----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 21:34:49]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 2] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/m (11) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.467300790110874 0.000000000000000 0.000000000000000 b 0.000000000000000 7.773844970000000 0.000000000000000 c -2.423557802551437 0.000000000000000 6.391730561522190 Atomic positions (fractional): *1 Na 0.50000000000000 0.00000000000000 0.00000000000000 22.990 *2 Na 0.48943654638469 0.25000000000000 0.50834069307111 22.990 3 Na 0.50000000000000 0.50000000000000 0.00000000000000 22.990 4 Na 0.51056345361531 0.75000000000000 0.49165930692889 22.990 *5 U 0.99534361989208 0.75000000000000 0.96283928775346 238.029 *6 U 0.00000000000000 0.00000000000000 0.50000000000000 238.029 7 U 0.00465638010792 0.25000000000000 0.03716071224654 238.029 8 U 0.00000000000000 0.50000000000000 0.50000000000000 238.029 *9 O 0.68914298625087 0.02165108551702 0.39756936023056 15.999 *10 O 0.98567069206060 0.95538745175494 0.18024993966088 15.999 *11 O 0.69495243564998 0.25000000000000 0.93143619769812 15.999 12 O 0.30504756435002 0.75000000000000 0.06856380230188 15.999 13 O 0.01432930793940 0.04461254824506 0.81975006033912 15.999 14 O 0.68914298625087 0.47834891448298 0.39756936023056 15.999 15 O 0.31085701374913 0.97834891448298 0.60243063976944 15.999 *16 O 0.04424980932632 0.25000000000000 0.38501597901040 15.999 17 O 0.98567069206060 0.54461254824506 0.18024993966088 15.999 *18 O 0.68866700434671 0.75000000000000 0.86757346832669 15.999 19 O 0.31133299565329 0.25000000000000 0.13242653167331 15.999 20 O 0.01432930793940 0.45538745175494 0.81975006033912 15.999 21 O 0.95575019067368 0.75000000000000 0.61498402098960 15.999 22 O 0.31085701374913 0.52165108551702 0.60243063976944 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.467300790110874 0.000000000000000 0.000000000000000 b 0.000000000000000 7.773844970000000 0.000000000000000 c -2.423557802551437 0.000000000000000 6.391730561522190 Atomic positions (fractional): *1 Na 0.50000000000000 0.00000000000000 0.00000000000000 22.990 > 1 *2 Na 0.48943654638469 0.25000000000000 0.50834069307111 22.990 > 2 3 Na 0.50000000000000 0.50000000000000 0.00000000000000 22.990 > 3 4 Na 0.51056345361531 0.75000000000000 0.49165930692889 22.990 > 4 *5 U 0.99534361989208 0.75000000000000 0.96283928775346 238.029 > 5 *6 U 0.00000000000000 0.00000000000000 0.50000000000000 238.029 > 6 7 U 0.00465638010792 0.25000000000000 0.03716071224654 238.029 > 7 8 U 0.00000000000000 0.50000000000000 0.50000000000000 238.029 > 8 *9 O 0.68914298625087 0.02165108551702 0.39756936023056 15.999 > 9 *10 O 0.98567069206060 0.95538745175494 0.18024993966088 15.999 > 10 *11 O 0.69495243564998 0.25000000000000 0.93143619769812 15.999 > 11 12 O 0.30504756435002 0.75000000000000 0.06856380230188 15.999 > 12 13 O 0.01432930793940 0.04461254824506 0.81975006033912 15.999 > 13 14 O 0.68914298625087 0.47834891448298 0.39756936023056 15.999 > 14 15 O 0.31085701374913 0.97834891448298 0.60243063976944 15.999 > 15 *16 O 0.04424980932632 0.25000000000000 0.38501597901040 15.999 > 16 17 O 0.98567069206060 0.54461254824506 0.18024993966088 15.999 > 17 *18 O 0.68866700434671 0.75000000000000 0.86757346832669 15.999 > 18 19 O 0.31133299565329 0.25000000000000 0.13242653167331 15.999 > 19 20 O 0.01432930793940 0.45538745175494 0.81975006033912 15.999 > 20 21 O 0.95575019067368 0.75000000000000 0.61498402098960 15.999 > 21 22 O 0.31085701374913 0.52165108551702 0.60243063976944 15.999 > 22 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.934601580221749 0.000000000000000 0.000000000000000 b 0.000000000000000 7.773844970000000 0.000000000000000 c -4.847115605102874 0.000000000000000 12.783461123044381 Atomic positions (fractional): *1 Na 0.25000000000000 0.00000000000000 0.00000000000000 22.990 > 1 2 Na 0.75000000000000 0.00000000000000 0.00000000000000 22.990 > 1 3 Na 0.25000000000000 0.00000000000000 0.50000000000000 22.990 > 1 4 Na 0.75000000000000 0.00000000000000 0.50000000000000 22.990 > 1 *5 Na 0.24471827319234 0.25000000000000 0.25417034653556 22.990 > 2 6 Na 0.74471827319234 0.25000000000000 0.25417034653556 22.990 > 2 7 Na 0.24471827319234 0.25000000000000 0.75417034653556 22.990 > 2 8 Na 0.74471827319234 