 19.245 ( -3.458 -9.200 -2.132) 10.057 19.563 ( 0.849 -0.251 -2.444) 2.599 21.402 ( -0.210 -9.136 8.099) 12.210 21.685 ( 0.222 -26.527 5.314) 27.055 27.500 ( 0.515 0.982 1.375) 1.767 27.672 ( -0.713 0.261 -1.708) 1.869 36.695 ( 3.266 1.190 0.437) 3.503 37.052 ( 0.465 11.741 -0.776) 11.776 37.481 ( -7.158 15.210 1.459) 16.873 38.447 ( 3.405 48.288 -24.223) 54.130 ======================= Grid point 582 (301/371) ======================= q-point: ( 0.46 0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.044 ( 5.784 26.348 15.772) 31.247 3.393 ( 3.382 18.794 13.007) 23.105 4.203 ( -7.052 6.241 -0.252) 9.420 5.893 ( 5.024 6.242 -1.913) 8.238 6.660 ( 16.800 5.398 3.221) 17.938 7.326 ( -1.935 -16.136 11.859) 20.118 7.518 ( 0.074 7.205 11.884) 13.898 8.027 ( -1.368 11.735 -10.406) 15.743 8.510 ( -3.324 -9.023 -4.662) 10.686 8.735 ( -6.925 9.441 -11.676) 16.535 9.665 ( 13.515 -3.631 -3.425) 14.407 9.923 ( 4.706 -4.087 8.456) 10.505 11.413 ( -0.304 3.813 10.821) 11.477 11.697 ( -2.381 8.741 -3.929) 9.875 12.004 ( 4.287 9.956 -3.228) 11.310 12.308 ( 6.523 1.763 0.030) 6.758 13.273 ( -12.583 -3.592 -5.979) 14.387 13.412 ( -9.156 -10.924 -2.320) 14.441 18.920 ( -3.697 -2.725 -0.330) 4.604 19.053 ( -2.671 -8.770 -2.961) 9.634 19.137 ( 4.494 -6.200 4.091) 8.682 19.523 ( -3.471 -0.639 -2.313) 4.220 21.301 ( -4.284 -12.318 5.426) 14.125 21.448 ( -5.036 -18.376 5.886) 19.942 27.533 ( 1.199 1.791 0.454) 2.202 27.660 ( -0.367 0.997 -0.905) 1.395 36.872 ( 16.075 -0.043 -0.828) 16.097 37.138 ( -4.977 15.322 -1.019) 16.142 37.660 ( 8.350 15.210 4.656) 17.965 38.818 ( 6.840 37.809 -23.879) 45.239 ======================= Grid point 583 (302/371) ======================= q-point: ( 0.54 0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.500 ( 11.054 25.007 10.437) 29.266 3.681 ( 1.086 16.785 14.447) 22.173 4.151 ( 0.866 6.840 -10.180) 12.295 5.996 ( 3.043 2.070 -0.409) 3.703 6.978 ( 19.648 -8.637 -2.399) 21.596 7.171 ( -6.175 -11.506 16.463) 21.013 7.645 ( -5.174 8.716 2.413) 10.419 8.081 ( 2.857 4.407 -5.806) 7.829 8.413 ( 5.838 -5.355 0.029) 7.922 8.696 ( -6.559 19.105 -9.683) 22.400 9.791 ( 13.750 -10.185 -2.083) 17.237 10.004 ( -2.017 3.285 1.980) 4.333 11.522 ( 2.310 5.455 11.134) 12.612 11.702 ( -4.760 9.203 -2.461) 10.650 12.109 ( 1.071 1.050 -3.387) 3.704 12.466 ( 11.900 0.084 0.914) 11.935 12.917 ( -21.243 -4.462 1.516) 21.759 13.181 ( -6.035 -9.343 -3.296) 11.601 18.808 ( -9.574 0.305 0.624) 9.599 18.915 ( 1.314 -9.852 -4.810) 11.042 19.192 ( 4.138 -4.318 3.783) 7.076 19.429 ( -4.675 -1.528 -2.291) 5.426 21.109 ( -6.455 -12.191 3.594) 14.255 21.260 ( -4.973 -10.952 3.896) 12.643 27.573 ( 1.315 2.428 -0.793) 2.873 27.675 ( 0.792 1.710 0.367) 1.920 37.117 ( 4.721 5.930 2.733) 8.057 37.234 ( 10.612 8.226 -7.738) 15.497 38.009 ( 11.426 13.917 8.286) 19.822 39.128 ( 8.455 26.550 -20.054) 34.330 ======================= Grid point 584 (303/371) ======================= q-point: ( 0.62 0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.790 ( -3.887 8.010 8.189) 12.097 3.977 ( 9.118 24.522 4.298) 26.513 4.333 ( 14.705 9.910 -6.623) 18.929 6.034 ( -1.166 1.495 3.975) 4.404 6.988 ( 1.849 -17.079 4.186) 17.681 7.199 ( 8.347 -6.269 3.540) 11.023 7.555 ( -6.702 2.688 -7.765) 10.604 8.032 ( 0.132 -8.731 -6.398) 10.825 8.568 ( 0.845 12.039 -1.982) 12.230 8.864 ( 9.384 17.481 4.667) 20.382 9.873 ( -7.656 -1.480 -1.717) 7.984 9.930 ( 6.845 -6.308 -0.854) 9.348 11.649 ( -0.853 3.846 -0.247) 3.947 11.689 ( -3.689 0.731 4.424) 5.806 12.101 ( 2.073 3.552 3.984) 5.726 12.553 ( -18.126 -1.177 1.338) 18.213 12.657 ( 8.537 -4.025 0.288) 9.443 13.038 ( -1.201 -5.829 0.635) 5.985 18.653 ( -9.299 0.458 1.198) 9.387 18.845 ( 0.926 -5.775 -4.274) 7.244 19.208 ( -1.312 -0.613 2.066) 2.523 19.350 ( 0.940 -5.321 -2.038) 5.775 20.934 ( -5.112 -7.617 2.160) 9.425 21.107 ( -4.707 -7.923 1.599) 9.354 27.615 ( 1.451 2.857 -1.066) 3.377 27.713 ( 1.126 1.801 0.907) 2.310 37.188 ( -4.835 12.926 0.080) 13.801 37.510 ( 19.924 -0.447 -6.865) 21.078 38.322 ( 6.061 11.688 7.693) 15.249 39.404 ( 11.770 16.447 -13.057) 24.073 ======================= Grid point 585 (304/371) ======================= q-point: ( 0.69 0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.807 ( -3.592 5.444 1.225) 6.637 4.305 ( 4.460 15.358 1.705) 16.084 4.622 ( 11.837 8.297 -5.623) 15.511 6.040 ( -3.388 1.717 8.542) 9.348 6.877 ( 2.028 -16.083 0.545) 16.219 7.252 ( 0.795 -0.164 -0.767) 1.116 7.474 ( 0.000 -1.046 -4.746) 4.859 7.966 ( 8.899 -8.373 -6.880) 14.023 8.628 ( -5.154 15.297 -5.879) 17.179 9.212 ( 6.227 12.844 10.248) 17.571 9.640 ( -10.944 -0.852 -3.329) 11.471 10.024 ( 9.155 -10.450 5.428) 14.916 11.441 ( -16.133 -2.999 -10.061) 19.248 11.715 ( 4.071 -6.277 7.840) 10.837 12.194 ( -13.376 -2.928 -0.633) 13.707 12.374 ( 5.181 10.336 11.812) 16.529 12.769 ( 8.125 -0.187 -1.095) 8.201 12.999 ( 0.198 -5.332 1.209) 5.471 18.545 ( -6.149 2.577 0.921) 6.731 18.775 ( -2.332 -3.084 -1.871) 4.296 19.193 ( -0.345 1.097 -0.600) 1.297 19.325 ( 3.583 -7.356 -1.164) 8.264 20.824 ( -3.245 -3.432 0.693) 4.774 20.978 ( -3.803 -5.643 0.545) 6.827 27.661 ( 1.344 2.786 -0.703) 3.172 27.747 ( 0.593 1.456 0.885) 1.804 37.221 ( -5.264 12.155 -1.267) 13.306 37.765 ( 16.240 -1.620 -5.814) 17.325 38.485 ( -2.006 9.178 4.374) 10.363 39.691 ( 15.223 8.418 -6.521) 18.577 ======================= Grid point 586 (305/371) ======================= q-point: (-0.23 0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.797 ( -3.383 3.936 -0.226) 5.195 4.391 ( -6.076 3.955 1.640) 7.433 4.792 ( 6.047 4.846 -8.507) 11.507 6.070 ( 0.107 1.592 10.084) 10.209 6.743 ( 1.850 -16.920 -5.851) 17.999 7.234 ( -5.619 9.249 -6.419) 12.583 7.460 ( 0.626 -2.756 5.831) 6.480 8.120 ( 15.171 1.045 -6.209) 16.425 8.647 ( -3.254 10.142 -4.438) 11.539 9.302 ( -11.299 13.794 1.353) 17.882 9.605 ( 7.574 -7.251 7.720) 13.020 10.072 ( 5.189 -11.446 7.780) 14.781 11.043 ( -19.896 -3.446 -12.757) 23.885 11.785 ( 8.192 -9.677 8.886) 15.483 11.934 ( -12.891 -2.727 4.310) 13.863 12.625 ( 5.943 7.835 3.926) 10.589 12.925 ( -2.479 -6.117 -1.527) 6.774 12.936 ( 9.682 3.559 2.518) 10.619 18.508 ( -2.147 3.125 -0.618) 3.842 18.714 ( -3.138 1.458 1.309) 3.700 19.210 ( 3.184 -1.364 -2.703) 4.394 19.311 ( 2.752 -5.521 -0.324) 6.177 20.753 ( -3.355 -1.343 -0.530) 3.653 20.897 ( -1.098 -3.142 0.691) 3.399 27.696 ( 0.430 1.923 -0.338) 1.999 27.768 ( -0.061 1.169 0.669) 1.348 37.229 ( -5.930 10.472 -1.536) 12.132 37.939 ( 10.365 -1.985 -4.796) 11.592 38.483 ( -8.549 5.999 1.944) 10.623 39.976 ( 16.070 3.390 -4.397) 17.002 ======================= Grid point 593 (306/371) ======================= q-point: ( 0.31 0.46 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.840 ( -9.797 25.326 17.003) 32.039 3.103 ( -4.034 13.380 24.229) 27.970 4.140 ( -6.407 8.578 -3.035) 11.129 6.319 ( 2.418 5.992 1.502) 6.634 6.650 ( -31.061 3.994 -5.545) 31.804 7.118 ( 4.134 -9.627 14.286) 17.716 7.653 ( -6.293 6.320 0.461) 8.931 8.221 ( 2.514 19.252 -2.735) 19.607 8.339 ( 7.079 -6.963 -2.376) 10.210 8.917 ( 0.674 -1.132 -11.120) 11.197 9.394 ( -6.088 -9.484 -2.331) 11.508 10.023 ( -3.039 -8.674 6.481) 11.246 11.163 ( -1.349 0.699 7.769) 7.916 11.847 ( 3.590 12.194 1.595) 12.811 11.977 ( -8.101 3.900 -3.189) 9.540 12.467 ( -12.951 7.510 -3.229) 15.315 13.009 ( 21.800 -8.987 0.476) 23.585 13.478 ( 10.273 -4.482 -3.511) 11.746 18.779 ( 9.276 -3.973 1.987) 10.285 19.064 ( -0.906 -8.221 -0.567) 8.290 19.366 ( 1.308 -1.397 0.426) 1.960 19.410 ( 2.668 -1.652 -3.210) 4.489 21.278 ( 7.839 -9.217 5.849) 13.439 21.447 ( 10.557 -14.585 6.236) 19.054 27.510 ( -1.292 0.718 0.658) 1.617 27.684 ( -0.118 1.621 -1.194) 2.017 36.847 ( -2.273 5.858 -2.732) 6.852 37.203 ( -16.765 -1.912 3.614) 17.256 38.019 ( -16.775 20.803 0.105) 26.724 38.596 ( -15.625 30.834 -27.578) 44.220 ======================= Grid point 594 (307/371) ======================= q-point: ( 0.38 0.46 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.059 ( -5.226 24.478 19.051) 31.455 3.340 ( -0.321 19.874 10.631) 22.541 4.188 ( 4.460 5.228 -0.356) 6.881 6.145 ( -16.589 5.756 -12.147) 21.351 6.505 ( -5.430 11.274 11.798) 17.198 7.173 ( 5.164 -7.852 13.045) 16.078 7.624 ( -4.238 -0.577 5.917) 7.301 8.198 ( -7.352 5.499 -6.675) 11.351 8.449 ( 5.513 -3.821 -9.999) 12.041 8.845 ( 3.581 2.838 -9.477) 10.521 9.407 ( 1.267 7.788 6.524) 10.239 9.877 ( -3.908 -12.047 5.444) 13.785 11.262 ( 5.869 2.718 8.665) 10.813 11.815 ( -8.644 4.591 -2.427) 10.084 12.047 ( 2.436 10.290 -2.222) 10.805 12.321 ( -10.272 3.927 0.995) 11.042 13.212 ( 12.758 -6.677 -5.999) 15.599 13.548 ( 5.507 -4.816 -5.748) 9.303 18.870 ( 5.457 -8.066 2.000) 9.942 18.990 ( 1.856 -4.484 -1.341) 5.034 19.252 ( -6.106 -6.164 0.939) 8.727 19.493 ( 5.428 -0.740 -2.217) 5.910 21.304 ( 4.284 -12.906 5.471) 14.657 21.449 ( 4.823 -17.295 5.660) 18.826 27.511 ( -0.105 1.081 0.806) 1.352 27.686 ( -0.842 1.675 -1.338) 2.303 36.792 ( -9.710 2.935 1.901) 10.320 37.113 ( 2.460 10.235 -0.895) 10.564 37.871 ( -19.225 16.496 1.720) 25.390 38.713 ( 0.111 38.617 -23.842) 45.384 ======================= Grid point 595 (308/371) ======================= q-point: ( 0.46 0.46 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.309 ( -0.929 21.470 13.659) 25.463 3.559 ( 1.523 19.531 4.338) 20.065 4.259 ( 1.643 -0.843 -8.132) 8.339 6.049 ( -5.512 15.574 0.755) 16.537 6.577 ( -0.614 4.577 7.711) 8.988 7.261 ( 3.172 -9.275 15.366) 18.226 7.608 ( 1.191 3.096 9.216) 9.795 8.094 ( -4.624 2.469 -10.551) 11.781 8.378 ( 1.858 -8.408 -10.785) 13.800 8.952 ( -2.535 19.357 -6.172) 20.475 9.435 ( 0.857 -8.842 -1.743) 9.053 9.883 ( 5.726 2.420 11.049) 12.678 11.452 ( 6.673 1.141 11.291) 13.165 11.755 ( -1.619 6.162 -3.846) 7.442 12.122 ( -4.704 13.446 -7.114) 15.922 12.242 ( 0.120 -4.729 5.844) 7.519 13.233 ( 2.839 -7.040 -8.114) 11.111 13.470 ( -5.629 -5.358 -6.763) 10.302 18.827 ( 2.412 -10.207 -2.361) 10.751 19.025 ( 4.391 -5.072 2.051) 7.015 19.095 ( -6.581 -3.862 1.151) 7.717 19.527 ( 0.928 -1.156 -1.723) 2.273 21.228 ( 0.080 -15.570 4.267) 16.145 21.361 ( -0.334 -14.174 5.117) 15.073 27.534 ( 0.831 1.723 0.337) 1.943 27.679 ( -0.978 1.802 -0.898) 2.238 36.745 ( 1.123 3.256 0.551) 3.488 37.325 ( 3.960 14.724 4.322) 15.848 37.798 ( -7.824 16.705 0.627) 18.457 38.970 ( 2.749 33.733 -21.304) 39.992 ======================= Grid point 596 (309/371) ======================= q-point: ( 0.54 0.46 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.592 ( 7.854 17.574 5.087) 19.910 3.820 ( 4.253 17.121 8.439) 19.556 4.180 ( -1.600 1.295 -12.969) 13.131 6.136 ( -7.011 16.735 6.364) 19.229 6.655 ( 8.348 -8.006 0.209) 11.568 7.228 ( -3.475 -9.430 16.305) 19.154 7.832 ( 0.043 11.211 6.622) 13.021 8.006 ( 3.799 0.364 -5.973) 7.088 8.258 ( 1.259 -8.288 -6.650) 10.700 9.002 ( -10.588 21.831 -5.183) 24.811 9.422 ( 14.194 -12.344 -6.182) 19.801 10.067 ( 2.265 6.125 7.633) 10.045 11.573 ( 2.431 -0.839 10.856) 11.156 11.823 ( 0.652 7.869 -3.304) 8.559 12.105 ( -2.486 3.459 -1.773) 4.614 12.299 ( 7.388 -0.867 0.390) 7.448 13.108 ( -5.113 -5.898 -9.133) 12.014 13.224 ( -13.126 -6.020 -1.544) 14.523 18.759 ( 2.857 -9.272 -5.249) 11.031 18.932 ( -5.618 -5.033 2.083) 7.825 19.094 ( 3.320 -2.162 2.776) 4.837 19.485 ( -3.556 -1.268 -1.309) 3.996 21.081 ( -2.930 -13.516 3.307) 14.220 21.237 ( -2.778 -11.135 3.309) 11.944 27.571 ( 1.255 2.484 -0.554) 2.838 27.686 ( 0.051 1.898 0.007) 1.898 36.885 ( 12.072 2.401 -1.064) 12.354 37.461 ( -7.551 16.209 4.022) 18.328 37.986 ( 9.999 13.989 4.474) 17.767 39.196 ( 2.623 26.656 -18.003) 32.273 ======================= Grid point 597 (310/371) ======================= q-point: ( 0.62 0.46 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.892 ( 5.300 6.186 3.104) 8.717 4.042 ( 6.948 13.506 0.355) 15.193 4.240 ( 7.187 13.741 -3.325) 15.859 6.199 ( -7.916 14.733 8.688) 18.847 6.668 ( 9.390 -16.136 -6.155) 19.657 7.185 ( -1.983 -5.913 12.609) 14.067 7.714 ( -11.449 2.257 -6.517) 13.366 7.962 ( -5.545 -7.342 -3.725) 9.927 8.486 ( 18.852 5.827 8.104) 21.331 9.026 ( -5.371 20.177 -6.583) 21.893 9.558 ( 17.046 -10.453 -2.976) 20.216 10.085 ( -8.488 3.624 -0.115) 9.230 11.642 ( 2.385 -6.016 8.222) 10.463 11.828 ( -6.334 5.639 -2.993) 8.993 12.117 ( 1.837 3.166 3.089) 4.790 12.447 ( 10.878 -0.260 -2.808) 11.238 12.843 ( -16.261 -3.262 -4.402) 17.159 13.026 ( -4.404 -4.751 1.253) 6.599 18.694 ( 2.028 -8.785 -2.028) 9.242 18.824 ( -5.337 1.084 -2.465) 5.977 19.141 ( 4.271 -4.610 3.554) 7.220 19.384 ( -6.350 -1.102 -1.083) 6.535 20.935 ( -3.300 -9.055 2.211) 9.888 21.103 ( -3.502 -8.595 1.421) 9.389 27.614 ( 1.388 3.075 -1.017) 3.523 27.715 ( 1.063 1.652 0.618) 2.059 37.137 ( 16.773 0.912 -1.748) 16.888 37.484 ( -8.437 15.991 0.197) 18.081 38.329 ( 11.524 10.242 8.909) 17.807 39.377 ( 3.506 19.161 -13.412) 23.650 ======================= Grid point 598 (311/371) ======================= q-point: ( 0.69 0.46 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.921 ( -2.571 3.684 -0.397) 4.510 4.342 ( 8.876 12.396 -0.569) 15.257 4.505 ( 10.158 9.498 0.501) 13.916 6.228 ( -9.023 8.094 12.036) 17.082 6.615 ( 7.457 -14.907 -10.248) 19.567 7.209 ( 4.122 -0.517 6.276) 7.526 7.542 ( -8.049 2.037 -3.533) 9.023 7.807 ( -1.554 -5.375 -4.129) 6.953 8.769 ( 3.600 7.911 0.348) 8.699 9.187 ( 7.649 11.983 1.988) 14.354 9.714 ( 15.177 -11.720 -0.307) 19.178 9.888 ( -15.838 1.851 -3.996) 16.439 11.612 ( -0.984 -12.994 7.888) 15.233 11.671 ( -12.225 2.590 -5.420) 13.622 12.252 ( 3.401 2.383 0.612) 4.198 12.565 ( -12.082 2.010 4.285) 12.976 12.603 ( 10.581 0.964 -3.080) 11.062 12.964 ( -0.902 -2.993 1.413) 3.431 18.642 ( -1.174 -4.276 2.742) 5.213 18.751 ( -2.327 1.464 -5.895) 6.505 19.180 ( 4.533 -5.888 2.409) 7.812 19.266 ( -6.098 0.125 -0.923) 6.168 20.835 ( -2.165 -4.622 1.024) 5.206 20.982 ( -3.316 -6.243 0.345) 7.078 27.663 ( 1.466 3.273 -0.833) 3.682 27.750 ( 1.052 1.026 0.688) 1.622 37.379 ( 7.987 2.911 0.954) 8.554 37.523 ( 1.593 11.260 -4.918) 12.391 38.595 ( 4.190 7.971 8.624) 12.468 39.549 ( 7.406 11.256 -8.037) 15.689 ======================= Grid point 599 (312/371) ======================= q-point: ( 0.77 0.46 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.914 ( -3.787 5.878 0.456) 7.008 4.495 ( 0.161 4.849 -0.686) 4.900 4.695 ( 6.175 2.633 -2.237) 7.076 6.184 ( -6.773 -2.168 13.401) 15.171 6.524 ( 2.716 -9.631 -12.016) 15.637 7.368 ( 2.470 14.974 -5.211) 16.047 7.456 ( -1.086 -3.598 6.410) 7.430 7.841 ( 11.607 2.345 -3.082) 12.236 8.814 ( -5.254 9.458 -4.147) 11.587 9.421 ( 10.380 -4.025 6.652) 12.969 9.630 ( -14.933 6.346 -2.284) 16.386 9.815 ( 11.835 -15.180 0.894) 19.269 11.317 ( -21.764 1.061 -8.545) 23.405 11.619 ( 5.519 -13.149 10.316) 17.601 12.128 ( -10.221 -4.227 -0.445) 11.070 12.607 ( 4.368 3.386 0.786) 5.582 12.800 ( 9.257 4.333 2.139) 10.442 12.928 ( -1.046 -1.159 0.725) 1.721 18.592 ( -4.341 1.253 0.288) 4.527 18.729 ( 1.513 -0.482 -0.840) 1.797 19.164 ( -0.066 -4.180 -2.544) 4.893 19.230 ( 1.049 -0.480 1.825) 2.159 20.782 ( -1.711 -1.302 -0.127) 2.154 20.888 ( -1.979 -4.349 0.332) 4.790 27.708 ( 0.734 2.931 -0.582) 3.077 27.773 ( 0.671 0.248 0.638) 0.959 37.431 ( -6.047 9.246 0.903) 11.085 37.706 ( 12.993 1.721 -5.428) 14.187 38.690 ( -5.471 6.954 5.609) 10.476 39.751 ( 11.997 4.556 -4.198) 13.502 ======================= Grid point 606 (313/371) ======================= q-point: ( 0.31 0.54 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.330 ( -12.291 24.195 10.339) 29.041 3.416 ( -7.160 10.359 18.025) 21.988 4.336 ( -12.104 9.264 -10.168) 18.323 6.272 ( 9.885 1.000 4.541) 10.924 6.989 ( -6.970 -5.710 4.379) 10.018 7.061 ( -12.757 -8.490 -5.472) 16.272 7.894 ( -2.323 3.353 5.652) 6.971 8.133 ( 0.017 1.850 -1.391) 2.315 8.422 ( -1.335 17.918 -8.297) 19.791 8.895 ( -3.431 3.421 -2.342) 5.382 9.282 ( 3.698 -13.069 -5.362) 14.602 10.055 ( -3.978 -6.555 7.654) 10.834 11.333 ( -10.429 4.018 11.994) 16.394 11.895 ( 6.170 11.858 1.745) 13.480 12.053 ( -1.315 -0.050 -3.977) 4.189 12.565 ( 18.597 -6.125 -1.470) 19.635 12.703 ( -8.422 -1.691 3.344) 9.218 13.258 ( 9.036 -2.907 -3.386) 10.078 18.608 ( 8.802 -2.111 1.492) 9.173 18.985 ( 0.481 -9.035 -0.632) 9.070 19.238 ( 7.555 0.923 -2.335) 7.961 19.444 ( -4.838 -2.252 -0.666) 5.378 21.068 ( 8.599 -8.862 3.676) 12.883 21.236 ( 7.192 -8.016 3.509) 11.326 27.548 ( -2.129 1.188 0.175) 2.444 27.703 ( -0.295 2.161 -0.569) 2.254 36.920 ( -1.077 7.642 -3.558) 8.499 37.500 ( -18.487 -2.871 6.095) 19.676 38.408 ( -6.313 22.457 -8.536) 24.840 38.984 ( -21.152 15.263 -15.535) 30.359 ======================= Grid point 607 (314/371) ======================= q-point: ( 0.38 0.54 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.466 ( -6.753 19.730 15.428) 25.941 3.594 ( -0.953 20.275 10.912) 23.044 4.208 ( -5.622 6.737 -9.842) 13.185 6.315 ( -10.063 1.290 -10.640) 14.701 6.688 ( -0.379 0.220 4.417) 4.439 7.097 ( 3.588 -7.841 14.998) 17.300 7.849 ( -11.698 7.541 7.138) 15.641 8.107 ( 5.777 -9.109 -11.022) 15.422 8.458 ( -10.838 -3.209 -5.138) 12.416 8.788 ( 3.782 14.875 -8.766) 17.675 9.480 ( 9.275 12.695 6.757) 17.113 9.899 ( -8.345 -11.503 6.183) 15.498 11.306 ( -3.315 3.077 9.884) 10.870 11.952 ( -5.913 -1.405 -3.998) 7.275 12.072 ( 2.428 8.607 1.349) 9.044 12.536 ( -10.668 1.072 0.708) 10.745 12.849 ( 20.070 -6.549 -2.800) 21.296 13.349 ( 8.857 -3.868 -6.210) 11.488 18.725 ( 6.078 -4.497 2.124) 7.854 18.901 ( 1.142 -6.297 -2.263) 6.788 19.309 ( -5.845 -5.544 1.796) 8.254 19.365 ( 7.289 -0.286 -2.623) 7.752 21.109 ( 6.211 -12.101 3.478) 14.039 21.270 ( 5.268 -10.382 3.522) 12.163 27.537 ( -1.164 1.699 0.530) 2.127 27.713 ( -0.729 2.369 -1.007) 2.675 36.995 ( -3.768 9.697 1.673) 10.537 37.220 ( -10.883 2.511 -0.358) 11.175 38.353 ( -18.726 14.891 -0.384) 23.928 38.920 ( -1.978 27.499 -17.801) 32.817 ======================= Grid point 608 (315/371) ======================= q-point: ( 0.46 0.54 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.598 ( -5.883 13.083 10.930) 18.035 3.785 ( -2.705 21.547 3.199) 21.950 4.166 ( 0.050 1.970 -10.950) 11.126 6.172 ( -1.217 7.279 -6.925) 10.120 6.775 ( -3.434 0.918 14.383) 14.815 7.203 ( 7.675 -1.618 12.846) 15.051 7.744 ( -11.259 3.908 6.647) 13.646 8.040 ( 1.586 -6.384 -9.681) 11.704 8.242 ( -0.021 -6.642 -8.362) 10.679 9.031 ( 5.755 20.495 -9.471) 23.299 9.538 ( -15.191 -5.249 4.893) 16.801 9.878 ( 8.213 7.922 9.848) 15.073 11.386 ( 5.264 -1.036 9.043) 10.515 11.831 ( -4.621 -0.208 -2.399) 5.211 12.171 ( 1.932 3.955 0.835) 4.480 12.377 ( -10.657 2.378 -0.468) 10.929 13.017 ( 10.684 -5.994 -7.185) 14.202 13.389 ( 4.374 -4.364 -8.311) 10.356 18.696 ( 0.455 -9.770 -0.281) 9.784 18.918 ( 4.450 -3.407 -0.595) 5.636 19.166 ( -5.631 -3.979 1.742) 7.111 19.456 ( 5.196 -1.184 -1.211) 5.465 21.080 ( 2.888 -13.225 3.107) 13.889 21.249 ( 2.362 -10.959 3.158) 11.647 27.547 ( -0.146 2.209 0.439) 2.257 27.712 ( -1.232 2.155 -1.005) 2.678 36.874 ( -11.231 3.407 1.956) 11.898 37.356 ( 8.933 13.897 3.194) 16.826 38.178 ( -17.563 14.053 0.076) 22.494 39.119 ( 2.699 27.836 -15.856) 32.149 ======================= Grid point 609 (316/371) ======================= q-point: ( 0.54 0.54 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.667 ( -0.286 10.582 0.449) 10.595 3.954 ( 1.270 9.045 1.029) 9.192 4.141 ( -0.271 9.646 -6.366) 11.561 6.279 ( 6.521 4.791 -3.717) 8.905 6.725 ( -11.596 2.503 14.572) 18.790 7.316 ( -4.958 -1.673 13.263) 14.258 7.795 ( 12.463 3.023 1.467) 12.908 7.947 ( -0.828 -2.016 -3.603) 4.211 8.213 ( -0.137 1.450 -4.838) 5.053 9.119 ( 0.931 -12.233 -6.843) 14.048 9.345 ( -8.707 18.757 -2.508) 20.831 10.128 ( 4.233 9.373 8.102) 13.093 11.501 ( 7.014 -8.914 9.709) 14.930 11.815 ( 2.530 3.485 -1.938) 4.722 12.182 ( -2.830 -7.548 6.225) 10.185 12.283 ( -3.550 13.218 -9.788) 16.826 13.026 ( 2.091 -4.775 -7.787) 9.371 13.304 ( -4.364 -5.281 -6.410) 9.382 18.611 ( 1.438 -8.699 -3.363) 9.437 18.901 ( 0.318 -9.135 3.171) 9.675 19.110 ( -1.567 2.655 0.157) 3.087 19.490 ( 0.894 -1.462 -0.354) 1.750 20.997 ( 0.003 -11.853 2.594) 12.134 21.177 ( -0.449 -10.139 2.217) 10.388 27.577 ( 0.701 2.769 -0.069) 2.857 27.708 ( -0.825 1.759 -0.550) 2.019 36.820 ( -0.290 3.868 0.898) 3.982 37.662 ( 6.064 12.517 9.936) 17.093 38.086 ( -7.162 14.121 -2.707) 16.063 39.330 ( 1.453 24.680 -12.574) 27.737 ======================= Grid point 610 (317/371) ======================= q-point: ( 0.62 0.54 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.818 ( 7.904 4.666 -0.597) 9.198 4.016 ( 4.879 7.416 -7.699) 11.751 4.301 ( 2.502 14.087 5.598) 15.364 6.352 ( 6.794 -6.853 -8.476) 12.844 6.649 ( -14.819 11.883 16.145) 24.929 7.242 ( -5.199 -4.231 8.460) 10.794 7.761 ( -2.525 -7.573 -7.789) 11.153 8.119 ( -12.521 4.130 -1.662) 13.289 8.257 ( 18.970 7.792 10.073) 22.848 9.029 ( 11.360 -13.488 -4.493) 18.198 9.417 ( -4.554 19.034 -7.304) 20.889 10.227 ( -3.927 4.457 1.130) 6.047 11.534 ( 4.580 -15.099 9.471) 18.402 11.891 ( 2.294 0.393 -0.432) 2.367 12.127 ( 0.950 0.502 1.373) 1.744 12.342 ( 2.033 10.073 -8.203) 13.149 12.934 ( -4.707 -1.945 -7.207) 8.825 13.118 ( -8.480 -4.910 -0.593) 9.817 18.554 ( 2.954 -6.964 -3.420) 8.302 18.836 ( 0.095 -7.077 1.423) 7.220 19.121 ( -1.222 2.573 1.198) 3.090 19.455 ( -3.443 -1.334 0.330) 3.707 20.898 ( -1.326 -8.872 1.928) 9.175 21.076 ( -2.090 -8.179 1.012) 8.502 27.618 ( 1.113 3.146 -0.610) 3.392 27.718 ( 0.418 1.254 0.024) 1.322 36.933 ( 9.126 3.030 -0.000) 9.616 37.786 ( -8.676 11.646 6.505) 15.913 38.254 ( 11.541 9.981 2.595) 15.477 39.493 ( -0.850 20.745 -8.666) 22.498 ======================= Grid point 611 (318/371) ======================= q-point: ( 0.69 0.54 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.924 ( 3.760 1.631 -1.640) 4.415 4.247 ( 12.596 10.288 -3.500) 16.635 4.489 ( 4.242 7.655 5.831) 10.517 6.300 ( 5.257 -13.251 -9.450) 17.103 6.625 ( -14.373 14.519 13.703) 24.601 7.188 ( 0.056 -3.077 5.039) 5.904 7.607 ( -4.001 -6.081 -4.638) 8.632 7.942 ( -13.288 9.505 -0.371) 16.341 8.626 ( 16.463 -1.637 5.994) 17.596 9.164 ( 13.696 -1.844 -2.605) 14.063 9.468 ( -0.572 8.575 -5.884) 10.415 10.102 ( -11.635 0.266 -5.341) 12.805 11.472 ( 3.166 -19.670 10.532) 22.536 11.860 ( -5.379 -0.627 -1.525) 5.626 12.186 ( 1.791 1.116 -6.029) 6.388 12.470 ( 7.568 8.603 -3.601) 12.010 12.766 ( -9.903 0.295 -1.071) 9.965 12.993 ( -3.492 -1.233 1.255) 3.910 18.546 ( 4.407 -5.488 -0.295) 7.044 18.782 ( -0.879 -2.315 -3.285) 4.113 19.125 ( -0.988 -0.051 2.640) 2.819 19.370 ( -5.801 -0.399 0.822) 5.873 20.818 ( -0.985 -5.399 1.172) 5.612 20.974 ( -2.587 -5.770 0.073) 6.324 27.665 ( 1.455 3.010 -0.606) 3.398 27.742 ( 1.118 0.756 0.178) 1.361 37.148 ( 14.215 1.533 -0.798) 14.319 37.757 ( -9.537 11.005 2.096) 14.713 38.557 ( 12.277 4.997 6.669) 14.838 39.606 ( -2.038 16.175 -4.858) 17.012 ======================= Grid point 612 (319/371) ======================= q-point: (-0.23 -0.46 -0.77) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.986 ( 1.257 3.752 -0.159) 3.961 4.456 ( 6.658 2.810 -2.981) 7.818 4.631 ( 4.195 1.020 3.091) 5.310 6.198 ( 1.751 -12.324 -5.471) 13.597 6.558 ( -12.446 6.895 6.774) 15.759 7.311 ( 11.872 5.828 4.025) 13.824 7.484 ( -2.909 -3.942 -1.542) 5.136 7.909 ( -7.051 17.969 0.744) 19.317 8.826 ( 9.471 -3.250 0.562) 10.029 9.315 ( 4.431 -1.110 -0.151) 4.570 9.504 ( 6.283 -5.802 -3.444) 9.220 9.864 ( -11.787 0.828 -5.758) 13.144 11.429 ( 6.074 -16.473 12.034) 21.285 11.667 ( -18.401 2.431 -4.253) 19.042 12.088 ( 0.273 -10.838 -11.160) 15.559 12.608 ( -0.809 4.260 -3.434) 5.531 12.761 ( 5.479 6.059 8.940) 12.110 12.960 ( -2.130 2.736 -1.171) 3.660 18.580 ( 4.298 -5.027 2.763) 7.168 18.732 ( -2.062 2.457 -5.659) 6.505 19.113 ( -0.575 -2.348 1.831) 3.033 19.290 ( -4.506 1.232 1.297) 4.848 20.779 ( 0.029 -2.385 0.459) 2.429 20.887 ( -2.572 -3.741 -0.294) 4.549 27.714 ( 1.627 2.427 -0.292) 2.936 27.763 ( 0.734 0.189 0.086) 0.762 37.387 ( 13.868 0.039 -1.212) 13.921 37.719 ( -7.202 9.034 0.575) 11.568 38.779 ( 5.657 3.181 5.610) 8.579 39.695 ( 0.233 10.730 -1.780) 10.879 ======================= Grid point 619 (320/371) ======================= q-point: ( 0.31 0.62 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.696 ( -7.922 9.029 7.157) 13.982 3.784 ( -12.407 18.985 5.653) 23.373 4.572 ( -11.992 7.350 -10.300) 17.434 6.094 ( 12.741 -2.568 7.028) 14.775 6.992 ( 1.933 -3.312 16.334) 16.778 7.233 ( -19.081 -6.801 -19.786) 28.316 7.757 ( 10.203 -3.801 -0.631) 10.906 8.240 ( -11.451 -9.301 -5.425) 15.718 8.527 ( 5.757 16.500 -7.638) 19.072 8.956 ( 16.555 11.626 2.104) 20.339 9.193 ( -18.550 -6.456 2.826) 19.843 10.079 ( -1.504 -7.737 9.270) 12.168 11.630 ( -5.827 4.170 8.466) 11.091 11.818 ( 6.305 2.791 -1.238) 7.005 12.085 ( 1.376 3.731 6.760) 7.843 12.227 ( 10.994 -4.461 -2.510) 12.128 12.810 ( -6.019 -2.919 0.326) 6.697 13.120 ( 4.606 -1.848 -1.171) 5.099 18.484 ( 6.206 0.859 1.113) 6.363 18.855 ( 5.486 -7.409 -0.074) 9.219 19.176 ( -0.399 1.193 -2.016) 2.376 19.479 ( -2.776 -2.881 -1.386) 4.234 20.897 ( 5.927 -5.140 1.831) 8.057 21.075 ( 5.938 -6.014 1.192) 8.535 27.603 ( -2.600 1.903 0.273) 3.233 27.722 ( 0.051 1.606 -0.230) 1.623 36.986 ( -0.428 7.374 -3.671) 8.248 37.788 ( -15.507 -2.913 6.896) 17.219 38.547 ( 2.911 16.665 -15.071) 22.656 39.420 ( -23.467 9.390 -4.393) 25.655 ======================= Grid point 620 (321/371) ======================= q-point: ( 0.38 0.62 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.736 ( -3.257 8.109 10.585) 13.726 3.902 ( -4.361 24.421 6.311) 25.598 4.397 ( -12.354 8.730 -8.785) 17.493 6.329 ( 10.073 -0.263 6.177) 11.820 6.721 ( -16.157 -5.971 -15.823) 23.390 7.076 ( 1.230 -4.230 14.649) 15.297 7.859 ( 8.469 -7.241 -7.184) 13.258 7.979 ( -4.185 -8.019 -5.893) 10.796 8.641 ( -10.602 1.760 0.299) 10.751 8.943 ( -7.123 17.229 -2.913) 18.870 9.396 ( 18.611 13.960 5.666) 23.945 9.964 ( -7.221 -10.828 7.034) 14.794 11.532 ( -13.020 2.990 10.292) 16.863 11.902 ( 4.225 -5.298 -5.028) 8.438 12.164 ( -0.689 6.262 3.541) 7.227 12.452 ( 19.303 -1.477 -1.479) 19.416 12.675 ( -6.623 -3.411 1.611) 7.622 13.161 ( 5.850 -3.334 -5.234) 8.528 18.616 ( 6.590 0.897 2.113) 6.979 18.819 ( 0.103 -7.351 -1.276) 7.462 19.223 ( 6.216 -0.476 -1.324) 6.374 19.367 ( -5.356 -4.902 -0.562) 7.282 20.939 ( 5.015 -7.405 1.858) 9.134 21.109 ( 5.356 -7.761 1.193) 9.505 27.587 ( -2.166 2.512 0.640) 3.378 27.737 ( -0.127 2.086 -0.775) 2.229 37.097 ( 3.335 13.092 -0.438) 13.517 37.491 ( -19.206 -2.142 1.842) 19.412 38.652 ( -3.396 13.969 -10.202) 17.628 39.187 ( -13.797 15.670 -3.465) 21.164 ======================= Grid point 621 (322/371) ======================= q-point: ( 0.46 0.62 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.800 ( -3.022 3.463 7.525) 8.817 4.062 ( -6.441 18.891 0.783) 19.974 4.273 ( -8.967 12.286 -4.406) 15.836 6.251 ( -8.675 3.380 -9.738) 13.472 6.735 ( 13.192 -3.638 11.030) 17.577 7.130 ( 3.784 -3.013 10.550) 11.606 7.777 ( 1.689 -6.643 -14.933) 16.431 7.965 ( 7.180 -4.914 -1.245) 8.789 8.345 ( -21.740 0.912 7.179) 22.913 9.134 ( 2.261 22.922 -8.510) 24.555 9.722 ( -12.164 -11.186 5.453) 17.402 9.838 ( 14.927 13.107 6.614) 20.937 11.412 ( -6.263 -4.764 9.190) 12.099 11.849 ( -1.223 -3.704 -2.269) 4.512 12.212 ( -1.053 3.027 2.544) 4.092 12.527 ( -6.964 -0.100 -3.314) 7.713 12.735 ( 14.655 -1.010 -3.151) 15.024 13.201 ( 7.356 -4.236 -7.700) 11.461 18.640 ( -2.487 -6.715 2.347) 7.535 18.808 ( 5.381 -1.298 -2.633) 6.129 19.220 ( -5.006 -5.290 1.887) 7.524 19.336 ( 7.139 -0.477 -1.464) 7.303 20.938 ( 3.116 -8.648 1.778) 9.362 21.115 ( 3.934 -8.555 1.181) 9.490 27.587 ( -1.413 2.822 0.721) 3.238 27.744 ( -0.833 1.960 -1.063) 2.381 37.155 ( -17.145 2.807 2.674) 17.578 37.360 ( 7.490 13.190 1.494) 15.242 38.549 ( -14.596 8.087 -4.363) 17.247 39.261 ( 0.740 22.121 -5.966) 22.923 ======================= Grid point 622 (323/371) ======================= q-point: ( 0.54 0.62 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.763 ( -3.777 -0.426 -0.135) 3.803 4.053 ( -7.951 12.184 -5.035) 15.395 4.318 ( -3.510 15.371 4.590) 16.422 6.192 ( 1.559 1.064 -7.481) 7.715 6.889 ( 1.452 -3.543 16.694) 17.127 7.331 ( 13.778 0.438 7.883) 15.880 7.649 ( -1.729 -4.426 -15.249) 15.972 8.065 ( 1.527 1.475 6.419) 6.761 8.137 ( -4.412 5.340 2.324) 7.307 9.141 ( -13.535 -1.776 -6.429) 15.089 9.566 ( -2.556 8.906 -0.492) 9.279 10.169 ( 7.677 10.593 4.329) 13.780 11.345 ( 2.815 -13.751 9.012) 16.680 11.814 ( -0.347 1.082 0.080) 1.139 12.186 ( -2.882 -5.887 2.726) 7.099 12.424 ( -5.203 9.383 -9.863) 14.573 12.887 ( 7.484 -0.132 -4.928) 8.961 13.215 ( 3.753 -5.693 -6.804) 9.633 18.533 ( -2.181 -6.471 -0.824) 6.878 18.828 ( 0.873 -6.077 0.664) 6.175 19.152 ( -1.040 1.081 0.776) 1.689 19.428 ( 4.957 -1.305 0.224) 5.131 20.900 ( 1.170 -8.519 1.580) 8.743 21.087 ( 1.730 -8.345 0.966) 8.577 27.602 ( -0.419 2.996 0.438) 3.057 27.737 ( -1.240 1.463 -0.964) 2.146 36.956 ( -10.507 3.155 1.815) 11.120 37.670 ( 10.671 12.674 7.691) 18.266 38.362 ( -13.408 7.296 -4.234) 15.841 39.476 ( 2.181 22.229 -4.900) 22.867 ======================= Grid point 623 (324/371) ======================= q-point: ( 0.62 0.62 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.751 ( 3.171 1.359 -0.415) 3.474 4.048 ( -2.823 12.296 -4.506) 13.396 4.441 ( -0.919 10.112 7.863) 12.842 6.168 ( 2.435 -5.050 -9.060) 10.654 6.956 ( -2.137 1.378 16.918) 17.108 7.401 ( -10.684 2.069 0.539) 10.896 7.593 ( 9.462 -9.609 -7.524) 15.443 8.110 ( 3.632 3.688 8.279) 9.764 8.340 ( 6.602 12.787 2.235) 14.564 8.800 ( -9.568 -11.874 -3.461) 15.637 9.640 ( -3.602 15.413 -6.552) 17.131 10.308 ( -0.640 4.275 -1.451) 4.559 11.316 ( 6.418 -20.020 8.665) 22.739 11.833 ( 0.749 -3.773 3.365) 5.111 12.110 ( 1.337 0.467 -3.455) 3.734 12.427 ( -2.260 13.039 -9.848) 16.495 12.938 ( 0.764 2.096 -4.029) 4.605 13.137 ( -2.226 -6.946 -3.851) 8.248 18.458 ( 0.200 -4.125 -2.211) 4.684 18.763 ( -0.050 -8.161 1.863) 8.371 19.180 ( -0.423 4.490 0.336) 4.523 19.465 ( 0.887 -1.726 1.159) 2.260 20.840 ( -0.120 -7.224 1.331) 7.347 21.028 ( -0.317 -6.976 0.439) 6.997 27.632 ( 0.440 3.006 -0.069) 3.039 27.727 ( -0.612 0.857 -0.565) 1.195 36.903 ( -1.003 3.173 1.893) 3.828 37.972 ( 5.067 6.935 13.678) 16.151 38.242 ( -3.527 7.847 -7.538) 11.439 39.676 ( -0.428 20.795 -2.337) 20.930 ======================= Grid point 624 (325/371) ======================= q-point: (-0.31 -0.38 -0.77) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.857 ( 5.684 1.723 1.411) 6.104 4.169 ( 5.927 11.590 -2.638) 13.282 4.544 ( 0.372 3.550 8.712) 9.415 6.095 ( 1.937 -6.322 -10.031) 12.015 7.008 ( -6.241 3.894 16.900) 18.432 7.228 ( -8.957 0.263 -3.506) 9.623 7.557 ( 0.268 -6.685 -3.509) 7.554 8.281 ( 0.209 7.719 5.147) 9.280 8.354 ( -0.735 -3.669 -0.219) 3.748 8.851 ( 16.836 1.187 1.781) 16.971 9.650 ( -6.727 13.175 -8.121) 16.876 10.217 ( -7.978 -2.032 -8.429) 11.783 11.247 ( 5.577 -24.132 10.073) 26.739 11.778 ( 1.721 -11.409 0.151) 11.540 12.216 ( 2.264 11.486 -6.140) 13.219 12.479 ( 0.560 11.576 -6.442) 13.260 12.894 ( -6.683 0.026 -1.031) 6.762 13.026 ( -1.605 -2.115 -1.690) 3.147 18.442 ( 2.592 -2.515 -0.952) 3.735 18.714 ( 1.775 -5.747 -0.509) 6.036 19.202 ( -2.866 4.384 1.404) 5.423 19.439 ( -2.816 -1.601 1.540) 3.587 20.782 ( -0.269 -5.309 1.039) 5.417 20.958 ( -1.457 -4.711 -0.206) 4.935 27.668 ( 0.866 2.201 -0.257) 2.379 27.733 ( 0.697 0.781 -0.340) 1.101 36.990 ( 7.146 1.970 1.524) 7.567 38.006 ( -8.984 5.013 5.132) 11.497 38.401 ( 13.177 3.394 1.644) 13.706 39.820 ( -4.102 18.701 0.366) 19.149 ======================= Grid point 625 (326/371) ======================= q-point: (-0.23 -0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.949 ( 4.512 -1.086 0.345) 4.653 4.362 ( 6.816 6.005 -1.741) 9.250 4.607 ( 0.938 -2.568 7.233) 7.732 6.034 ( 2.614 -3.147 -9.073) 9.953 6.907 ( -17.276 1.404 9.442) 19.738 7.209 ( 7.321 2.240 3.036) 8.236 7.478 ( -1.757 -3.194 -1.933) 4.126 8.270 ( -9.573 20.122 3.340) 22.532 8.502 ( 17.327 -12.124 1.173) 21.180 9.120 ( 11.927 -0.491 1.685) 12.056 9.588 ( -9.024 8.589 -7.636) 14.613 9.971 ( -9.299 -5.254 -10.582) 15.035 11.202 ( 8.362 -20.207 12.399) 25.140 11.695 ( 3.570 -12.960 -4.822) 14.281 12.139 ( -16.627 5.523 -11.268) 20.831 12.621 ( 4.701 9.666 -4.529) 11.664 12.802 ( -1.679 -2.459 7.599) 8.162 13.023 ( -1.053 6.479 -2.762) 7.122 18.472 ( 3.993 -3.672 1.413) 5.606 18.712 ( 2.546 0.299 -3.762) 4.552 19.181 ( -4.984 2.585 2.537) 6.161 19.375 ( -4.147 -0.548 1.591) 4.476 20.747 ( 0.551 -3.584 0.650) 3.684 20.894 ( -1.993 -2.262 -0.637) 3.081 27.698 ( 1.530 0.228 0.251) 1.567 27.757 ( 0.978 1.562 -0.655) 1.956 37.167 ( 11.956 0.217 0.657) 11.976 37.923 ( -8.337 4.129 2.475) 9.627 38.643 ( 12.960 -1.135 3.096) 13.372 39.898 ( -7.076 16.042 2.583) 17.722 ======================= Grid point 632 (327/371) ======================= q-point: ( 0.31 0.69 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.872 ( -1.698 5.798 -0.415) 6.056 4.134 ( -9.905 12.001 1.883) 15.675 4.704 ( -5.337 1.555 -11.758) 13.006 5.948 ( 6.061 -1.821 8.664) 10.729 7.049 ( -1.045 -0.734 15.201) 15.254 7.276 ( -3.329 -5.401 -14.960) 16.249 7.583 ( 3.399 -5.806 -5.236) 8.525 8.352 ( -2.959 -6.348 -0.813) 7.051 8.382 ( 3.690 5.225 -6.909) 9.415 8.899 ( 4.185 15.338 -3.843) 16.357 9.509 ( -14.611 0.741 9.734) 17.572 10.050 ( 1.834 -9.750 12.434) 15.907 11.395 ( 21.102 -4.290 -8.311) 23.082 11.781 ( 11.227 -8.585 -0.411) 14.139 12.097 ( -9.858 4.410 8.637) 13.828 12.365 ( -9.115 10.131 8.271) 15.941 12.888 ( -6.201 -1.683 -0.067) 6.426 13.017 ( 4.777 -2.606 -0.608) 5.475 18.434 ( 2.734 2.570 0.136) 3.755 18.702 ( 5.915 -3.691 0.912) 7.031 19.227 ( -5.174 0.394 -1.768) 5.482 19.464 ( -0.203 -3.257 -1.740) 3.698 20.790 ( 3.955 -2.614 0.082) 4.741 20.952 ( 3.639 -3.884 0.548) 5.351 27.663 ( -1.879 1.983 0.304) 2.749 27.729 ( 0.220 0.914 0.146) 0.951 37.028 ( 1.027 6.202 -3.405) 7.149 38.002 ( -10.059 -3.683 5.295) 11.949 38.515 ( 7.048 10.877 -12.559) 18.048 39.843 ( -21.003 6.397 -2.369) 22.083 ======================= Grid point 633 (328/371) ======================= q-point: ( 0.38 0.69 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.889 ( -3.040 6.092 2.884) 7.394 4.192 ( -3.143 17.201 3.653) 17.864 4.592 ( -6.610 5.251 -7.327) 11.178 6.141 ( 13.458 -1.704 10.056) 16.887 6.870 ( -17.150 -9.685 -15.284) 24.930 7.136 ( -1.801 2.609 8.111) 8.709 7.626 ( 7.982 -6.161 -4.934) 11.226 7.983 ( -14.374 -7.857 -5.386) 17.244 8.692 ( 9.966 8.631 -2.433) 13.407 9.157 ( 6.150 12.291 -1.741) 13.854 9.353 ( -5.291 6.804 8.818) 12.331 9.990 ( -3.789 -11.043 8.667) 14.540 11.626 ( 15.661 -3.985 -8.671) 18.339 11.820 ( -8.341 -5.203 3.616) 10.475 12.064 ( 9.333 -4.971 8.680) 13.681 12.404 ( -3.370 11.393 5.361) 13.034 12.761 ( -7.044 -0.934 -0.774) 7.148 13.035 ( 2.943 -3.975 -3.706) 6.180 18.543 ( 6.256 3.797 0.185) 7.321 18.742 ( 1.987 -5.100 1.850) 5.778 19.160 ( -0.410 -0.849 -1.876) 2.100 19.387 ( -3.335 -4.894 -1.369) 6.079 20.825 ( 3.593 -3.522 0.285) 5.039 20.972 ( 3.959 -5.396 0.345) 6.702 27.655 ( -2.279 2.877 0.659) 3.729 27.746 ( 0.534 1.332 -0.407) 1.491 37.148 ( 4.435 11.990 -0.908) 12.816 37.768 ( -15.750 -3.125 1.196) 16.101 38.684 ( 5.520 11.896 -10.001) 16.492 39.566 ( -18.459 7.341 0.404) 19.869 ======================= Grid point 634 (329/371) ======================= q-point: ( 0.46 0.69 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.897 ( -3.755 2.109 2.568) 5.014 4.319 ( -3.759 14.324 2.263) 14.981 4.523 ( -7.282 10.507 -1.754) 12.904 