0.25000000000000 0.75417034653556 22.990 > 2 9 Na 0.25000000000000 0.50000000000000 0.00000000000000 22.990 > 3 10 Na 0.75000000000000 0.50000000000000 0.00000000000000 22.990 > 3 11 Na 0.25000000000000 0.50000000000000 0.50000000000000 22.990 > 3 12 Na 0.75000000000000 0.50000000000000 0.50000000000000 22.990 > 3 13 Na 0.25528172680765 0.75000000000000 0.24582965346444 22.990 > 4 14 Na 0.75528172680766 0.75000000000000 0.24582965346444 22.990 > 4 15 Na 0.25528172680765 0.75000000000000 0.74582965346444 22.990 > 4 16 Na 0.75528172680766 0.75000000000000 0.74582965346444 22.990 > 4 *17 U 0.49767180994604 0.75000000000000 0.48141964387673 238.029 > 5 18 U 0.99767180994604 0.75000000000000 0.48141964387673 238.029 > 5 19 U 0.49767180994604 0.75000000000000 0.98141964387673 238.029 > 5 20 U 0.99767180994604 0.75000000000000 0.98141964387673 238.029 > 5 *21 U 0.00000000000000 0.00000000000000 0.25000000000000 238.029 > 6 22 U 0.50000000000000 0.00000000000000 0.25000000000000 238.029 > 6 23 U 0.00000000000000 0.00000000000000 0.75000000000000 238.029 > 6 24 U 0.50000000000000 0.00000000000000 0.75000000000000 238.029 > 6 25 U 0.00232819005396 0.25000000000000 0.01858035612327 238.029 > 7 26 U 0.50232819005396 0.25000000000000 0.01858035612327 238.029 > 7 27 U 0.00232819005396 0.25000000000000 0.51858035612327 238.029 > 7 28 U 0.50232819005396 0.25000000000000 0.51858035612327 238.029 > 7 29 U 0.00000000000000 0.50000000000000 0.25000000000000 238.029 > 8 30 U 0.50000000000000 0.50000000000000 0.25000000000000 238.029 > 8 31 U 0.00000000000000 0.50000000000000 0.75000000000000 238.029 > 8 32 U 0.50000000000000 0.50000000000000 0.75000000000000 238.029 > 8 *33 O 0.34457149312543 0.02165108551702 0.19878468011528 15.999 > 9 34 O 0.84457149312543 0.02165108551702 0.19878468011528 15.999 > 9 35 O 0.34457149312543 0.02165108551702 0.69878468011528 15.999 > 9 36 O 0.84457149312543 0.02165108551702 0.69878468011528 15.999 > 9 *37 O 0.49283534603030 0.95538745175494 0.09012496983044 15.999 > 10 38 O 0.99283534603030 0.95538745175494 0.09012496983044 15.999 > 10 39 O 0.49283534603030 0.95538745175494 0.59012496983044 15.999 > 10 40 O 0.99283534603030 0.95538745175494 0.59012496983044 15.999 > 10 *41 O 0.34747621782499 0.25000000000000 0.46571809884906 15.999 > 11 42 O 0.84747621782499 0.25000000000000 0.46571809884906 15.999 > 11 43 O 0.34747621782499 0.25000000000000 0.96571809884906 15.999 > 11 44 O 0.84747621782499 0.25000000000000 0.96571809884906 15.999 > 11 45 O 0.15252378217501 0.75000000000000 0.03428190115094 15.999 > 12 46 O 0.65252378217501 0.75000000000000 0.03428190115094 15.999 > 12 47 O 0.15252378217501 0.75000000000000 0.53428190115094 15.999 > 12 48 O 0.65252378217501 0.75000000000000 0.53428190115094 15.999 > 12 49 O 0.00716465396970 0.04461254824506 0.40987503016956 15.999 > 13 50 O 0.50716465396970 0.04461254824506 0.40987503016956 15.999 > 13 51 O 0.00716465396970 0.04461254824506 0.90987503016956 15.999 > 13 52 O 0.50716465396970 0.04461254824506 0.90987503016956 15.999 > 13 53 O 0.34457149312543 0.47834891448298 0.19878468011528 15.999 > 14 54 O 0.84457149312543 0.47834891448298 0.19878468011528 15.999 > 14 55 O 0.34457149312543 0.47834891448298 0.69878468011528 15.999 > 14 56 O 0.84457149312543 0.47834891448298 0.69878468011528 15.999 > 14 57 O 0.15542850687457 0.97834891448298 0.30121531988472 15.999 > 15 58 O 0.65542850687457 0.97834891448298 0.30121531988472 15.999 > 15 59 O 0.15542850687457 0.97834891448298 0.80121531988472 15.999 > 15 60 O 0.65542850687457 0.97834891448298 0.80121531988472 15.999 > 15 *61 O 0.02212490466316 0.25000000000000 0.19250798950520 15.999 > 16 62 O 0.52212490466316 0.25000000000000 0.19250798950520 15.999 > 16 63 O 0.02212490466316 0.25000000000000 0.69250798950520 15.999 > 16 64 O 0.52212490466316 0.25000000000000 0.69250798950520 15.999 > 16 65 O 0.49283534603030 0.54461254824506 0.09012496983044 15.999 > 17 66 O 0.99283534603030 0.54461254824506 0.09012496983044 15.999 > 17 67 O 0.49283534603030 0.54461254824506 0.59012496983044 15.999 > 17 68 O 0.99283534603030 0.54461254824506 0.59012496983044 15.999 > 17 *69 O 0.34433350217336 0.75000000000000 0.43378673416335 15.999 > 18 70 O 0.84433350217336 0.75000000000000 0.43378673416335 15.999 > 18 71 O 0.34433350217336 