6.400 ( -4.518 1.066 1.346) 4.833 6.481 ( 7.558 -6.848 -5.149) 11.425 7.171 ( -3.074 2.052 9.524) 10.216 7.621 ( 2.622 -5.314 -10.796) 12.315 7.787 ( 2.176 -5.127 -1.911) 5.888 8.721 ( -13.364 3.125 5.718) 14.869 9.254 ( 2.010 17.045 -5.815) 18.121 9.681 ( 18.178 8.522 4.040) 20.479 9.812 ( -8.183 -11.315 5.488) 15.003 11.551 ( -13.481 -12.664 7.464) 19.946 11.749 ( 8.753 -2.487 -7.161) 11.580 12.220 ( 4.676 -2.982 4.474) 7.125 12.522 ( 3.622 3.579 4.212) 6.609 12.659 ( -3.809 5.663 -4.802) 8.345 13.025 ( 4.416 -4.186 -5.921) 8.491 18.666 ( -3.046 -2.584 4.966) 6.373 18.694 ( 5.374 -0.652 -3.755) 6.589 19.193 ( 5.102 -2.375 0.866) 5.693 19.272 ( -3.387 -3.151 -1.812) 4.968 20.839 ( 2.355 -4.463 0.515) 5.072 20.983 ( 3.845 -6.096 0.158) 7.209 27.650 ( -2.239 3.054 0.852) 3.881 27.762 ( 0.050 1.391 -0.861) 1.636 37.374 ( 7.143 13.511 1.463) 15.352 37.476 ( -17.745 0.385 1.464) 17.809 38.732 ( -5.172 5.372 -8.810) 11.542 39.466 ( -5.603 14.010 2.394) 15.278 ======================= Grid point 635 (330/371) ======================= q-point: ( 0.54 0.69 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.819 ( -5.655 -1.663 -0.376) 5.906 4.323 ( -9.700 10.612 -0.688) 14.394 4.543 ( -4.890 11.759 4.610) 13.544 6.188 ( -5.521 -0.160 -10.210) 11.608 6.772 ( 17.033 -5.495 11.416) 21.229 7.188 ( 0.731 -1.070 6.543) 6.670 7.565 ( 1.369 -0.534 -12.402) 12.489 7.891 ( 11.239 1.965 2.234) 11.627 8.516 ( -18.045 4.942 8.268) 20.455 9.352 ( -11.335 6.451 -7.101) 14.850 9.600 ( 0.912 -2.454 1.364) 2.952 10.072 ( 15.674 6.621 -0.620) 17.026 11.281 ( -6.855 -17.673 10.135) 21.496 11.813 ( 3.713 1.848 -4.133) 5.855 12.178 ( -3.509 -9.431 1.122) 10.125 12.519 ( -3.295 6.544 -6.733) 9.951 12.777 ( 6.441 7.596 -1.863) 10.132 13.044 ( 6.009 -5.049 -4.823) 9.212 18.547 ( -5.120 -4.468 0.920) 6.857 18.766 ( 2.039 -1.869 -0.966) 2.929 19.174 ( -1.016 -1.180 1.815) 2.391 19.318 ( 6.945 -0.487 -0.269) 6.967 20.823 ( 0.989 -5.058 0.686) 5.200 20.982 ( 2.876 -6.001 0.012) 6.654 27.650 ( -1.590 2.806 0.718) 3.304 27.762 ( -0.862 1.110 -1.009) 1.730 37.203 ( -15.167 1.169 1.072) 15.250 37.667 ( 8.755 13.402 6.168) 17.156 38.572 ( -10.955 0.761 -6.195) 12.608 39.623 ( 2.368 18.314 1.969) 18.571 ======================= Grid point 636 (331/371) ======================= q-point: (-0.38 -0.31 -0.77) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.744 ( -1.232 0.274 0.680) 1.434 4.251 ( -8.437 8.818 -1.187) 12.262 4.605 ( -3.887 8.258 9.155) 12.927 6.086 ( -1.341 -0.930 -9.379) 9.520 6.988 ( 6.749 -2.885 11.986) 14.055 7.253 ( 11.664 -9.936 -2.318) 15.497 7.508 ( -2.261 0.449 -6.353) 6.759 8.131 ( 6.034 1.577 5.777) 8.501 8.402 ( -4.711 12.738 5.958) 14.831 9.018 ( -20.519 -3.077 -1.507) 20.803 9.712 ( 4.177 8.085 -6.646) 11.268 10.275 ( 6.213 1.333 -7.144) 9.561 11.107 ( 0.238 -21.096 11.548) 24.051 11.850 ( -2.493 -1.570 2.544) 3.892 12.043 ( 2.606 -2.840 -7.093) 8.073 12.523 ( -1.759 10.444 -8.081) 13.321 12.916 ( 3.873 6.686 -2.827) 8.227 13.044 ( 2.492 -6.965 -2.743) 7.890 18.452 ( -3.073 -1.185 -0.452) 3.325 18.716 ( -1.821 -6.078 0.295) 6.352 19.211 ( 1.856 3.843 1.162) 4.423 19.409 ( 4.626 -1.597 1.229) 5.046 20.787 ( 0.061 -5.114 0.790) 5.175 20.963 ( 1.275 -5.004 -0.202) 5.167 27.660 ( -0.541 2.434 0.314) 2.513 27.747 ( -1.278 0.608 -0.839) 1.645 37.027 ( -9.140 2.027 2.431) 9.672 37.960 ( 9.524 8.222 8.932) 15.430 38.373 ( -9.603 -0.096 -5.304) 10.970 39.854 ( 2.124 18.945 2.566) 19.236 ======================= Grid point 637 (332/371) ======================= q-point: (-0.31 -0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.792 ( 4.239 -0.275 2.502) 4.930 4.233 ( -1.355 6.862 -0.649) 7.025 4.657 ( -4.220 4.556 12.788) 14.216 6.015 ( -1.196 0.525 -8.999) 9.094 7.072 ( 1.450 -2.809 8.402) 8.977 7.300 ( 5.610 -5.418 -15.154) 17.044 7.465 ( -0.526 -4.705 9.550) 10.659 8.099 ( -0.814 -9.638 2.530) 9.997 8.641 ( 0.370 14.918 1.565) 15.005 8.766 ( -5.001 7.877 5.142) 10.653 9.767 ( -0.792 6.573 -8.983) 11.159 10.220 ( -3.146 -5.765 -13.989) 15.454 10.988 ( 3.518 -23.372 12.140) 26.570 11.708 ( -5.204 -10.315 1.349) 11.632 12.201 ( 9.969 13.051 -6.751) 17.756 12.560 ( -1.132 10.220 -7.110) 12.501 12.953 ( -3.481 -8.817 0.100) 9.480 13.007 ( 1.774 6.969 -3.794) 8.131 18.421 ( -1.049 1.630 -0.493) 2.000 18.640 ( 0.188 -5.578 -0.001) 5.581 19.281 ( -0.036 5.055 1.600) 5.302 19.444 ( 0.938 -2.212 1.527) 2.846 20.743 ( -0.160 -4.751 0.813) 4.823 20.932 ( -0.127 -3.064 -0.519) 3.110 27.677 ( 0.017 1.434 -0.006) 1.434 27.733 ( -0.242 0.579 -0.616) 0.879 36.972 ( -1.415 1.324 3.129) 3.680 38.186 ( -3.744 -0.215 12.630) 13.176 38.238 ( 6.491 1.726 -7.409) 10.000 40.055 ( -1.229 18.376 3.699) 18.785 ======================= Grid point 638 (333/371) ======================= q-point: (-0.23 -0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.830 ( 4.062 -8.567 -0.288) 9.485 4.326 ( 5.237 3.919 -0.023) 6.541 4.675 ( -5.977 0.627 13.744) 15.000 5.982 ( -0.177 5.185 -7.527) 9.142 7.126 ( 4.145 -4.136 10.495) 12.018 7.165 ( -8.043 0.263 -12.356) 14.746 7.460 ( -0.308 -4.853 5.213) 7.129 8.073 ( 11.428 -13.907 0.517) 18.007 8.660 ( -8.005 16.682 6.403) 19.580 9.005 ( 8.714 9.067 2.755) 12.873 9.732 ( -4.225 5.022 -9.255) 11.346 9.958 ( -7.167 -12.069 -16.134) 21.386 10.941 ( 7.400 -17.909 12.742) 23.192 11.538 ( -2.804 -11.401 -2.558) 12.016 12.370 ( -5.265 12.091 -10.678) 16.969 12.612 ( 2.573 8.053 -4.938) 9.791 12.814 ( -2.050 -8.745 5.189) 10.373 13.081 ( 0.774 9.078 -3.625) 9.806 18.421 ( 0.012 -0.706 0.703) 0.997 18.647 ( 3.980 1.157 -1.694) 4.478 19.305 ( -3.936 4.067 2.499) 6.187 19.422 ( -1.822 -1.667 1.392) 2.834 20.705 ( 0.376 -4.249 0.575) 4.304 20.901 ( -0.981 -0.753 -0.746) 1.444 27.682 ( 0.254 -0.670 0.342) 0.794 27.750 ( 1.264 1.526 -0.863) 2.161 37.030 ( 5.619 -0.285 2.893) 6.326 38.077 ( -6.923 -0.706 1.048) 7.038 38.424 ( 12.022 -3.701 3.952) 13.185 40.188 ( -5.723 17.113 4.685) 18.643 ======================= Grid point 736 (334/371) ======================= q-point: ( 0.31 0.31 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 371 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.250 ( -0.000 0.000 30.168) 30.168 2.250 ( -0.000 0.000 30.168) 30.168 3.672 ( -0.000 0.000 47.584) 47.584 5.975 ( 0.000 -0.000 -13.320) 13.320 5.975 ( 0.000 -0.000 -13.320) 13.320 7.295 ( -0.000 0.000 4.863) 4.863 7.295 ( -0.000 0.000 4.863) 4.863 8.432 ( 0.000 -0.000 -7.087) 7.087 8.812 ( -0.000 0.000 0.582) 0.582 8.812 ( 0.000 0.000 0.582) 0.582 9.312 ( 0.000 -0.000 -11.283) 11.283 10.477 ( 0.000 -0.000 -2.963) 2.963 11.376 ( -0.000 0.000 1.929) 1.929 11.376 ( 0.000 0.000 1.929) 1.929 11.616 ( 0.000 -0.000 -1.194) 1.194 11.616 ( 0.000 -0.000 -1.194) 1.194 13.587 ( 0.000 -0.000 -2.266) 2.266 13.839 ( -0.000 0.000 0.258) 0.258 19.105 ( -0.000 0.000 3.826) 3.826 19.105 ( -0.000 0.000 3.826) 3.826 19.523 ( 0.000 -0.000 -3.548) 3.548 19.523 ( 0.000 -0.000 -3.548) 3.548 21.526 ( -0.000 0.000 12.240) 12.240 22.490 ( 0.000 -0.000 -9.656) 9.656 27.486 ( -0.000 0.000 2.278) 2.278 27.703 ( 0.000 -0.000 -2.528) 2.528 36.777 ( -0.000 -0.000 -1.604) 1.604 36.777 ( 0.000 -0.000 -1.604) 1.604 37.089 ( 0.000 0.000 1.650) 1.650 37.089 ( 0.000 0.000 1.650) 1.650 ======================= Grid point 737 (335/371) ======================= q-point: ( 0.38 0.31 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.312 ( 2.803 0.609 28.168) 28.314 2.677 ( 12.760 8.611 25.802) 30.045 3.938 ( 2.095 1.296 30.936) 31.034 5.914 ( 12.906 -2.081 -5.096) 14.031 6.130 ( 9.529 14.701 -13.670) 22.222 7.325 ( -2.084 5.134 8.578) 10.212 7.388 ( 6.816 -1.597 2.167) 7.328 8.206 ( -10.854 -11.317 -2.406) 15.864 8.665 ( -9.746 -2.744 0.058) 10.125 8.882 ( 3.077 -3.390 -11.625) 12.494 9.387 ( 6.943 11.699 -3.316) 14.002 10.305 ( -9.926 -5.348 0.281) 11.278 11.268 ( -6.614 1.705 2.218) 7.182 11.584 ( 7.310 -3.994 2.094) 8.589 11.632 ( 10.366 3.967 0.143) 11.100 11.874 ( 16.977 13.304 -6.222) 22.449 13.494 ( -8.302 -4.354 -1.792) 9.544 13.761 ( -6.662 -4.883 -0.086) 8.260 19.032 ( -6.141 -3.651 3.472) 7.943 19.164 ( 1.027 1.597 3.442) 3.931 19.432 ( -2.761 -3.581 -2.996) 5.424 19.518 ( -2.063 0.105 -3.580) 4.133 21.540 ( -4.495 -2.704 11.333) 12.488 22.194 ( -19.994 -11.347 -3.876) 23.314 27.495 ( -0.155 0.065 2.347) 2.353 27.677 ( -0.722 -0.689 -2.397) 2.597 36.773 ( -1.877 4.777 -2.328) 5.636 36.981 ( 16.130 10.175 -4.639) 19.627 37.147 ( 14.915 -6.828 1.852) 16.508 37.450 ( 23.312 22.163 -5.560) 32.643 ======================= Grid point 738 (336/371) ======================= q-point: ( 0.46 0.31 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.618 ( 13.315 7.164 22.044) 26.731 3.068 ( 9.857 7.685 25.164) 28.097 4.035 ( 1.234 -0.108 2.989) 3.236 6.129 ( 13.637 -5.435 -2.154) 14.838 6.543 ( 21.845 26.967 -2.306) 34.781 7.363 ( -7.414 3.551 14.191) 16.400 7.495 ( 8.200 -0.824 -1.830) 8.442 7.980 ( -0.186 -11.836 -0.805) 11.865 8.462 ( -10.323 -1.473 -3.734) 11.076 8.797 ( 2.028 -7.013 -12.730) 14.675 9.591 ( 0.471 16.659 -3.154) 16.961 10.151 ( -4.320 -3.033 1.386) 5.458 11.235 ( -2.796 4.786 6.216) 8.329 11.633 ( 7.003 -8.228 2.212) 11.029 11.892 ( 9.610 8.965 -1.182) 13.196 12.237 ( 17.552 9.317 -6.417) 20.882 13.214 ( -17.269 -9.158 1.671) 19.618 13.556 ( -9.721 -7.949 -1.186) 12.614 18.883 ( -8.996 -4.756 2.922) 10.587 19.181 ( -2.534 1.791 0.043) 3.104 19.347 ( -1.417 -7.106 -0.688) 7.278 19.446 ( -3.321 1.299 -2.681) 4.462 21.444 ( -8.741 -5.321 7.836) 12.889 21.737 ( -19.899 -11.144 2.171) 22.910 27.511 ( 0.393 0.803 1.545) 1.785 27.656 ( 0.410 -0.511 -1.707) 1.828 36.782 ( 0.446 3.411 -3.028) 4.583 37.299 ( 5.362 19.133 4.981) 20.485 37.466 ( 33.165 -9.351 -8.084) 35.393 38.071 ( 28.367 25.636 -13.869) 40.673 ======================= Grid point 739 (337/371) ======================= q-point: ( 0.54 0.31 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.064 ( 17.731 11.634 14.691) 25.799 3.394 ( 6.917 5.777 22.747) 24.467 4.116 ( 10.887 4.008 -10.410) 15.588 6.211 ( 4.462 -7.317 -0.034) 8.571 7.071 ( 9.805 24.425 -6.109) 27.020 7.265 ( -11.424 -1.855 12.593) 17.104 7.724 ( 22.401 -2.063 -0.173) 22.497 7.926 ( 0.758 -8.449 3.152) 9.049 8.330 ( -2.535 6.197 -9.288) 11.450 8.724 ( 5.436 -9.619 -3.695) 11.650 9.610 ( -13.601 15.965 -8.791) 22.741 10.126 ( 2.099 -1.295 2.628) 3.604 11.355 ( 4.525 8.270 11.514) 14.881 11.682 ( 6.970 -8.961 3.144) 11.780 12.035 ( 1.604 4.232 -4.899) 6.669 12.516 ( 8.977 3.633 -5.061) 10.927 12.862 ( -14.518 -7.184 7.485) 17.844 13.315 ( -8.941 -7.731 -1.287) 11.890 18.697 ( -9.605 -4.648 2.301) 10.915 19.138 ( -3.944 2.795 -1.212) 4.984 19.198 ( -5.633 -8.712 -2.512) 10.674 19.453 ( 1.869 1.344 0.009) 2.302 21.239 ( -12.021 -7.095 3.625) 14.422 21.404 ( -12.525 -7.108 3.459) 14.811 27.537 ( 1.053 1.427 0.274) 1.794 27.666 ( 1.627 0.072 -0.485) 1.699 36.823 ( 2.374 3.770 -3.414) 5.613 37.593 ( 7.467 14.007 8.272) 17.899 37.858 ( 27.522 -3.942 -13.325) 30.831 38.667 ( 25.371 22.285 -11.080) 35.540 ======================= Grid point 740 (338/371) ======================= q-point: ( 0.62 0.31 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.515 ( 15.177 9.820 8.014) 19.774 3.649 ( 8.539 6.795 12.258) 16.412 4.351 ( 15.874 7.536 -10.571) 20.507 6.146 ( -3.614 -8.676 4.747) 10.530 7.148 ( -6.667 -3.318 14.375) 16.189 7.286 ( 0.424 18.441 -15.014) 23.784 7.772 ( -0.956 -14.201 -1.810) 14.348 8.108 ( 18.365 0.745 -2.519) 18.552 8.337 ( -0.069 6.313 -13.047) 14.494 8.794 ( 6.808 -6.973 11.255) 14.888 9.444 ( -13.387 15.310 -8.034) 21.867 10.184 ( 2.049 0.433 4.746) 5.188 11.612 ( 6.235 5.817 9.941) 13.097 11.695 ( 4.207 -8.444 0.542) 9.450 12.038 ( 1.861 1.618 2.177) 3.290 12.376 ( -14.844 -6.022 -3.254) 16.346 12.835 ( 2.774 1.473 3.097) 4.411 13.154 ( -3.818 -3.923 2.095) 5.861 18.528 ( -7.236 -3.498 1.926) 8.264 18.986 ( -9.528 -4.952 -1.683) 10.869 19.135 ( 1.581 0.777 -1.638) 2.406 19.491 ( 1.466 0.164 -0.716) 1.640 21.010 ( -9.546 -5.652 1.667) 11.218 21.192 ( -9.008 -5.007 1.492) 10.413 27.577 ( 2.052 1.727 -0.141) 2.686 27.696 ( 1.497 0.438 0.224) 1.576 36.886 ( 2.976 3.704 -3.556) 5.935 37.876 ( 7.343 9.911 9.594) 15.626 38.117 ( 17.442 -2.424 -16.901) 24.408 39.205 ( 22.604 17.743 -4.754) 29.126 ======================= Grid point 741 (339/371) ======================= q-point: ( 0.69 0.31 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.741 ( 7.198 -0.211 0.989) 7.269 3.985 ( 12.462 12.355 3.553) 17.904 4.582 ( 9.393 6.041 -10.211) 15.132 6.033 ( -4.953 -4.833 8.228) 10.751 7.116 ( -1.354 -2.475 6.209) 6.820 7.325 ( -2.923 5.157 -3.336) 6.802 7.614 ( -3.022 -7.084 -6.773) 10.256 8.251 ( 0.418 -2.535 -9.496) 9.837 8.398 ( 13.618 0.833 -4.723) 14.438 8.755 ( -9.419 3.437 2.610) 10.361 9.541 ( 6.772 11.190 5.799) 14.307 10.227 ( -1.924 0.670 8.638) 8.875 11.439 ( -12.265 -13.182 -6.838) 19.260 11.859 ( 4.838 0.225 0.606) 4.881 12.063 ( -8.773 -4.345 2.525) 10.110 12.264 ( 11.706 7.687 10.437) 17.466 12.895 ( 2.945 1.181 1.447) 3.488 13.086 ( -4.696 -2.276 2.547) 5.807 18.429 ( -2.945 -1.380 1.461) 3.566 18.787 ( -8.237 -4.324 -1.131) 9.372 19.192 ( 3.959 2.476 -1.105) 4.798 19.487 ( -0.491 -1.303 -1.624) 2.139 20.848 ( -5.858 -3.409 0.233) 6.781 21.029 ( -6.470 -3.424 0.332) 7.328 27.632 ( 2.549 1.501 0.026) 2.958 27.719 ( 0.588 0.534 0.451) 0.914 36.944 ( 2.211 2.983 -3.453) 5.070 38.102 ( 4.592 5.941 10.198) 12.664 38.215 ( 8.791 -2.504 -17.170) 19.451 39.677 ( 19.257 13.547 -2.199) 23.647 ======================= Grid point 750 (340/371) ======================= q-point: ( 0.38 0.38 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.495 ( -1.144 7.054 26.728) 27.667 2.808 ( 1.338 17.455 18.867) 25.737 4.135 ( 0.249 2.397 29.703) 29.800 5.740 ( -4.974 -0.698 -10.065) 11.248 6.117 ( 4.529 18.000 -9.003) 20.629 7.331 ( 1.983 -0.846 7.730) 8.025 7.469 ( -1.226 10.547 3.785) 11.272 8.174 ( -3.493 -15.826 -1.096) 16.244 8.693 ( 4.793 -5.579 -10.591) 12.894 8.840 ( -8.653 -1.172 -3.990) 9.600 9.319 ( 7.537 7.651 -1.426) 10.835 10.261 ( 0.187 -15.996 0.672) 16.011 11.317 ( 4.429 -0.615 6.279) 7.709 11.574 ( -1.199 4.011 -0.307) 4.198 11.667 ( -9.602 11.441 -4.413) 15.575 11.834 ( 5.461 20.810 -2.941) 21.714 13.506 ( 0.394 -5.590 -2.494) 6.134 13.773 ( -0.821 -6.540 -0.581) 6.617 19.093 ( -1.133 -2.940 3.354) 4.602 19.135 ( 1.998 -3.412 3.376) 5.199 19.386 ( -1.314 -6.963 -2.789) 7.615 19.533 ( 0.605 1.754 -3.550) 4.006 21.598 ( -0.104 -6.012 11.534) 13.007 22.166 ( 0.170 -21.098 -5.309) 21.757 27.506 ( 0.140 -0.297 2.475) 2.497 27.666 ( -0.228 -0.673 -2.532) 2.630 36.705 ( 4.072 -2.043 0.278) 4.564 36.870 ( -2.974 6.756 -2.127) 7.682 37.234 ( -6.209 11.204 0.811) 12.835 37.484 ( 5.103 39.297 -7.033) 40.246 ======================= Grid point 751 (341/371) ======================= q-point: ( 0.46 0.38 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.727 ( 2.657 15.605 21.767) 26.914 3.142 ( 8.306 15.246 14.914) 22.888 4.157 ( -10.424 0.026 9.212) 13.911 5.818 ( 14.495 0.158 -4.185) 15.088 6.437 ( 16.737 20.587 -0.822) 26.545 7.422 ( 3.171 2.523 4.723) 6.223 7.568 ( -2.853 8.416 8.816) 12.518 7.921 ( -6.217 -13.480 0.537) 14.854 8.606 ( -7.854 -1.520 -15.536) 17.475 8.631 ( -1.908 -6.435 -3.275) 7.469 9.587 ( 11.897 9.088 -2.078) 15.114 10.122 ( -0.551 -11.617 1.586) 11.738 11.382 ( -2.972 4.859 8.229) 10.008 11.555 ( -1.633 3.005 -3.135) 4.639 11.805 ( 10.623 9.687 -0.091) 14.377 12.110 ( 8.578 16.170 -4.689) 18.895 13.362 ( -9.375 -7.402 -2.161) 12.139 13.612 ( -7.785 -10.302 -0.418) 12.919 18.992 ( -6.865 -4.134 2.671) 8.447 19.168 ( 1.573 -4.360 -0.540) 4.666 19.287 ( 0.218 -7.407 1.080) 7.488 19.503 ( -3.418 1.079 -3.339) 4.899 21.536 ( -5.269 -9.115 8.744) 13.686 21.847 ( -10.578 -19.902 -0.884) 22.555 27.521 ( 0.276 0.250 1.929) 1.965 27.643 ( -0.249 -0.037 -1.961) 1.977 36.879 ( -5.213 10.615 -1.563) 11.929 36.900 ( 21.240 -3.669 -2.557) 21.706 37.392 ( 7.321 15.822 4.029) 17.893 37.965 ( 13.683 38.691 -13.291) 43.138 ======================= Grid point 752 (342/371) ======================= q-point: ( 0.54 0.38 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.098 ( 8.958 21.206 15.580) 27.798 3.494 ( 7.698 12.792 16.730) 22.423 4.020 ( -4.188 1.425 -6.270) 7.674 6.003 ( 11.172 -3.182 -3.839) 12.235 6.964 ( 23.360 12.919 0.321) 26.696 7.478 ( -8.364 1.787 3.690) 9.314 7.521 ( -2.932 -7.373 10.747) 13.359 7.902 ( 5.703 7.287 2.461) 9.575 8.403 ( -7.532 5.403 -14.282) 17.027 8.548 ( 3.001 -8.516 -2.136) 9.279 9.794 ( 4.989 8.716 -6.382) 11.899 10.038 ( -0.066 -6.772 -0.246) 6.777 11.456 ( 0.165 7.663 10.447) 12.957 11.569 ( 1.824 1.343 -1.131) 2.532 12.024 ( 4.788 6.174 -2.246) 8.129 12.377 ( 11.674 9.373 -2.120) 15.120 13.062 ( -15.870 -9.413 2.003) 18.560 13.369 ( -8.472 -10.768 -0.116) 13.702 18.835 ( -9.563 -3.028 2.009) 10.230 19.082 ( -0.308 -9.089 -4.049) 9.955 19.269 ( -1.689 -2.057 2.795) 3.859 19.437 ( -1.798 -0.560 -1.853) 2.642 21.350 ( -9.465 -11.087 3.976) 15.110 21.515 ( -10.332 -13.390 2.311) 17.070 27.539 ( 0.527 1.010 0.269) 1.171 27.648 ( 1.025 1.088 -0.365) 1.539 36.896 ( -4.301 11.669 -1.852) 12.574 37.227 ( 25.719 -5.949 -5.394) 26.943 37.741 ( 9.880 19.292 6.234) 22.553 38.484 ( 18.475 30.217 -13.405) 37.869 ======================= Grid point 753 (343/371) ======================= q-point: ( 0.62 0.38 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.535 ( 9.344 23.128 8.997) 26.517 3.720 ( -1.528 5.750 16.022) 17.091 4.107 ( 15.533 8.623 -11.645) 21.242 6.082 ( 4.492 -4.834 0.678) 6.634 7.270 ( -4.377 -4.610 -6.207) 8.884 7.332 ( 9.456 -0.949 3.882) 10.266 7.498 ( -0.629 -6.725 2.734) 7.287 8.057 ( 1.023 6.128 3.412) 7.088 8.310 ( -2.795 6.460 -17.633) 18.986 8.684 ( 14.257 4.838 11.758) 19.103 9.758 ( -14.475 9.399 -8.609) 19.287 10.060 ( 10.565 -5.556 -1.026) 11.981 11.585 ( 2.822 -1.140 -1.421) 3.359 11.650 ( 2.883 7.230 9.893) 12.588 12.064 ( -0.501 2.852 0.455) 2.931 12.525 ( -5.771 2.586 -4.652) 7.851 12.804 ( -2.408 -7.893 6.368) 10.424 13.180 ( -3.953 -7.444 3.226) 9.025 18.659 ( -9.982 -1.542 1.522) 10.214 18.976 ( -0.342 -9.087 -3.294) 9.672 19.197 ( -6.097 2.047 0.055) 6.431 19.432 ( 2.976 -3.468 -0.216) 4.575 21.104 ( -9.346 -9.217 1.416) 13.203 21.277 ( -8.134 -8.803 1.562) 12.087 27.565 ( 1.345 1.834 -0.623) 2.358 27.684 ( 1.432 1.600 0.676) 2.251 36.938 ( -2.739 11.413 -2.343) 11.969 37.544 ( 23.617 -6.207 -6.565) 25.286 38.078 ( 5.157 18.434 4.694) 19.709 38.990 ( 20.983 20.547 -7.499) 30.310 ======================= Grid point 754 (344/371) ======================= q-point: ( 0.69 0.38 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.728 ( -1.931 4.677 4.098) 6.511 3.976 ( 9.598 18.062 4.717) 20.990 4.415 ( 13.964 9.494 -7.557) 18.500 6.084 ( -1.115 -3.026 6.476) 7.235 7.110 ( -2.820 -6.148 -6.336) 9.268 7.402 ( -0.424 -14.549 3.637) 15.003 7.456 ( 4.127 1.411 -1.369) 4.571 8.119 ( 7.982 -8.415 -3.821) 12.211 8.272 ( -2.746 14.912 -11.141) 18.816 9.007 ( 0.577 12.336 10.694) 16.336 9.589 ( -4.827 6.039 -3.539) 8.503 10.185 ( 8.714 -3.939 2.292) 9.834 11.478 ( -9.386 -6.952 -7.775) 14.032 11.778 ( 4.270 1.241 4.320) 6.200 12.208 ( 4.089 3.518 4.442) 6.988 12.283 ( -11.549 2.795 4.095) 12.568 12.827 ( 4.915 -4.288 2.469) 6.974 13.120 ( -1.126 -5.085 5.076) 7.273 18.516 ( -7.194 0.277 1.256) 7.308 18.850 ( -4.832 -5.555 -1.930) 7.611 19.163 ( 0.159 1.864 -0.631) 1.975 19.436 ( 2.286 -4.754 -0.929) 5.356 20.910 ( -6.465 -5.431 0.211) 8.447 21.093 ( -6.413 -6.093 0.240) 8.850 27.610 ( 2.061 2.169 -0.541) 3.041 27.723 ( 0.797 1.578 0.897) 1.982 36.989 ( -2.202 10.353 -2.551) 10.888 37.798 ( 18.721 -5.576 -7.664) 20.983 38.290 ( -0.700 14.399 3.866) 14.925 39.461 ( 20.379 12.917 -2.792) 24.289 ======================= Grid point 763 (345/371) ======================= q-point: ( 0.38 0.46 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.756 ( -2.028 16.614 22.575) 28.103 3.098 ( -7.843 13.145 14.268) 20.925 4.155 ( 9.198 -0.192 9.312) 13.090 5.997 ( -22.738 2.787 -11.774) 25.757 6.269 ( -6.874 19.776 5.789) 21.722 7.342 ( -0.481 -3.870 9.721) 10.474 7.591 ( 1.483 9.280 4.006) 10.216 8.087 ( -0.287 -2.801 -1.364) 3.128 8.471 ( 7.382 -6.394 -13.191) 16.413 8.846 ( 1.664 -1.289 -7.844) 8.122 9.353 ( -4.266 0.650 3.727) 5.702 10.124 ( -0.379 -11.575 1.864) 11.730 11.262 ( 4.686 0.992 7.278) 8.713 11.716 ( -9.356 3.902 -1.994) 10.332 11.823 ( 0.332 11.949 -0.697) 11.974 12.086 ( -11.963 18.179 -4.877) 22.302 13.343 ( 9.782 -8.847 -1.811) 13.313 13.651 ( 6.664 -7.316 -1.847) 10.067 18.993 ( 8.106 -4.518 3.226) 9.825 19.115 ( -1.471 -7.159 0.160) 7.310 19.357 ( -3.191 -4.514 0.329) 5.538 19.477 ( 5.362 0.723 -3.497) 6.442 21.541 ( 5.131 -8.882 8.803) 13.517 21.841 ( 10.721 -20.107 -0.908) 22.805 27.512 ( 0.057 -0.333 1.963) 1.992 27.654 ( -0.139 0.672 -2.105) 2.214 36.749 ( -4.154 2.304 0.674) 4.798 36.981 ( -9.392 2.537 -1.655) 9.868 37.560 ( -15.597 17.805 -0.739) 23.682 37.846 ( -7.916 38.835 -11.682) 41.319 ======================= Grid point 764 (346/371) ======================= q-point: ( 0.46 0.46 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.001 ( -2.727 18.633 19.716) 27.264 3.236 ( 3.218 16.346 3.513) 17.026 4.279 ( 0.882 -4.070 0.753) 4.232 5.792 ( -5.639 11.478 0.425) 12.796 6.431 ( 3.297 15.909 4.657) 16.901 7.411 ( 5.351 0.505 8.177) 9.786 7.702 ( -0.698 2.519 9.715) 10.061 7.945 ( -8.486 -2.914 -4.644) 10.103 8.431 ( 4.214 -4.822 -17.020) 18.184 8.751 ( -5.282 -0.567 -4.168) 6.753 9.466 ( 6.425 4.534 2.060) 8.129 10.017 ( 1.148 -10.726 4.849) 11.827 11.452 ( 7.326 4.242 10.443) 13.443 11.618 ( -4.377 5.030 -5.023) 8.348 11.852 ( -5.196 11.960 -4.229) 13.709 12.170 ( 1.150 14.783 -1.021) 14.863 13.335 ( 1.217 -8.403 -4.787) 9.747 13.595 ( -2.180 -10.015 -2.677) 10.593 19.007 ( -0.829 -9.413 -1.043) 9.507 19.087 ( 4.114 -2.741 2.773) 5.668 19.240 ( -3.670 -7.658 1.523) 8.627 19.519 ( 0.808 0.619 -3.213) 3.370 21.522 ( -0.243 -12.722 7.086) 14.564 21.722 ( 0.264 -20.982 -0.043) 20.983 27.524 ( 0.455 -0.154 1.552) 1.625 27.644 ( -0.579 1.086 -1.712) 2.108 36.705 ( 1.417 1.115 0.847) 1.993 37.065 ( 1.462 14.239 2.670) 14.561 37.493 ( -5.904 15.446 -0.119) 16.536 38.154 ( 3.017 40.988 -14.135) 43.461 ======================= Grid point 765 (347/371) ======================= q-point: ( 0.54 0.46 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.262 ( 4.630 19.823 10.659) 22.978 3.522 ( 8.909 17.166 4.409) 19.836 4.141 ( -8.063 -2.959 -6.930) 11.036 5.905 ( 0.929 10.581 4.067) 11.373 6.715 ( 14.705 4.428 2.981) 15.644 7.555 ( 0.208 -10.006 16.772) 19.531 7.655 ( -5.548 4.825 3.129) 7.991 7.887 ( 3.457 9.124 -4.907) 10.922 8.359 ( 2.823 -4.518 -13.924) 14.908 8.639 ( -11.621 8.883 -0.482) 14.635 9.583 ( 11.765 -5.688 -6.659) 14.667 10.036 ( 1.174 -0.074 5.748) 5.867 11.551 ( -2.176 5.209 1.204) 5.772 11.656 ( -1.141 8.433 3.772) 9.308 11.953 ( 7.631 7.640 -3.156) 11.250 12.319 ( 4.987 6.710 1.491) 8.492 13.177 ( -7.802 -7.670 -6.104) 12.528 13.390 ( -7.757 -11.747 -0.507) 14.086 18.901 ( -0.949 -7.792 -2.168) 8.144 19.026 ( -6.584 -5.546 -0.434) 8.620 19.208 ( 4.954 -6.184 4.731) 9.229 19.483 ( -3.584 0.281 -2.865) 4.597 21.370 ( -5.250 -14.833 3.188) 16.054 21.509 ( -4.818 -15.821 2.191) 16.683 27.539 ( 0.549 0.670 0.180) 0.884 27.649 ( 0.323 1.834 -0.345) 1.894 36.848 ( 14.223 0.603 -1.933) 14.367 37.157 ( -9.520 17.146 3.023) 19.843 37.736 ( 13.543 15.496 5.268) 21.243 38.519 ( 6.786 35.029 -15.040) 38.721 ======================= Grid point 766 (348/371) ======================= q-point: ( 0.62 0.46 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.636 ( 11.415 20.638 6.275) 24.405 3.869 ( 8.890 14.633 