0.75000000000000 0.93378673416335 15.999 > 18 72 O 0.84433350217336 0.75000000000000 0.93378673416335 15.999 > 18 73 O 0.15566649782664 0.25000000000000 0.06621326583665 15.999 > 19 74 O 0.65566649782664 0.25000000000000 0.06621326583665 15.999 > 19 75 O 0.15566649782664 0.25000000000000 0.56621326583665 15.999 > 19 76 O 0.65566649782664 0.25000000000000 0.56621326583665 15.999 > 19 77 O 0.00716465396970 0.45538745175494 0.40987503016956 15.999 > 20 78 O 0.50716465396970 0.45538745175494 0.40987503016956 15.999 > 20 79 O 0.00716465396970 0.45538745175494 0.90987503016956 15.999 > 20 80 O 0.50716465396970 0.45538745175494 0.90987503016956 15.999 > 20 81 O 0.47787509533684 0.75000000000000 0.30749201049480 15.999 > 21 82 O 0.97787509533684 0.75000000000000 0.30749201049480 15.999 > 21 83 O 0.47787509533684 0.75000000000000 0.80749201049480 15.999 > 21 84 O 0.97787509533684 0.75000000000000 0.80749201049480 15.999 > 21 85 O 0.15542850687457 0.52165108551702 0.30121531988472 15.999 > 22 86 O 0.65542850687457 0.52165108551702 0.30121531988472 15.999 > 22 87 O 0.15542850687457 0.52165108551702 0.80121531988472 15.999 > 22 88 O 0.65542850687457 0.52165108551702 0.80121531988472 15.999 > 22 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.6320584 0.0000000 -0.5314139 0.0000000 4.8159829 0.0000000 -0.5314108 0.0000000 4.8044032 -------------------------- Born effective charges -------------------------- 1 Na 1.5318320 0.0803211 0.1899411 -0.0160157 1.0453235 -0.0009172 0.1761087 -0.0001562 1.1302102 2 Na 1.5196940 0.0000000 0.1561623 -0.0000000 1.0711323 0.0000000 0.1808494 0.0000000 1.1155478 3 Na 1.5318320 -0.0803211 0.1899411 0.0160157 1.0453235 0.0009172 0.1761087 0.0001562 1.1302102 4 Na 1.5196940 0.0000000 0.1561623 -0.0000000 1.0711323 0.0000000 0.1808494 0.0000000 1.1155478 5 U 4.7538430 0.0000000 -0.5501641 -0.0000000 6.9686999 0.0000000 -0.5186444 0.0000000 5.9266492 6 U 4.8519382 0.2940365 -0.8768618 0.5493755 5.4141661 -0.7160247 -0.8979821 -1.2176518 6.7487016 7 U 4.7538430 0.0000000 -0.5501641 -0.0000000 6.9686999 0.0000000 -0.5186444 0.0000000 5.9266492 8 U 4.8519382 -0.2940365 -0.8768618 -0.5493755 5.4141661 0.7160247 -0.8979821 1.2176518 6.7487016 9 O -2.5651454 0.0873142 -0.5947362 0.1623995 -0.8743834 0.0905593 -0.5978854 0.1219114 -1.1681771 10 O -0.8700881 0.2808536 1.2495368 0.3851872 -3.3372979 -1.0866798 1.2332669 -0.8297088 -3.7356311 11 O -2.5537300 0.0000000 -0.6864461 -0.0000000 -0.9488381 0.0000000 -0.4872724 0.0000000 -1.0350306 12 O -2.5537300 0.0000000 -0.6864461 -0.0000000 -0.9488381 0.0000000 -0.4872724 0.0000000 -1.0350306 13 O -0.8700881 0.2808536 1.2495368 0.3851872 -3.3372979 -1.0866798 1.2332669 -0.8297088 -3.7356311 14 O -2.5651454 -0.0873142 -0.5947362 -0.1623995 -0.8743834 -0.0905593 -0.5978854 -0.1219114 -1.1681771 15 O -2.5651454 0.0873142 -0.5947362 0.1623995 -0.8743834 0.0905593 -0.5978854 0.1219114 -1.1681771 16 O -0.7729467 0.0000000 0.9911916 -0.0000000 -4.2594284 0.0000000 0.9866743 0.0000000 -2.9565526 17 O -0.8700881 -0.2808536 1.2495368 -0.3851872 -3.3372979 1.0866798 1.2332669 0.8297088 -3.7356311 18 O -2.4601635 0.0000000 -0.5334243 -0.0000000 -0.8676929 0.0000000 -0.7104965 0.0000000 -1.1219092 19 O -2.4601635 0.0000000 -0.5334243 -0.0000000 -0.8676929 0.0000000 -0.7104965 0.0000000 -1.1219092 20 O -0.8700881 -0.2808536 1.2495368 -0.3851872 -3.3372979 1.0866798 1.2332669 0.8297088 -3.7356311 21 O -0.7729467 0.0000000 0.9911916 -0.0000000 -4.2594284 0.0000000 0.9866743 0.0000000 -2.9565526 22 O -2.5651454 -0.0873142 -0.5947362 -0.1623995 -0.8743834 -0.0905593 -0.5978854 -0.1219114 -1.1681771 ---------------------------------------------------------------------------- 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: 264/264 Permutation basis: 8976/8976 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2396 Number of blocks in projector: 2396 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 592 Use submatrix version of eigh solver. (1) Block: 592 / 592 (2) Block: 250 / 592 (2) 233 eigenvectors found. (2) Block: 500 / 592 (2) 233 eigenvectors found. (2) Block: 592 / 592 (2) 83 eigenvectors found. (2) Complementary block size: 43 (2) Compute compressed projector. (2) Use standard solver. (2) 26 eigenvectors found. (1) 575 eigenvectors found. (1) Complementary block size: 