8.417) 19.078 3.975 ( -3.841 3.138 -10.633) 11.733 6.022 ( 0.934 7.148 4.298) 8.392 6.922 ( 14.134 -11.219 -5.443) 18.849 7.393 ( -7.354 -10.380 6.441) 14.259 7.640 ( -8.795 4.603 3.879) 10.658 8.057 ( 2.058 -0.674 -0.325) 2.190 8.388 ( 6.606 8.006 -2.720) 10.730 8.608 ( -0.029 15.243 -0.313) 15.247 9.722 ( 17.002 -7.172 -6.505) 19.566 10.012 ( -9.076 3.366 -0.930) 9.724 11.577 ( -0.600 6.577 -5.210) 8.412 11.749 ( -0.364 6.707 9.004) 11.233 12.077 ( 2.502 2.435 -0.862) 3.596 12.491 ( 9.109 1.037 2.279) 9.446 12.897 ( -13.565 -7.247 -3.627) 15.802 13.180 ( -4.864 -9.914 3.043) 11.455 18.803 ( -5.287 -2.066 -1.730) 5.934 18.865 ( -2.367 -8.733 -1.055) 9.110 19.252 ( 2.861 -4.090 3.819) 6.284 19.392 ( -4.677 -1.155 -2.532) 5.443 21.145 ( -6.963 -12.136 1.134) 14.038 21.303 ( -5.881 -11.496 1.532) 13.004 27.560 ( 0.969 1.924 -0.822) 2.305 27.683 ( 1.282 2.033 0.745) 2.516 37.116 ( 18.457 1.263 -5.444) 19.285 37.169 ( -7.866 14.976 1.999) 17.034 38.147 ( 11.936 14.932 9.525) 21.358 38.881 ( 11.565 25.669 -11.738) 30.503 ======================= Grid point 767 (349/371) ======================= q-point: ( 0.69 0.46 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.863 ( -5.314 2.437 0.297) 5.854 4.034 ( 9.585 19.894 3.312) 22.330 4.258 ( 14.143 14.636 -2.391) 20.493 6.119 ( -0.258 5.874 7.030) 9.165 6.913 ( 7.804 -18.398 -10.357) 22.509 7.250 ( -2.398 -3.789 -3.243) 5.534 7.557 ( -5.804 -1.469 10.531) 12.114 7.965 ( -1.095 -10.557 -2.055) 10.811 8.473 ( -6.303 19.680 -8.420) 22.315 8.989 ( 18.680 11.882 9.700) 24.171 9.808 ( -16.190 3.993 -5.389) 17.524 9.912 ( 16.949 -8.212 -2.688) 19.025 11.552 ( -7.083 3.598 -8.540) 11.664 11.788 ( -1.590 -1.606 5.392) 5.847 12.189 ( 5.912 5.503 5.367) 9.698 12.526 ( -11.224 2.335 -2.704) 11.779 12.688 ( 4.583 -9.039 2.864) 10.531 13.092 ( -0.037 -7.378 5.892) 9.442 18.663 ( -9.079 0.951 -0.261) 9.133 18.797 ( 2.284 -7.013 -1.437) 7.514 19.232 ( -5.257 1.537 0.586) 5.508 19.327 ( 2.969 -6.797 -0.577) 7.440 20.951 ( -5.671 -7.433 0.133) 9.350 21.122 ( -5.342 -8.269 0.252) 9.848 27.600 ( 1.618 2.767 -0.907) 3.331 27.728 ( 1.215 1.758 1.035) 2.374 37.183 ( -7.454 15.672 -0.871) 17.376 37.413 ( 19.709 -1.224 -5.235) 20.430 38.447 ( 2.581 13.404 8.005) 15.824 39.260 ( 16.492 15.100 -5.205) 22.959 ======================= Grid point 776 (350/371) ======================= q-point: ( 0.38 0.54 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.099 ( -5.959 20.817 15.724) 26.760 3.434 ( -9.181 9.524 17.172) 21.676 4.059 ( 2.128 3.476 -5.973) 7.231 6.219 ( -11.839 3.383 -12.277) 17.388 6.662 ( -12.186 5.386 5.002) 14.231 7.351 ( 2.209 -9.648 15.239) 18.171 7.710 ( -7.441 12.251 5.673) 15.415 8.157 ( -1.954 14.023 -5.186) 15.078 8.212 ( 8.583 -6.006 -12.477) 16.292 8.774 ( -2.796 -2.933 -7.452) 8.482 9.395 ( 1.979 -3.067 2.899) 4.661 10.092 ( -4.021 -5.839 2.387) 7.481 11.304 ( -3.552 1.864 9.945) 10.724 11.865 ( -1.840 8.931 0.302) 9.123 11.921 ( -3.022 5.256 -4.026) 7.277 12.409 ( -11.513 11.199 -3.999) 16.551 13.033 ( 15.072 -11.458 2.674) 19.121 13.429 ( 9.841 -6.885 -2.753) 12.322 18.816 ( 9.604 -4.685 2.675) 11.016 19.050 ( -0.888 -8.862 -1.159) 8.981 19.345 ( 8.550 0.440 -3.736) 9.341 19.397 ( -4.082 -2.592 2.005) 5.235 21.355 ( 9.688 -11.228 3.943) 15.346 21.510 ( 10.084 -13.066 2.249) 16.657 27.523 ( -0.698 0.203 0.941) 1.189 27.666 ( -0.713 1.939 -1.167) 2.373 36.820 ( 0.584 7.646 -0.764) 7.706 37.236 ( -21.232 -3.341 0.304) 21.495 37.965 ( -8.415 26.459 -7.675) 28.806 38.329 ( -20.753 24.520 -6.330) 32.741 ======================= Grid point 777 (351/371) ======================= q-point: ( 0.46 0.54 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.346 ( -2.232 22.835 17.177) 28.661 3.418 ( -8.868 13.917 -0.661) 16.515 4.133 ( 6.297 -3.434 -6.445) 9.643 5.994 ( -6.648 7.639 -6.424) 11.993 6.709 ( -7.486 13.983 13.593) 20.889 7.355 ( 2.905 -5.474 9.236) 11.122 7.762 ( -1.787 -0.162 11.685) 11.822 8.049 ( -5.150 0.317 -12.424) 13.453 8.260 ( -0.122 0.803 -12.412) 12.439 8.704 ( 5.695 2.799 -8.366) 10.501 9.533 ( -0.912 7.839 9.059) 12.014 9.954 ( -2.042 -8.897 4.457) 10.159 11.399 ( 6.230 3.328 8.457) 11.018 11.756 ( -8.369 4.899 -5.705) 11.251 12.009 ( -1.784 8.919 -2.029) 9.319 12.339 ( -7.544 9.439 1.135) 12.136 13.132 ( 9.453 -10.119 -4.074) 14.434 13.462 ( 5.063 -8.283 -5.157) 10.992 18.885 ( 2.393 -9.880 -0.346) 10.172 18.987 ( 5.058 -4.540 1.284) 6.917 19.275 ( -6.050 -5.686 1.752) 8.485 19.456 ( 5.354 0.223 -2.484) 5.906 21.371 ( 5.221 -15.345 3.013) 16.486 21.509 ( 4.778 -15.029 2.286) 15.935 27.526 ( 0.007 0.389 0.952) 1.028 27.665 ( -0.936 2.140 -1.259) 2.654 36.827 ( -10.967 2.901 2.540) 11.625 37.113 ( 6.328 12.445 1.081) 14.003 37.882 ( -19.086 17.136 -0.815) 25.662 38.437 ( -1.344 35.760 -11.527) 37.596 ======================= Grid point 778 (352/371) ======================= q-point: ( 0.54 0.54 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.409 ( -2.570 14.260 -2.905) 14.778 3.665 ( 2.634 23.063 11.122) 25.740 4.071 ( 0.721 -6.761 -15.254) 16.701 6.096 ( 2.422 13.635 4.845) 14.672 6.728 ( -9.232 6.285 11.284) 15.876 7.485 ( 6.949 -6.033 10.853) 14.229 7.728 ( 0.929 0.415 3.856) 3.988 7.952 ( -4.336 2.954 -3.501) 6.308 8.198 ( 2.570 -2.745 -11.742) 12.329 8.853 ( 2.837 16.371 -6.497) 17.840 9.428 ( -8.743 -9.562 1.456) 13.039 10.034 ( 5.754 4.080 8.001) 10.666 11.620 ( 9.443 0.794 9.440) 13.376 11.672 ( -3.123 7.457 -6.967) 10.672 12.011 ( -4.596 10.554 -6.149) 13.051 12.339 ( -1.240 0.156 6.375) 6.496 13.103 ( 1.846 -8.323 -8.436) 11.994 13.378 ( -2.591 -7.906 -5.006) 9.710 18.782 ( 0.489 -10.969 -3.102) 11.410 19.071 ( 6.291 -3.576 3.149) 7.892 19.119 ( -7.076 -6.274 1.985) 9.663 19.496 ( 0.817 0.137 -2.082) 2.241 21.274 ( 0.111 -16.128 1.623) 16.210 21.418 ( -0.258 -14.088 2.330) 14.281 27.539 ( 0.390 1.100 0.282) 1.201 27.667 ( -0.483 2.193 -0.610) 2.327 36.757 ( -0.501 3.202 1.072) 3.413 37.436 ( 6.027 17.003 10.031) 20.641 37.783 ( -7.028 16.171 -2.765) 17.848 38.713 ( 1.533 33.532 -11.836) 35.593 ======================= Grid point 779 (353/371) ======================= q-point: ( 0.62 0.54 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.594 ( 10.589 15.060 -4.308) 18.907 3.950 ( 0.951 -3.445 -13.127) 13.604 3.980 ( 3.663 21.678 8.622) 23.616 6.254 ( -3.864 14.270 7.575) 16.611 6.676 ( -1.577 -6.234 3.225) 7.194 7.403 ( -4.121 -10.372 1.600) 11.275 7.834 ( -6.582 -0.332 2.891) 7.197 8.041 ( 3.531 8.042 2.779) 9.212 8.194 ( 13.583 -0.121 0.796) 13.607 8.937 ( -12.781 21.119 -3.133) 24.883 9.318 ( 14.047 -13.199 -6.620) 20.380 10.147 ( -2.358 4.669 2.506) 5.800 11.649 ( -1.907 7.593 -4.256) 8.911 11.815 ( 4.351 0.182 5.313) 6.870 12.050 ( 2.140 8.500 -4.451) 9.831 12.362 ( 4.519 -7.273 6.904) 10.999 12.960 ( -5.451 -5.382 -9.828) 12.461 13.209 ( -6.531 -6.655 -0.215) 9.327 18.689 ( 2.423 -9.340 -3.827) 10.380 18.957 ( -7.504 -4.354 1.262) 8.767 19.143 ( 5.114 -4.310 3.438) 7.520 19.463 ( -3.866 0.187 -1.389) 4.112 21.112 ( -3.143 -13.181 0.791) 13.574 21.273 ( -3.235 -11.954 1.256) 12.447 27.562 ( 0.690 2.219 -0.556) 2.389 27.688 ( 0.732 1.945 0.283) 2.098 36.873 ( 10.058 3.034 -0.300) 10.510 37.535 ( -13.372 17.427 4.400) 22.402 38.068 ( 17.387 12.743 6.858) 22.621 38.978 ( 2.116 28.560 -10.118) 30.373 ======================= Grid point 780 (354/371) ======================= q-point: (-0.31 -0.46 -0.69) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.871 ( 4.339 2.469 -5.919) 7.743 3.989 ( 13.743 13.588 -5.197) 20.013 4.275 ( 4.985 17.392 6.365) 19.179 6.341 ( -5.331 13.641 7.121) 16.285 6.590 ( 1.714 -13.226 -1.318) 13.401 7.254 ( -3.751 -4.632 -5.729) 8.267 7.712 ( -7.925 -3.795 7.756) 11.720 7.934 ( -7.408 -6.227 0.381) 9.685 8.600 ( 12.872 7.753 5.690) 16.068 8.944 ( -0.852 19.335 -3.258) 19.626 9.489 ( 20.485 -9.622 -5.713) 23.342 10.052 ( -12.084 2.453 -4.114) 12.999 11.669 ( -3.095 8.888 -6.195) 11.267 11.821 ( -3.179 -5.981 4.484) 8.123 12.174 ( 4.758 5.512 2.403) 7.668 12.427 ( 10.116 -8.768 0.632) 13.402 12.745 ( -10.410 -1.268 -6.591) 12.386 13.082 ( -3.251 -5.538 4.828) 8.034 18.654 ( 4.695 -6.666 -2.707) 8.591 18.808 ( -7.755 -1.728 0.035) 7.945 19.191 ( 4.151 -5.201 2.808) 7.222 19.369 ( -7.070 0.615 -0.685) 7.130 20.953 ( -3.697 -8.682 0.079) 9.436 21.117 ( -3.966 -9.088 0.216) 9.917 27.599 ( 1.246 3.140 -0.875) 3.489 27.725 ( 1.416 1.391 0.734) 2.116 37.107 ( 15.564 2.094 -1.574) 15.783 37.497 ( -11.776 16.473 0.791) 20.265 38.481 ( 13.106 8.848 10.810) 19.155 39.220 ( 4.519 21.304 -6.627) 22.764 ======================= Grid point 789 (355/371) ======================= q-point: ( 0.38 0.62 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.484 ( -8.935 20.389 9.147) 24.067 3.692 ( -2.168 5.384 17.512) 18.449 4.163 ( -12.455 10.035 -11.927) 19.952 6.318 ( 2.181 3.700 0.112) 4.297 6.792 ( -14.467 -9.164 -12.317) 21.095 7.268 ( 5.142 -7.627 14.902) 17.512 7.948 ( 8.556 -4.872 -2.929) 10.272 8.047 ( -12.509 1.552 -4.429) 13.361 8.285 ( 2.611 21.993 -8.456) 23.707 8.901 ( -17.365 0.969 1.815) 17.487 9.246 ( 13.824 -2.191 1.516) 14.078 10.142 ( -5.047 -3.966 3.174) 7.161 11.516 ( -11.507 3.545 11.058) 16.348 11.898 ( 7.371 5.299 -2.700) 9.471 12.008 ( -4.925 6.110 -0.342) 7.855 12.480 ( 9.651 -1.642 -7.544) 12.359 12.812 ( 0.219 -6.761 8.996) 11.256 13.219 ( 6.253 -5.081 -1.604) 8.215 18.640 ( 9.090 -2.549 2.601) 9.793 18.973 ( -0.135 -9.120 -0.863) 9.161 19.195 ( 7.531 1.833 -3.137) 8.362 19.446 ( -3.637 -2.725 0.770) 4.609 21.107 ( 9.331 -9.173 1.440) 13.164 21.273 ( 8.312 -8.794 1.213) 12.161 27.554 ( -1.812 1.338 0.493) 2.305 27.694 ( -0.827 1.993 -0.509) 2.217 36.881 ( 0.579 8.740 -1.477) 8.882 37.563 ( -22.039 -4.700 1.335) 22.575 38.221 ( -0.658 24.581 -12.801) 27.722 38.888 ( -24.932 15.671 1.169) 29.471 ======================= Grid point 790 (356/371) ======================= q-point: ( 0.46 0.62 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.652 ( -3.143 23.761 5.806) 24.661 3.755 ( -9.838 8.797 11.717) 17.648 4.048 ( -3.402 5.281 -10.351) 12.109 6.137 ( -11.845 2.971 -10.357) 16.012 6.807 ( 11.702 2.171 8.768) 14.783 7.311 ( 1.462 -9.530 11.740) 15.192 7.833 ( -2.553 -5.900 -14.072) 15.471 8.011 ( 0.913 1.236 4.026) 4.309 8.386 ( -14.635 2.746 -3.054) 15.200 8.666 ( 0.044 14.187 -6.637) 15.663 9.602 ( 12.390 13.111 8.455) 19.922 9.976 ( -8.728 -9.796 3.670) 13.624 11.457 ( -4.879 2.759 9.251) 10.817 11.875 ( -5.059 0.673 -6.462) 8.234 12.076 ( 0.370 7.913 -0.377) 7.931 12.527 ( -3.875 4.547 -1.884) 6.264 12.842 ( 10.209 -11.342 2.182) 15.415 13.254 ( 7.238 -6.458 -5.874) 11.340 18.764 ( 5.148 -4.325 2.764) 7.269 18.873 ( 1.341 -7.459 -1.390) 7.705 19.307 ( 1.719 -1.259 -2.984) 3.666 19.354 ( 0.868 -3.647 2.042) 4.269 21.145 ( 6.735 -12.269 1.153) 14.044 21.306 ( 6.332 -11.016 1.105) 12.755 27.548 ( -1.112 1.627 0.793) 2.125 27.697 ( -0.963 2.366 -0.989) 2.739 37.039 ( 0.836 12.686 3.988) 13.324 37.203 ( -13.608 1.444 -1.828) 13.806 38.290 ( -11.136 16.933 -7.810) 21.719 38.781 ( -10.305 25.725 -0.084) 27.712 ======================= Grid point 791 (357/371) ======================= q-point: ( 0.54 0.62 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.647 ( -12.715 14.085 -4.278) 19.452 3.880 ( 1.394 6.264 5.220) 8.272 3.993 ( -3.750 13.595 -7.474) 15.961 6.102 ( 4.220 5.802 -2.434) 7.576 7.023 ( -2.342 1.743 17.225) 17.470 7.351 ( 9.791 -1.405 5.521) 11.328 7.678 ( -0.493 -6.384 -14.485) 15.837 8.061 ( -7.184 2.990 12.729) 14.919 8.131 ( -2.207 -2.623 -5.971) 6.885 8.867 ( 4.370 19.198 -11.520) 22.811 9.633 ( -16.746 -7.264 7.262) 19.646 10.004 ( 9.858 8.262 6.092) 14.232 11.515 ( 5.052 -0.575 6.981) 8.637 11.772 ( -4.788 2.753 -5.507) 7.800 12.118 ( -1.689 7.637 -5.518) 9.572 12.434 ( -7.803 -4.451 6.247) 10.942 12.907 ( 8.242 -6.040 -6.929) 12.346 13.265 ( 4.419 -5.265 -7.255) 9.994 18.682 ( -2.127 -9.655 -1.386) 9.983 18.933 ( 6.898 -4.199 2.118) 8.349 19.188 ( -5.781 -4.377 1.083) 7.331 19.439 ( 5.218 -0.021 -0.926) 5.299 21.109 ( 3.171 -13.132 0.773) 13.532 21.281 ( 3.044 -11.702 0.962) 12.129 27.556 ( -0.467 2.036 0.598) 2.173 27.697 ( -1.008 2.214 -0.940) 2.608 36.904 ( -11.921 3.134 1.992) 12.486 37.435 ( 13.715 16.057 6.629) 22.133 38.150 ( -16.847 13.078 -3.717) 21.649 38.963 ( -1.108 29.422 -4.114) 29.729 ======================= Grid point 792 (358/371) ======================= q-point: (-0.38 -0.38 -0.69) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.623 ( -1.194 13.378 -5.503) 14.515 3.841 ( 0.180 1.750 -11.998) 12.126 4.193 ( 0.594 19.902 9.145) 21.911 6.217 ( 7.065 -2.412 -4.321) 8.626 6.982 ( -13.486 5.599 17.982) 23.163 7.385 ( -5.484 -3.954 -7.162) 9.849 7.747 ( 13.674 -7.058 -0.457) 15.394 8.026 ( 3.255 8.472 8.293) 12.294 8.192 ( -0.268 5.183 3.268) 6.134 8.978 ( 5.281 -1.491 -11.212) 12.483 9.352 ( -15.909 5.532 3.480) 17.199 10.207 ( 2.503 6.132 1.854) 6.877 11.628 ( 7.537 -8.669 5.957) 12.940 11.755 ( 1.305 8.128 -5.449) 9.872 12.128 ( -2.471 10.957 -9.083) 14.445 12.293 ( -2.837 -12.725 7.006) 14.801 12.912 ( 1.139 -1.895 -6.565) 6.927 13.212 ( -1.205 -4.428 -5.140) 6.891 18.564 ( -0.007 -8.423 -2.728) 8.853 18.950 ( 0.771 -9.998 2.920) 10.444 19.117 ( -1.230 2.156 0.779) 2.602 19.486 ( 0.806 -0.029 -0.080) 0.811 21.020 ( 0.098 -11.619 0.369) 11.625 21.199 ( -0.348 -10.800 0.526) 10.819 27.576 ( 0.117 2.653 0.012) 2.655 27.701 ( -0.236 1.714 -0.416) 1.780 36.843 ( -1.271 4.064 2.070) 4.735 37.860 ( 9.060 13.126 15.249) 22.066 38.009 ( -7.000 12.663 -7.103) 16.119 39.202 ( -0.696 27.825 -4.040) 28.125 ======================= Grid point 793 (359/371) ======================= q-point: (-0.31 -0.38 -0.69) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.783 ( 6.986 6.265 -3.912) 10.167 3.888 ( 7.167 13.736 -7.898) 17.390 4.420 ( 1.374 14.328 9.091) 17.024 6.218 ( 5.384 -10.521 -8.610) 14.623 6.926 ( -16.236 13.415 19.213) 28.508 7.220 ( -3.154 -3.945 -10.802) 11.924 7.725 ( -0.569 -10.528 2.368) 10.805 8.145 ( -13.335 4.819 4.973) 15.026 8.403 ( 18.284 6.002 8.650) 21.099 8.980 ( 13.075 -13.850 -1.876) 19.139 9.291 ( -7.027 19.710 -8.334) 22.523 10.195 ( -6.669 0.719 -5.105) 8.429 11.652 ( 4.548 -11.645 4.932) 13.439 11.848 ( 0.838 7.032 -4.167) 8.217 12.151 ( 1.096 -4.373 -0.404) 4.526 12.231 ( 4.810 2.525 -4.546) 7.084 12.843 ( -5.549 1.245 -4.181) 7.058 13.112 ( -3.343 -4.583 -0.060) 5.673 18.510 ( 3.482 -5.828 -2.240) 7.149 18.851 ( -2.464 -7.817 0.581) 8.217 19.146 ( 0.350 1.609 1.882) 2.500 19.463 ( -3.681 -0.064 0.741) 3.755 20.912 ( -1.424 -8.493 -0.031) 8.611 21.085 ( -2.293 -8.649 0.006) 8.948 27.610 ( 0.723 3.227 -0.507) 3.346 27.719 ( 0.927 0.994 0.139) 1.366 36.945 ( 7.549 3.550 1.653) 8.504 37.848 ( -13.229 12.612 0.097) 18.278 38.340 ( 17.673 6.776 9.863) 21.343 39.408 ( -2.173 24.500 -2.417) 24.715 ======================= Grid point 920 (360/371) ======================= q-point: ( 0.38 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 371 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.659 ( -0.000 0.000 21.984) 21.984 2.659 ( -0.000 0.000 21.984) 21.984 4.312 ( -0.000 0.000 33.946) 33.946 5.760 ( 0.000 -0.000 -13.144) 13.144 5.760 ( 0.000 -0.000 -13.144) 13.144 7.386 ( -0.000 0.000 6.002) 6.002 7.386 ( -0.000 0.000 6.002) 6.002 8.301 ( 0.000 -0.000 -9.102) 9.102 8.807 ( 0.000 -0.000 -0.863) 0.863 8.807 ( 0.000 0.000 -0.863) 0.863 9.166 ( 0.000 -0.000 -7.233) 7.233 10.440 ( 0.000 -0.000 -1.809) 1.809 11.415 ( -0.000 0.000 3.073) 3.073 11.415 ( 0.000 0.000 3.073) 3.073 11.588 ( 0.000 -0.000 -2.460) 2.460 11.588 ( 0.000 -0.000 -2.460) 2.460 13.557 ( 0.000 -0.000 -1.483) 1.483 13.841 ( -0.000 0.000 0.036) 0.036 19.164 ( -0.000 0.000 3.737) 3.737 19.164 ( -0.000 0.000 3.737) 3.737 19.467 ( 0.000 -0.000 -3.532) 3.532 19.467 ( 0.000 -0.000 -3.532) 3.532 21.724 ( -0.000 0.000 13.213) 13.213 22.327 ( 0.000 -0.000 -11.397) 11.397 27.524 ( -0.000 0.000 2.686) 2.686 27.661 ( 0.000 -0.000 -2.863) 2.863 36.757 ( -0.000 -0.000 -0.984) 0.984 36.757 ( 0.000 -0.000 -0.984) 0.984 37.110 ( -0.000 0.000 1.018) 1.018 37.110 ( 0.000 0.000 1.018) 1.018 ======================= Grid point 921 (361/371) ======================= q-point: ( 0.46 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.705 ( 2.070 -0.046 21.805) 21.904 2.986 ( 12.331 8.624 13.041) 19.912 4.305 ( -12.954 -7.340 16.629) 22.320 5.842 ( 18.367 -5.832 -8.033) 20.878 5.946 ( 14.862 24.833 -5.143) 29.394 7.429 ( 0.478 1.286 3.881) 4.116 7.463 ( 4.372 2.044 6.767) 8.312 8.169 ( -6.963 -6.779 -1.556) 9.842 8.589 ( -14.683 -2.342 -10.084) 17.966 8.760 ( 1.404 -9.225 -2.418) 9.639 9.348 ( 9.455 12.361 -1.833) 15.670 10.299 ( -8.763 -4.995 -0.867) 10.124 11.331 ( -5.141 2.030 5.558) 7.838 11.590 ( 7.841 -7.442 -1.462) 10.908 11.650 ( 9.811 7.242 1.585) 12.297 11.782 ( 14.921 13.074 -5.028) 20.465 13.472 ( -7.503 -4.027 -0.958) 8.569 13.760 ( -7.069 -4.664 -0.050) 8.469 19.088 ( -6.375 -4.004 3.630) 8.357 19.204 ( -0.844 0.910 1.252) 1.763 19.400 ( -0.680 -3.215 -0.734) 3.367 19.459 ( -2.208 0.584 -3.864) 4.488 21.718 ( -6.619 -3.961 11.457) 13.812 22.100 ( -14.116 -7.958 -7.841) 18.002 27.534 ( -0.460 -0.088 2.676) 2.717 27.638 ( -0.357 -0.447 -2.702) 2.762 36.745 ( -2.015 2.858 -1.352) 3.749 36.905 ( 16.078 5.834 -4.368) 17.652 37.185 ( 9.716 0.533 2.662) 10.088 37.399 ( 19.974 16.028 -1.694) 25.666 ======================= Grid point 922 (362/371) ======================= q-point: ( 0.54 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.935 ( 9.856 5.185 18.107) 21.258 3.347 ( 14.567 10.141 8.271) 19.582 4.069 ( -10.648 -7.046 4.184) 13.436 6.021 ( 13.942 0.359 -10.390) 17.392 6.543 ( 22.101 22.988 0.499) 31.893 7.494 ( 7.332 -1.709 1.073) 7.604 7.582 ( -2.773 4.956 13.065) 14.246 8.000 ( -1.685 -9.614 4.700) 10.833 8.291 ( -10.650 -0.739 -16.724) 19.841 8.696 ( 2.521 -7.292 -1.207) 7.810 9.537 ( -0.875 12.418 -3.338) 12.889 10.143 ( -3.085 -3.896 -2.152) 5.415 11.362 ( -0.099 6.114 9.464) 11.267 11.651 ( 9.334 -8.714 -0.272) 12.772 11.856 ( 5.441 9.926 -3.499) 11.848 12.165 ( 18.377 9.850 -2.443) 20.993 13.240 ( -13.775 -7.323 1.813) 15.705 13.548 ( -10.770 -7.444 0.180) 13.094 18.930 ( -9.402 -5.194 3.113) 11.183 19.164 ( -3.041 -0.329 -1.975) 3.641 19.331 ( -4.637 -5.266 -2.250) 7.369 19.429 ( 0.380 1.411 1.053) 1.801 21.554 ( -12.217 -7.355 6.025) 15.481 21.735 ( -15.774 -8.750 -1.955) 18.144 27.534 ( -0.595 0.076 1.289) 1.422 27.631 ( 1.255 0.228 -1.286) 1.811 36.744 ( 0.178 2.575 -1.928) 3.221 37.271 ( 20.180 11.964 -9.005) 25.129 37.419 ( 14.703 1.823 3.484) 15.220 37.962 ( 27.703 19.848 -1.560) 34.116 ======================= Grid point 923 (363/371) ======================= q-point: ( 0.62 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.278 ( 13.327 9.236 12.173) 20.275 3.714 ( 9.575 7.194 15.321) 19.447 3.944 ( 4.313 -0.425 -8.385) 9.439 6.174 ( 10.072 -3.188 -4.388) 11.440 6.911 ( 1.929 20.803 -11.944) 24.065 7.486 ( -8.825 -5.763 11.668) 15.724 7.712 ( 15.891 -6.073 -0.451) 17.018 8.019 ( -3.109 -2.674 6.834) 7.970 8.111 ( 2.445 5.957 -14.239) 15.627 8.756 ( 11.896 -3.187 5.529) 13.500 9.488 ( -14.747 11.040 -6.269) 19.460 10.122 ( 5.179 -2.053 -3.122) 6.386 11.534 ( 5.318 8.709 10.747) 14.820 11.708 ( 7.516 -9.975 -1.106) 12.538 11.972 ( 2.166 6.821 -1.797) 7.378 12.433 ( 4.903 3.589 -5.707) 8.336 12.978 ( -10.110 -6.114 7.716) 14.111 13.321 ( -8.714 -5.505 2.135) 10.525 18.736 ( -9.752 -5.198 2.776) 11.394 19.112 ( -0.390 -1.811 -2.151) 2.839 19.157 ( -9.102 -3.426 -2.761) 10.109 19.467 ( 1.504 0.309 1.590) 2.210 21.277 ( -13.477 -7.946 1.191) 15.690 21.433 ( -12.286 -6.851 0.375) 14.072 27.541 ( 0.796 0.693 0.094) 1.060 27.662 ( 1.904 0.890 0.013) 2.102 36.781 ( 2.160 3.153 -2.101) 4.362 37.629 ( 20.222 4.745 -14.166) 25.142 37.712 ( 11.410 9.532 6.037) 16.047 38.605 ( 28.027 18.198 1.991) 33.476 ======================= Grid point 934 (364/371) ======================= q-point: ( 0.46 0.46 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.857 ( -1.903 7.207 19.019) 20.428 3.002 ( 2.070 10.710 5.417) 12.180 4.446 ( 0.274 -10.857 10.126) 14.849 5.638 ( -3.403 4.334 -2.130) 5.908 6.009 ( 3.034 26.745 -4.566) 27.301 7.431 ( 0.721 -0.111 4.623) 4.680 7.529 ( -0.308 9.137 2.870) 9.582 8.162 ( -1.884 -7.144 0.051) 7.388 8.521 ( 2.898 -16.438 -9.612) 19.262 8.786 ( -5.460 -2.618 -2.832) 6.685 9.315 ( 4.481 12.275 0.463) 13.075 10.270 ( 0.131 -13.169 0.666) 13.187 11.425 ( 6.166 2.646 7.077) 9.752 11.535 ( -4.690 0.901 -5.062) 6.959 11.630 ( -5.949 10.528 0.246) 12.095 11.789 ( 3.889 19.915 -2.880) 20.494 13.477 ( 0.210 -6.885 -1.318) 7.013 13.765 ( -0.381 -7.620 -0.424) 7.642 19.144 ( -2.450 -4.324 2.782) 5.695 19.169 ( 3.329 -4.409 0.852) 5.590 19.365 ( -1.477 -4.861 0.370) 5.094 19.475 ( 0.669 1.928 -3.775) 4.291 21.776 ( -0.127 -8.697 11.172) 14.159 22.056 ( 0.158 -14.751 -8.500) 17.025 27.547 ( 0.158 -0.718 2.697) 2.795 27.624 ( -0.199 -0.192 -2.730) 2.744 36.714 ( 2.015 -1.456 0.854) 2.629 36.847 ( -1.575 8.833 -0.665) 8.997 37.239 ( -3.519 10.837 -0.321) 11.399 37.411 ( 3.075 29.824 -2.884) 30.120 ======================= Grid point 935 (365/371) ======================= q-point: ( 0.54 0.46 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.019 ( 2.336 12.134 14.454) 19.016 3.248 ( 11.124 12.496 -1.248) 16.776 4.241 ( -12.167 -9.222 2.421) 15.458 5.774 ( 9.331 4.742 -0.441) 10.476 6.434 ( 17.991 25.674 -0.805) 31.361 7.470 ( -1.061 3.744 1.143) 4.056 7.672 ( 5.554 10.956 3.304) 12.720 8.002 ( -7.182 -16.397 10.845) 20.930 8.316 ( -3.900 -4.725 -17.416) 18.463 8.658 ( -5.587 -4.463 3.483) 7.954 9.527 ( 8.805 7.521 -5.277) 12.726 10.139 ( -3.383 -8.036 0.620) 8.742 11.484 ( 2.261 -0.671 -4.916) 5.452 11.524 ( -4.424 9.184 8.388) 13.201 11.810 ( 11.657 7.273 0.556) 13.751 12.050 ( 8.278 18.378 -2.698) 20.336 13.335 ( -7.032 -9.453 -1.181) 11.841 13.612 ( -6.814 -10.727 0.453) 12.716 19.030 ( -5.900 -6.009 2.048) 8.667 19.135 ( -1.628 -6.170 -2.751) 6.949 19.333 ( 1.248 -4.216 3.771) 5.793 19.451 ( -2.547 1.110 -3.178) 4.222 21.657 ( -7.485 -12.763 6.224) 16.052 21.805 ( -7.994 -14.559 -3.749) 17.027 27.547 ( -0.488 -0.983 1.044) 1.515 27.617 ( 0.537 1.116 -0.998) 1.590 36.820 ( 5.775 3.826 -3.814) 7.908 36.912 ( 3.525 6.474 1.931) 7.620 37.456 ( 10.771 16.860 4.316) 20.468 37.814 ( 13.963 30.853 -6.559) 34.494 ======================= Grid point 936 (366/371) ======================= q-point: ( 0.62 0.46 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.312 ( 7.788 16.755 11.179) 21.595 3.570 ( 16.401 13.804 -8.052) 22.899 4.014 ( -9.194 -5.246 6.742) 12.550 5.956 ( 9.523 1.935 -1.175) 9.789 6.894 ( 14.709 13.702 -9.199) 22.107 7.448 ( -3.944 0.156 -3.557) 5.314 7.770 ( -9.404 -9.445 15.995) 20.820 7.963 ( 12.073 7.588 -0.077) 14.259 8.167 ( -7.042 5.531 -7.369) 11.597 8.595 ( 4.346 -5.190 5.536) 8.745 9.673 ( 4.529 7.330 -8.748) 12.279 10.012 ( -3.903 -4.393 -2.867) 6.539 11.507 ( 5.027 -2.568 -4.962) 7.515 11.634 ( 0.929 9.836 9.594) 13.772 11.998 ( 3.672 6.359 -0.692) 7.376 12.355 ( 9.842 11.226 -1.007) 14.963 13.088 ( -9.901 -11.299 1.852) 15.137 13.395 ( -7.281 -10.194 3.245) 12.941 18.866 ( -9.222 -4.582 1.862) 10.464 19.025 ( -0.270 -8.771 -3.250) 9.358 19.293 ( -6.187 0.647 -0.034) 6.221 19.426 ( 1.902 -2.802 0.811) 3.482 21.389 ( -11.107 -12.826 0.785) 16.985 21.528 ( -9.549 -11.445 -0.316) 14.909 27.537 ( 0.102 0.195 -0.473) 0.521 27.650 ( 1.494 1.835 0.609) 2.443 36.865 ( -4.484 12.145 -2.207) 13.133 37.151 ( 20.808 -3.195 -3.927) 21.415 37.835 ( 7.601 22.627 5.164) 24.422 38.364 ( 23.913 23.529 -1.914) 33.602 ======================= Grid point 947 (367/371) ======================= q-point: ( 