16 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 340 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 340 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 340 Use standard eigh solver. Tree of FC basis block matrices: - (2396, 2336), data: False |-- (340, 331), data: True |-- (340, 331), data: True |-- (340, 331), data: True |-- (392, 384), data: True |-- (392, 384), data: True |-- (592, 575), data: False |-- (592, 575), data: False |-- (592, 26), data: (592, 43) @ (43, 26) |-- (92, 83), data: True |-- (250, 233), data: True |-- (250, 233), data: True ----- Solver_atoms: 1 -- 88 / 88 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 720 - Time: 0.574 Solver_block: 200 / 720 - Time: 0.487 Solver_block: 300 / 720 - Time: 0.480 Solver_block: 400 / 720 - Time: 0.481 Solver_block: 500 / 720 - Time: 0.478 Solver_block: 600 / 720 - Time: 0.479 Solver_block: 700 / 720 - Time: 0.478 Solver_block: 720 / 720 - Time: 0.182 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 3.763 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 264/264 Permutation basis: 8976/8976 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2396 Number of blocks in projector: 2396 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 592 Use submatrix version of eigh solver. (1) Block: 592 / 592 (2) Block: 250 / 592 (2) 233 eigenvectors found. (2) Block: 500 / 592 (2) 233 eigenvectors found. (2) Block: 592 / 592 (2) 83 eigenvectors found. (2) Complementary block size: 43 (2) Compute compressed projector. (2) Use standard solver. (2) 26 eigenvectors found. (1) 575 eigenvectors found. (1) Complementary block size: 16 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 392 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 340 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 340 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 340 Use standard eigh solver. Tree of FC basis block matrices: - (2396, 2336), data: False |-- (340, 331), data: True |-- (340, 331), data: True |-- (340, 331), data: True |-- (392, 384), data: True |-- (392, 384), data: True |-- (592, 575), data: False |-- (592, 575), data: False |-- (592, 26), data: (592, 43) @ (43, 26) |-- (92, 83), data: True |-- (250, 233), data: True |-- (250, 233), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 21:35:17]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 21:35:17]------------------------- 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 1 2] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/m (11) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.467300790110874 0.000000000000000 0.000000000000000 b 0.000000000000000 7.773844970000000 0.000000000000000 c -2.423557802551437 0.000000000000000 6.391730561522190 Atomic positions (fractional): 1 Na 0.50000000000000 0.00000000000000 0.00000000000000 22.990 2 Na 0.48943654638469 0.25000000000000 0.50834069307111 22.990 3 Na 0.50000000000000 0.50000000000000 0.00000000000000 22.990 4 Na 0.51056345361531 0.75000000000000 0.49165930692889 22.990 5 U 0.99534361989208 0.75000000000000 0.96283928775346 238.029 6 U 0.00000000000000 0.00000000000000 0.50000000000000 238.029 7 U 0.00465638010792 0.25000000000000 0.03716071224654 238.029 8 U 0.00000000000000 0.50000000000000 0.50000000000000 238.029 9 O 0.68914298625087 0.02165108551702 0.39756936023056 15.999 10 O 0.98567069206060 0.95538745175494 0.18024993966088 15.999 11 O 0.69495243564998 0.25000000000000 0.93143619769812 15.999 12 O 0.30504756435002 0.75000000000000 0.06856380230188 15.999 13 O 0.01432930793940 0.04461254824506 0.81975006033912 15.999 14 O 0.68914298625087 0.47834891448298 0.39756936023056 15.999 15 O 0.31085701374913 0.97834891448298 0.60243063976944 15.999 16 O 0.04424980932632 0.25000000000000 0.38501597901040 15.999 17 O 0.98567069206060 0.54461254824506 0.18024993966088 15.999 18 O 0.68866700434671 0.75000000000000 0.86757346832669 15.999 19 O 0.31133299565329 0.25000000000000 0.13242653167331 15.999 20 O 0.01432930793940 0.45538745175494 0.81975006033912 15.999 21 O 0.95575019067368 0.75000000000000 0.61498402098960 15.999 22 O 0.31085701374913 0.52165108551702 0.60243063976944 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.934601580221749 0.000000000000000 0.000000000000000 b 0.000000000000000 7.773844970000000 0.000000000000000 c -4.847115605102874 0.000000000000000 12.783461123044381 Atomic positions (fractional): 1 Na 0.25000000000000 0.00000000000000 0.00000000000000 22.990 > 1 2 Na 0.75000000000000 0.00000000000000 0.00000000000000 22.990 > 1 3 Na 0.25000000000000 0.00000000000000 0.50000000000000 22.990 > 1 4 Na 0.75000000000000 0.00000000000000 0.50000000000000 22.990 > 1 5 Na 0.24471827319234 0.25000000000000 0.25417034653556 22.990 > 5 6 Na 0.74471827319234 0.25000000000000 0.25417034653556 22.990 > 5 7 Na 0.24471827319234 0.25000000000000 0.75417034653556 22.990 > 5 8 Na 0.74471827319234 0.25000000000000 0.75417034653556 22.990 > 5 9 Na 0.25000000000000 0.50000000000000 0.00000000000000 22.990 > 9 10 Na 0.75000000000000 0.50000000000000 0.00000000000000 22.990 > 9 11 Na 0.25000000000000 0.50000000000000 0.50000000000000 22.990 > 9 12 Na 0.75000000000000 0.50000000000000 0.50000000000000 22.990 > 9 13 Na 0.25528172680765 0.75000000000000 0.24582965346444 22.990 > 13 14 Na 0.75528172680766 0.75000000000000 0.24582965346444 22.990 > 13 15 Na 0.25528172680765 0.75000000000000 0.74582965346444 22.990 > 13 16 Na 0.75528172680766 0.75000000000000 0.74582965346444 22.990 > 13 17 U 0.49767180994604 0.75000000000000 0.48141964387673 238.029 > 17 18 U 0.99767180994604 0.75000000000000 0.48141964387673 238.029 > 17 19 U 0.49767180994604 0.75000000000000 0.98141964387673 238.029 > 17 20 U 0.99767180994604 0.75000000000000 0.98141964387673 238.029 > 17 21 U 0.00000000000000 0.00000000000000 0.25000000000000 238.029 > 21 22 U 0.50000000000000 0.00000000000000 0.25000000000000 238.029 > 21 23 U 0.00000000000000 0.00000000000000 0.75000000000000 238.029 > 21 24 U 0.50000000000000 0.00000000000000 0.75000000000000 238.029 > 21 25 U 0.00232819005396 0.25000000000000 0.01858035612327 238.029 > 25 26 U 0.50232819005396 0.25000000000000 0.01858035612327 238.029 > 25 27 U 0.00232819005396 0.25000000000000 0.51858035612327 238.029 > 25 28 U 0.50232819005396 0.25000000000000 0.51858035612327 238.029 > 25 29 U 0.00000000000000 0.50000000000000 0.25000000000000 238.029 > 29 30 U 0.50000000000000 0.50000000000000 0.25000000000000 238.029 > 29 31 U 0.00000000000000 0.50000000000000 0.75000000000000 238.029 > 29 32 U 0.50000000000000 0.50000000000000 0.75000000000000 238.029 > 29 33 O 0.34457149312543 0.02165108551702 0.19878468011528 15.999 > 33 34 O 0.84457149312543 0.02165108551702 0.19878468011528 15.999 > 33 35 O 0.34457149312543 0.02165108551702 0.69878468011528 15.999 > 33 36 O 0.84457149312543 0.02165108551702 0.69878468011528 15.999 > 33 37 O 0.49283534603030 0.95538745175494 0.09012496983044 15.999 > 37 38 O 0.99283534603030 0.95538745175494 0.09012496983044 15.999 > 37 39 O 0.49283534603030 0.95538745175494 0.59012496983044 15.999 > 37 40 O 0.99283534603030 0.95538745175494 0.59012496983044 15.999 > 37 41 O 0.34747621782499 0.25000000000000 0.46571809884906 15.999 > 41 42 O 0.84747621782499 0.25000000000000 0.46571809884906 15.999 > 41 43 O 0.34747621782499 0.25000000000000 0.96571809884906 15.999 > 41 44 O 0.84747621782499 0.25000000000000 0.96571809884906 15.999 > 41 45 O 0.15252378217501 0.75000000000000 0.03428190115094 15.999 > 45 46 O 0.65252378217501 0.75000000000000 0.03428190115094 15.999 > 45 47 O 0.15252378217501 0.75000000000000 0.53428190115094 15.999 > 45 48 O 0.65252378217501 0.75000000000000 0.53428190115094 15.999 > 45 49 O 0.00716465396970 0.04461254824506 0.40987503016956 15.999 > 49 50 O 0.50716465396970 0.04461254824506 0.40987503016956 15.999 > 49 51 O 0.00716465396970 0.04461254824506 0.90987503016956 15.999 > 49 52 O 0.50716465396970 0.04461254824506 0.90987503016956 15.999 > 49 53 O 0.34457149312543 0.47834891448298 0.19878468011528 15.999 > 53 54 O 0.84457149312543 0.47834891448298 0.19878468011528 15.999 > 53 55 O 0.34457149312543 0.47834891448298 0.69878468011528 15.999 > 53 56 O 0.84457149312543 0.47834891448298 0.69878468011528 15.999 > 53 57 O 0.15542850687457 0.97834891448298 0.30121531988472 15.999 > 57 58 O 0.65542850687457 0.97834891448298 0.30121531988472 15.999 > 57 59 O 0.15542850687457 0.97834891448298 0.80121531988472 15.999 > 57 60 O 0.65542850687457 0.97834891448298 0.80121531988472 15.999 > 57 61 O 0.02212490466316 0.25000000000000 0.19250798950520 15.999 > 61 62 O 0.52212490466316 0.25000000000000 