0.46 0.54 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.052 ( 0.174 14.429 13.370) 19.672 3.207 ( -13.016 9.752 0.703) 16.280 4.241 ( 11.335 -9.347 2.475) 14.899 5.831 ( -11.259 5.585 -8.011) 14.904 6.379 ( -14.002 25.867 6.426) 30.107 7.450 ( -2.943 -1.443 3.953) 5.135 7.667 ( -0.794 12.277 3.838) 12.888 8.116 ( 2.281 -7.980 6.832) 10.750 8.228 ( 6.490 -8.630 -16.443) 19.672 8.735 ( 1.581 -4.642 -6.302) 7.985 9.435 ( -2.184 6.588 6.171) 9.288 10.141 ( 1.347 -8.936 0.406) 9.046 11.380 ( 3.817 2.228 7.552) 8.750 11.649 ( -10.371 1.787 -6.644) 12.446 11.817 ( -0.349 12.153 -0.296) 12.161 12.036 ( -11.562 18.629 -1.182) 21.958 13.328 ( 7.222 -10.157 -0.217) 12.465 13.626 ( 6.425 -9.592 -1.285) 11.617 19.036 ( 7.211 -5.914 1.768) 9.492 19.110 ( 0.180 -7.173 -0.049) 7.175 19.372 ( -2.279 -3.524 0.195) 4.201 19.428 ( 3.800 1.096 -1.677) 4.296 21.662 ( 7.396 -12.660 5.982) 15.835 21.799 ( 8.099 -14.655 -3.437) 17.093 27.541 ( 0.580 -1.199 1.535) 2.033 27.624 ( -0.640 1.384 -1.615) 2.221 36.772 ( -1.570 4.735 2.301) 5.494 36.947 ( -8.612 3.904 -2.452) 9.769 37.522 ( -10.781 20.268 -3.881) 23.283 37.761 ( -13.085 29.109 -0.112) 31.915 ======================= Grid point 948 (368/371) ======================= q-point: ( 0.54 0.54 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.146 ( -2.032 10.458 -7.001) 12.748 3.306 ( 1.970 19.653 10.190) 22.225 4.193 ( 0.445 -13.332 -9.631) 16.453 5.864 ( 0.092 13.818 8.437) 16.191 6.513 ( -2.148 23.101 4.516) 23.636 7.492 ( 5.971 3.787 2.178) 7.399 7.745 ( -4.825 11.353 -6.781) 14.077 8.003 ( -3.325 -17.801 13.261) 22.445 8.177 ( 3.530 -3.044 -13.247) 14.043 8.706 ( 1.456 -1.029 -1.843) 2.565 9.495 ( -3.173 3.840 2.029) 5.378 10.091 ( 2.134 -6.573 4.364) 8.173 11.507 ( -5.802 4.830 -8.672) 11.498 11.598 ( 12.298 5.009 7.048) 15.033 11.817 ( -7.410 9.315 0.218) 11.904 12.155 ( 0.854 18.891 -0.593) 18.920 13.275 ( 0.341 -12.124 -2.983) 12.491 13.562 ( -0.475 -12.143 -1.555) 12.252 18.976 ( -0.176 -10.834 -2.676) 11.161 19.128 ( 1.196 -2.806 2.528) 3.962 19.282 ( -1.510 -7.058 3.437) 7.994 19.467 ( 0.583 1.336 -3.236) 3.549 21.600 ( -0.034 -17.086 1.589) 17.159 21.709 ( 0.024 -15.379 -0.176) 15.380 27.542 ( 0.132 -1.124 0.492) 1.234 27.625 ( -0.162 1.888 -0.571) 1.980 36.720 ( -0.688 1.091 1.156) 1.732 37.139 ( 3.173 18.584 6.907) 20.079 37.473 ( -3.451 14.860 -2.568) 15.470 37.999 ( 0.973 35.772 -6.134) 36.307 ======================= Grid point 949 (369/371) ======================= q-point: (-0.38 -0.46 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.292 ( 11.339 12.878 -7.332) 18.659 3.571 ( 2.702 21.590 0.219) 21.760 4.033 ( -0.045 -8.836 -4.432) 9.885 6.025 ( -3.967 14.258 11.136) 18.522 6.726 ( 8.064 5.285 -2.011) 9.849 7.566 ( -9.690 -1.493 -11.667) 15.240 7.755 ( 10.262 5.326 4.031) 12.245 7.957 ( -1.463 0.637 13.573) 13.667 8.177 ( 6.703 1.254 -6.573) 9.472 8.678 ( -9.223 4.013 4.801) 11.145 9.475 ( 7.252 -5.470 -6.709) 11.293 10.096 ( -3.373 1.279 1.884) 4.070 11.456 ( -1.356 5.704 -9.140) 10.859 11.792 ( -2.592 8.201 8.911) 12.385 11.911 ( 11.192 4.234 -2.059) 12.142 12.354 ( 4.706 12.215 2.934) 13.415 13.091 ( -5.371 -13.139 -4.804) 14.985 13.397 ( -4.382 -12.139 1.300) 12.971 18.860 ( 0.308 -10.431 -2.893) 10.829 19.032 ( -8.004 -3.784 0.966) 8.906 19.280 ( 4.630 -6.504 4.531) 9.180 19.437 ( -3.643 1.168 -2.929) 4.818 21.392 ( -5.608 -16.004 -0.530) 16.966 21.525 ( -5.051 -14.101 0.111) 14.979 27.536 ( -0.032 0.252 -0.584) 0.637 27.651 ( 1.021 2.080 0.610) 2.396 36.823 ( 10.417 1.907 -1.060) 10.643 37.211 ( -13.055 18.093 3.197) 22.539 37.833 ( 19.599 16.509 7.679) 26.752 38.348 ( 6.839 32.520 -6.894) 33.939 ======================= Grid point 1105 (370/371) ======================= q-point: ( 0.46 0.46 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 371 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.902 ( -0.000 0.000 8.412) 8.412 2.902 ( -0.000 0.000 8.412) 8.412 4.684 ( -0.000 0.000 12.799) 12.799 5.606 ( 0.000 -0.000 -5.651) 5.651 5.606 ( 0.000 -0.000 -5.651) 5.651 7.457 ( -0.000 0.000 2.604) 2.604 7.457 ( -0.000 0.000 2.604) 2.604 8.185 ( 0.000 -0.000 -4.623) 4.623 8.794 ( 0.000 -0.000 -0.605) 0.605 8.794 ( 0.000 -0.000 -0.605) 0.605 9.093 ( 0.000 -0.000 -2.298) 2.298 10.422 ( 0.000 -0.000 -0.603) 0.603 11.464 ( -0.000 0.000 2.743) 2.743 11.464 ( 0.000 0.000 2.743) 2.743 11.546 ( 0.000 -0.000 -2.504) 2.504 11.546 ( 0.000 -0.000 -2.504) 2.504 13.542 ( 0.000 -0.000 -0.516) 0.516 13.841 ( 0.000 -0.000 -0.011) 0.011 19.212 ( -0.000 0.000 1.931) 1.931 19.212 ( -0.000 0.000 1.931) 1.931 19.422 ( 0.000 -0.000 -1.855) 1.855 19.422 ( 0.000 -0.000 -1.855) 1.855 21.929 ( -0.000 0.000 12.832) 12.832 22.142 ( 0.000 -0.000 -12.180) 12.180 27.568 ( -0.000 0.000 2.887) 2.887 27.615 ( 0.000 -0.000 -2.952) 2.952 36.746 ( 0.000 -0.000 -0.331) 0.331 36.746 ( 0.000 -0.000 -0.331) 0.331 37.120 ( -0.000 0.000 0.344) 0.344 37.120 ( 0.000 0.000 0.344) 0.344 ======================= Grid point 1106 (371/371) ======================= q-point: ( 0.54 0.46 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 7.40e-04 3.34e-04 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.959 ( 3.952 1.698 9.982) 10.870 3.053 ( 9.732 6.266 -4.464) 12.405 4.472 ( -16.755 -9.683 5.319) 20.070 5.686 ( 8.554 3.774 -8.103) 12.373 5.958 ( 26.697 16.620 2.827) 31.575 7.464 ( 0.354 -0.424 0.317) 0.637 7.536 ( 5.997 4.138 2.152) 7.597 8.165 ( -0.365 -0.656 0.312) 0.813 8.461 ( -20.614 -10.934 -3.359) 23.575 8.756 ( -2.029 -3.143 1.005) 3.873 9.327 ( 11.575 8.254 -1.044) 14.255 10.283 ( -9.475 -5.569 -0.978) 11.034 11.428 ( -2.800 3.157 6.466) 7.721 11.538 ( 8.302 -5.784 -5.251) 11.400 11.650 ( 4.411 9.672 -1.568) 10.746 11.752 ( 18.219 9.045 1.272) 20.381 13.466 ( -6.755 -3.858 0.120) 7.780 13.760 ( -7.120 -4.189 0.167) 8.263 19.139 ( -6.364 -3.839 2.677) 7.899 19.196 ( -2.351 -1.015 -1.990) 3.243 19.394 ( -2.202 -1.974 -2.536) 3.895 19.425 ( 0.795 0.998 1.894) 2.283 21.878 ( -9.834 -5.779 6.603) 13.180 21.971 ( -9.632 -5.451 -6.162) 12.668 27.573 ( -1.418 -0.702 1.633) 2.274 27.598 ( 0.638 0.244 -1.630) 1.767 36.728 ( -1.444 0.281 -0.929) 1.739 36.856 ( 11.335 5.156 -1.909) 12.599 37.222 ( 8.663 4.872 1.842) 10.109 37.388 ( 21.842 13.012 0.237) 25.425 =================== 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 3/65910 10.0 1195.352 1195.352 2216.848 0.000 -0.000 0.000 3/65910 20.0 1294.211 1294.211 980.686 0.000 -0.000 0.000 3/65910 30.0 856.570 856.570 668.724 0.000 -0.000 0.000 3/65910 40.0 574.259 574.259 442.481 0.000 -0.000 0.000 3/65910 50.0 377.456 377.456 282.107 0.000 -0.000 0.000 3/65910 60.0 250.522 250.522 182.752 0.000 -0.000 0.000 3/65910 70.0 173.652 173.652 124.330 0.000 -0.000 0.000 3/65910 80.0 126.759 126.759 89.516 0.000 -0.000 0.000 3/65910 90.0 97.058 97.058 67.886 0.000 -0.000 0.000 3/65910 100.0 77.378 77.378 53.769 0.000 -0.000 0.000 3/65910 110.0 63.755 63.755 44.108 0.000 -0.000 0.000 3/65910 120.0 53.945 53.945 37.208 0.000 -0.000 0.000 3/65910 130.0 46.632 46.632 32.094 0.000 -0.000 0.000 3/65910 140.0 41.015 41.015 28.182 0.000 -0.000 0.000 3/65910 150.0 36.589 36.589 25.107 0.000 -0.000 0.000 3/65910 160.0 33.024 33.024 22.636 0.000 -0.000 0.000 3/65910 170.0 30.098 30.098 20.610 0.000 -0.000 0.000 3/65910 180.0 27.656 27.656 18.922 0.000 -0.000 0.000 3/65910 190.0 25.591 25.591 17.495 0.000 -0.000 0.000 3/65910 200.0 23.821 23.821 16.273 0.000 -0.000 0.000 3/65910 210.0 22.289 22.289 15.216 0.000 -0.000 0.000 3/65910 220.0 20.950 20.950 14.293 0.000 -0.000 0.000 3/65910 230.0 19.769 19.769 13.480 0.000 -0.000 0.000 3/65910 240.0 18.721 18.721 12.758 0.000 -0.000 0.000 3/65910 250.0 17.783 17.783 12.113 0.000 -0.000 0.000 3/65910 260.0 16.940 16.940 11.534 0.000 -0.000 0.000 3/65910 270.0 16.177 16.177 11.010 0.000 -0.000 0.000 3/65910 280.0 15.484 15.484 10.535 0.000 -0.000 0.000 3/65910 290.0 14.851 14.851 10.102 0.000 -0.000 0.000 3/65910 300.0 14.270 14.270 9.705 0.000 -0.000 0.000 3/65910 310.0 13.736 13.736 9.340 0.000 -0.000 0.000 3/65910 320.0 13.243 13.243 9.003 0.000 -0.000 0.000 3/65910 330.0 12.786 12.786 8.692 0.000 -0.000 0.000 3/65910 340.0 12.362 12.362 8.403 0.000 -0.000 0.000 3/65910 350.0 11.966 11.966 8.134 0.000 -0.000 0.000 3/65910 360.0 11.597 11.597 7.883 0.000 -0.000 0.000 3/65910 370.0 11.251 11.251 7.648 0.000 -0.000 0.000 3/65910 380.0 10.926 10.926 7.428 0.000 -0.000 0.000 3/65910 390.0 10.621 10.621 7.221 0.000 -0.000 0.000 3/65910 400.0 10.333 10.333 7.027 0.000 -0.000 0.000 3/65910 410.0 10.062 10.062 6.843 0.000 -0.000 0.000 3/65910 420.0 9.805 9.805 6.669 0.000 -0.000 0.000 3/65910 430.0 9.562 9.562 6.505 0.000 -0.000 0.000 3/65910 440.0 9.332 9.332 6.350 0.000 -0.000 0.000 3/65910 450.0 9.112 9.112 6.202 0.000 -0.000 0.000 3/65910 460.0 8.904 8.904 6.061 0.000 -0.000 0.000 3/65910 470.0 8.705 8.705 5.928 0.000 -0.000 0.000 3/65910 480.0 8.516 8.516 5.800 0.000 -0.000 0.000 3/65910 490.0 8.335 8.335 5.678 0.000 -0.000 0.000 3/65910 500.0 8.162 8.162 5.562 0.000 -0.000 0.000 3/65910 510.0 7.997 7.997 5.451 0.000 -0.000 0.000 3/65910 520.0 7.839 7.839 5.344 0.000 -0.000 0.000 3/65910 530.0 7.687 7.687 5.242 0.000 -0.000 0.000 3/65910 540.0 7.541 7.541 5.144 0.000 -0.000 0.000 3/65910 550.0 7.401 7.401 5.050 0.000 -0.000 0.000 3/65910 560.0 7.266 7.266 4.959 0.000 -0.000 0.000 3/65910 570.0 7.136 7.136 4.872 0.000 -0.000 0.000 3/65910 580.0 7.011 7.011 4.788 0.000 -0.000 0.000 3/65910 590.0 6.891 6.891 4.708 0.000 -0.000 0.000 3/65910 600.0 6.775 6.775 4.630 0.000 -0.000 0.000 3/65910 610.0 6.663 6.663 4.554 0.000 -0.000 0.000 3/65910 620.0 6.555 6.555 4.481 0.000 -0.000 0.000 3/65910 630.0 6.450 6.450 4.411 0.000 -0.000 0.000 3/65910 640.0 6.349 6.349 4.343 0.000 -0.000 0.000 3/65910 650.0 6.251 6.251 4.277 0.000 -0.000 0.000 3/65910 660.0 6.156 6.156 4.214 0.000 -0.000 0.000 3/65910 670.0 6.065 6.065 4.152 0.000 -0.000 0.000 3/65910 680.0 5.976 5.976 4.092 0.000 -0.000 0.000 3/65910 690.0 5.889 5.889 4.034 0.000 -0.000 0.000 3/65910 700.0 5.806 5.806 3.978 0.000 -0.000 0.000 3/65910 710.0 5.724 5.724 3.923 0.000 -0.000 0.000 3/65910 720.0 5.645 5.645 3.870 0.000 -0.000 0.000 3/65910 730.0 5.569 5.569 3.818 0.000 -0.000 0.000 3/65910 740.0 5.494 5.494 3.768 0.000 -0.000 0.000 3/65910 750.0 5.422 5.422 3.719 0.000 -0.000 0.000 3/65910 760.0 5.351 5.351 3.671 0.000 -0.000 0.000 3/65910 770.0 5.282 5.282 3.625 0.000 -0.000 0.000 3/65910 780.0 5.215 5.215 3.580 0.000 -0.000 0.000 3/65910 790.0 5.150 5.150 3.536 0.000 -0.000 0.000 3/65910 800.0 5.087 5.087 3.493 0.000 -0.000 0.000 3/65910 810.0 5.025 5.025 3.451 0.000 -0.000 0.000 3/65910 820.0 4.965 4.965 3.410 0.000 -0.000 0.000 3/65910 830.0 4.906 4.906 3.371 0.000 -0.000 0.000 3/65910 840.0 4.848 4.848 3.332 0.000 -0.000 0.000 3/65910 850.0 4.792 4.792 3.294 0.000 -0.000 0.000 3/65910 860.0 4.738 4.738 3.257 0.000 -0.000 0.000 3/65910 870.0 4.684 4.684 3.221 0.000 -0.000 0.000 3/65910 880.0 4.632 4.632 3.185 0.000 -0.000 0.000 3/65910 890.0 4.581 4.581 3.151 0.000 -0.000 0.000 3/65910 900.0 4.531 4.531 3.117 0.000 -0.000 0.000 3/65910 910.0 4.483 4.483 3.084 0.000 -0.000 0.000 3/65910 920.0 4.435 4.435 3.052 0.000 -0.000 0.000 3/65910 930.0 4.388 4.388 3.020 0.000 -0.000 0.000 3/65910 940.0 4.343 4.343 2.989 0.000 -0.000 0.000 3/65910 950.0 4.298 4.298 2.959 0.000 -0.000 0.000 3/65910 960.0 4.254 4.254 2.929 0.000 -0.000 0.000 3/65910 970.0 4.211 4.211 2.900 0.000 -0.000 0.000 3/65910 980.0 4.169 4.169 2.871 0.000 -0.000 0.000 3/65910 990.0 4.128 4.128 2.844 0.000 -0.000 0.000 3/65910 1000.0 4.088 4.088 2.816 0.000 -0.000 0.000 3/65910 Thermal conductivity related properties were written into "kappa-m131313.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:00:09]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|