0.19250798950520 15.999 > 61 63 O 0.02212490466316 0.25000000000000 0.69250798950520 15.999 > 61 64 O 0.52212490466316 0.25000000000000 0.69250798950520 15.999 > 61 65 O 0.49283534603030 0.54461254824506 0.09012496983044 15.999 > 65 66 O 0.99283534603030 0.54461254824506 0.09012496983044 15.999 > 65 67 O 0.49283534603030 0.54461254824506 0.59012496983044 15.999 > 65 68 O 0.99283534603030 0.54461254824506 0.59012496983044 15.999 > 65 69 O 0.34433350217336 0.75000000000000 0.43378673416335 15.999 > 69 70 O 0.84433350217336 0.75000000000000 0.43378673416335 15.999 > 69 71 O 0.34433350217336 0.75000000000000 0.93378673416335 15.999 > 69 72 O 0.84433350217336 0.75000000000000 0.93378673416335 15.999 > 69 73 O 0.15566649782664 0.25000000000000 0.06621326583665 15.999 > 73 74 O 0.65566649782664 0.25000000000000 0.06621326583665 15.999 > 73 75 O 0.15566649782664 0.25000000000000 0.56621326583665 15.999 > 73 76 O 0.65566649782664 0.25000000000000 0.56621326583665 15.999 > 73 77 O 0.00716465396970 0.45538745175494 0.40987503016956 15.999 > 77 78 O 0.50716465396970 0.45538745175494 0.40987503016956 15.999 > 77 79 O 0.00716465396970 0.45538745175494 0.90987503016956 15.999 > 77 80 O 0.50716465396970 0.45538745175494 0.90987503016956 15.999 > 77 81 O 0.47787509533684 0.75000000000000 0.30749201049480 15.999 > 81 82 O 0.97787509533684 0.75000000000000 0.30749201049480 15.999 > 81 83 O 0.47787509533684 0.75000000000000 0.80749201049480 15.999 > 81 84 O 0.97787509533684 0.75000000000000 0.80749201049480 15.999 > 81 85 O 0.15542850687457 0.52165108551702 0.30121531988472 15.999 > 85 86 O 0.65542850687457 0.52165108551702 0.30121531988472 15.999 > 85 87 O 0.15542850687457 0.52165108551702 0.80121531988472 15.999 > 85 88 O 0.65542850687457 0.52165108551702 0.80121531988472 15.999 > 85 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.6320584 0.0000000 -0.5314139 0.0000000 4.8159829 0.0000000 -0.5314108 0.0000000 4.8044032 -------------------------- Born effective charges -------------------------- 1 Na 1.5318320 0.0803211 0.1899411 -0.0160157 1.0453235 -0.0009172 0.1761087 -0.0001562 1.1302102 2 Na 1.5196940 0.0000000 0.1561623 -0.0000000 1.0711323 0.0000000 0.1808494 0.0000000 1.1155478 3 Na 1.5318320 -0.0803211 0.1899411 0.0160157 1.0453235 0.0009172 0.1761087 0.0001562 1.1302102 4 Na 1.5196940 0.0000000 0.1561623 -0.0000000 1.0711323 0.0000000 0.1808494 0.0000000 1.1155478 5 U 4.7538430 0.0000000 -0.5501641 -0.0000000 6.9686999 0.0000000 -0.5186444 0.0000000 5.9266492 6 U 4.8519382 0.2940365 -0.8768618 0.5493755 5.4141661 -0.7160247 -0.8979821 -1.2176518 6.7487016 7 U 4.7538430 0.0000000 -0.5501641 -0.0000000 6.9686999 0.0000000 -0.5186444 0.0000000 5.9266492 8 U 4.8519382 -0.2940365 -0.8768618 -0.5493755 5.4141661 0.7160247 -0.8979821 1.2176518 6.7487016 9 O -2.5651454 0.0873142 -0.5947362 0.1623995 -0.8743834 0.0905593 -0.5978854 0.1219114 -1.1681771 10 O -0.8700881 0.2808536 1.2495368 0.3851872 -3.3372979 -1.0866798 1.2332669 -0.8297088 -3.7356311 11 O -2.5537300 0.0000000 -0.6864461 -0.0000000 -0.9488381 0.0000000 -0.4872724 0.0000000 -1.0350306 12 O -2.5537300 0.0000000 -0.6864461 -0.0000000 -0.9488381 0.0000000 -0.4872724 0.0000000 -1.0350306 13 O -0.8700881 0.2808536 1.2495368 0.3851872 -3.3372979 -1.0866798 1.2332669 -0.8297088 -3.7356311 14 O -2.5651454 -0.0873142 -0.5947362 -0.1623995 -0.8743834 -0.0905593 -0.5978854 -0.1219114 -1.1681771 15 O -2.5651454 0.0873142 -0.5947362 0.1623995 -0.8743834 0.0905593 -0.5978854 0.1219114 -1.1681771 16 O -0.7729467 0.0000000 0.9911916 -0.0000000 -4.2594284 0.0000000 0.9866743 0.0000000 -2.9565526 17 O -0.8700881 -0.2808536 1.2495368 -0.3851872 -3.3372979 1.0866798 1.2332669 0.8297088 -3.7356311 18 O -2.4601635 0.0000000 -0.5334243 -0.0000000 -0.8676929 0.0000000 -0.7104965 0.0000000 -1.1219092 19 O -2.4601635 0.0000000 -0.5334243 -0.0000000 -0.8676929 0.0000000 -0.7104965 0.0000000 -1.1219092 20 O -0.8700881 -0.2808536 1.2495368 -0.3851872 -3.3372979 1.0866798 1.2332669 0.8297088 -3.7356311 21 O -0.7729467 0.0000000 0.9911916 -0.0000000 -4.2594284 0.0000000 0.9866743 0.0000000 -2.9565526 22 O -2.5651454 -0.0873142 -0.5947362 -0.1623995 -0.8743834 -0.0905593 -0.5978854 -0.1219114 -1.1681771 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 5, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 21, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 37, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 41, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 61, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Computing fc3[ 69, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0035 0.0000 0.0094] [ 0.0035 0.0000 -0.0094] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000011 (yzy) -0.00000011 (yzy) -0.00000011 (yyz) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000002 (zx) -0.00000002 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 21:35:40]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 21:35:41]------------------------- 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 1 2] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/m (11) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.467300790110874 0.000000000000000 0.000000000000000 b 0.000000000000000 7.773844970000000 0.000000000000000 c -2.423557802551437 0.000000000000000 6.391730561522190 Atomic positions (fractional): 1 Na 0.50000000000000 0.00000000000000 0.00000000000000 22.990 2 Na 0.48943654638469 0.25000000000000 0.50834069307111 22.990 3 Na 0.50000000000000 0.50000000000000 0.00000000000000 22.990 4 Na 0.51056345361531 0.75000000000000 0.49165930692889 22.990 5 U 0.99534361989208 0.75000000000000 0.96283928775346 238.029 6 U 0.00000000000000 0.00000000000000 0.50000000000000 238.029 7 U 0.00465638010792 0.25000000000000 0.03716071224654 238.029 8 U 0.00000000000000 0.50000000000000 0.50000000000000 238.029 9 O 0.68914298625087 0.02165108551702 0.39756936023056 15.999 10 O 0.98567069206060 0.95538745175494 0.18024993966088 15.999 11 O 0.69495243564998 0.25000000000000 0.93143619769812 15.999 12 O 0.30504756435002 0.75000000000000 0.06856380230188 15.999 13 O 0.01432930793940 0.04461254824506 0.81975006033912 15.999 14 O 0.68914298625087 0.47834891448298 0.39756936023056 15.999 15 O 0.31085701374913 0.97834891448298 0.60243063976944 15.999 16 O 0.04424980932632 0.25000000000000 0.38501597901040 15.999 17 O 0.98567069206060 0.54461254824506 0.18024993966088 15.999 18 O 0.68866700434671 0.75000000000000 0.86757346832669 15.999 19 O 0.31133299565329 0.25000000000000 0.13242653167331 15.999 20 O 0.01432930793940 0.45538745175494 0.81975006033912 15.999 21 O 0.95575019067368 0.75000000000000 0.61498402098960 15.999 22 O 0.31085701374913 0.52165108551702 0.60243063976944 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.934601580221749 0.000000000000000 0.000000000000000 b 0.000000000000000 7.773844970000000 0.000000000000000 c -4.847115605102874 0.000000000000000 12.783461123044381 Atomic positions (fractional): 1 Na 0.25000000000000 0.00000000000000 0.00000000000000 22.990 > 1 2 Na 0.75000000000000 0.00000000000000 0.00000000000000 22.990 > 1 3 Na 0.25000000000000 0.00000000000000 0.50000000000000 22.990 > 1 4 Na 0.75000000000000 0.00000000000000 0.50000000000000 22.990 > 1 5 Na 0.24471827319234 0.25000000000000 0.25417034653556 22.990 > 5 6 Na 0.74471827319234 0.25000000000000 0.25417034653556 22.990 > 5 7 Na 0.24471827319234 0.25000000000000 0.75417034653556 22.990 > 5 8 Na 0.74471827319234 0.25000000000000 0.75417034653556 22.990 > 5 9 Na 0.25000000000000 0.50000000000000 0.00000000000000 22.990 > 9 10 Na 0.75000000000000 0.50000000000000 0.00000000000000 22.990 > 9 11 Na 0.25000000000000 0.50000000000000 0.50000000000000 22.990 > 9 12 Na 0.75000000000000 0.50000000000000 0.50000000000000 22.990 > 9 13 Na 0.25528172680765 0.75000000000000 0.24582965346444 22.990 > 13 14 Na 0.75528172680766 0.75000000000000 0.24582965346444 22.990 > 13 15 Na 0.25528172680765 0.75000000000000 0.74582965346444 22.990 > 13 16 Na 0.75528172680766 0.75000000000000 0.74582965346444 22.990 > 13 17 U 0.49767180994604 0.75000000000000 0.48141964387673 238.029 > 17 18 U 0.99767180994604 0.75000000000000 0.48141964387673 238.029 > 17 19 U 0.49767180994604 0.75000000000000 0.98141964387673 238.029 > 17 20 U 0.99767180994604 0.75000000000000 0.98141964387673 238.029 > 17 21 U 0.00000000000000 0.00000000000000 0.25000000000000 238.029 > 21 22 U 0.50000000000000 0.00000000000000 0.25000000000000 238.029 > 21 23 U 0.00000000000000 0.00000000000000 0.75000000000000 238.029 > 21 24 U 0.50000000000000 0.00000000000000 0.75000000000000 238.029 > 21 25 U 0.00232819005396 0.25000000000000 0.01858035612327 238.029 > 25 26 U 0.50232819005396 0.25000000000000 0.01858035612327 238.029 > 25 27 U 0.00232819005396 0.25000000000000 0.51858035612327 238.029 > 25 28 U 0.50232819005396 0.25000000000000 0.51858035612327 238.029 > 25 29 U 0.00000000000000 0.50000000000000 0.25000000000000 238.029 > 29 30 U 0.50000000000000 0.50000000000000 0.25000000000000 238.029 > 29 31 U 0.00000000000000 0.50000000000000 0.75000000000000 238.029 > 29 32 U 0.50000000000000 0.50000000000000 0.75000000000000 238.029 > 29 33 O 0.34457149312543 0.02165108551702 0.19878468011528 15.999 > 33 34 O 0.84457149312543 0.02165108551702 0.19878468011528 15.999 > 33 35 O 0.34457149312543 0.02165108551702 0.69878468011528 15.999 > 33 36 O 0.84457149312543 0.02165108551702 0.69878468011528 15.999 > 33 37 O 0.49283534603030 0.95538745175494 0.09012496983044 15.999 > 37 38 O 0.99283534603030 0.95538745175494 0.09012496983044 15.999 > 37 39 O 0.49283534603030 0.95538745175494 0.59012496983044 15.999 > 37 40 O 0.99283534603030 0.95538745175494 0.59012496983044 15.999 > 37 41 O 0.34747621782499 0.25000000000000 0.46571809884906 15.999 > 41 42 O 0.84747621782499 0.25000000000000 0.46571809884906 15.999 > 41 43 O 0.34747621782499 0.25000000000000 0.96571809884906 15.999 > 41 44 O 0.84747621782499 0.25000000000000 0.96571809884906 15.999 > 41 45 O 0.15252378217501 0.75000000000000 0.03428190115094 15.999 > 45 46 O 0.65252378217501 0.75000000000000 0.03428190115094 15.999 > 45 47 O 0.15252378217501 0.75000000000000 0.53428190115094 15.999 > 45 48 O 0.65252378217501 0.75000000000000 0.53428190115094 15.999 > 45 49 O 0.00716465396970 0.04461254824506 0.40987503016956 15.999 > 49 50 O 0.50716465396970 0.04461254824506 0.40987503016956 15.999 > 49 51 O 0.00716465396970 0.04461254824506 0.90987503016956 15.999 > 49 52 O 0.50716465396970 0.04461254824506 0.90987503016956 15.999 > 49 53 O 0.34457149312543 0.47834891448298 0.19878468011528 15.999 > 53 54 O 0.84457149312543 0.47834891448298 0.19878468011528 15.999 > 53 55 O 0.34457149312543 0.47834891448298 0.69878468011528 15.999 > 53 56 O 0.84457149312543 0.47834891448298 0.69878468011528 15.999 > 53 57 O 0.15542850687457 0.97834891448298 0.30121531988472 15.999 > 57 58 O 0.65542850687457 0.97834891448298 0.30121531988472 15.999 > 57 59 O 0.15542850687457 0.97834891448298 0.80121531988472 15.999 > 57 60 O 0.65542850687457 0.97834891448298 0.80121531988472 15.999 > 57 61 O 0.02212490466316 0.25000000000000 0.19250798950520 15.999 > 61 62 O 0.52212490466316 0.25000000000000 0.19250798950520 15.999 > 61 63 O 0.02212490466316 0.25000000000000 0.69250798950520 15.999 > 61 64 O 0.52212490466316 0.25000000000000 0.69250798950520 15.999 > 61 65 O 0.49283534603030 0.54461254824506 0.09012496983044 15.999 > 65 66 O 0.99283534603030 0.54461254824506 0.09012496983044 15.999 > 65 67 O 0.49283534603030 0.54461254824506 0.59012496983044 15.999 > 65 68 O 0.99283534603030 0.54461254824506 0.59012496983044 15.999 > 65 69 O 0.34433350217336 0.75000000000000 0.43378673416335 15.999 > 69 70 O 0.84433350217336 0.75000000000000 0.43378673416335 15.999 > 69 71 O 0.34433350217336 0.75000000000000 0.93378673416335 15.999 > 69 72 O 0.84433350217336 0.75000000000000 0.93378673416335 15.999 > 69 73 O 0.15566649782664 0.25000000000000 0.06621326583665 15.999 > 73 74 O 0.65566649782664 0.25000000000000 0.06621326583665 15.999 > 73 75 O 0.15566649782664 0.25000000000000 0.56621326583665 15.999 > 73 76 O 0.65566649782664 0.25000000000000 0.56621326583665 15.999 > 73 77 O 0.00716465396970 0.45538745175494 0.40987503016956 15.999 > 77 78 O 0.50716465396970 0.45538745175494 0.40987503016956 15.999 > 77 79 O 0.00716465396970 0.45538745175494 0.90987503016956 15.999 > 77 80 O 0.50716465396970 0.45538745175494 0.90987503016956 15.999 > 77 81 O 0.47787509533684 0.75000000000000 0.30749201049480 15.999 > 81 82 O 0.97787509533684 0.75000000000000 0.30749201049480 15.999 > 81 83 O 0.47787509533684 0.75000000000000 0.80749201049480 15.999 > 81 84 O 0.97787509533684 0.75000000000000 0.80749201049480 15.999 > 81 85 O 0.15542850687457 0.52165108551702 0.30121531988472 15.999 > 85 86 O 0.65542850687457 0.52165108551702 0.30121531988472 15.999 > 85 87 O 0.15542850687457 0.52165108551702 0.80121531988472 15.999 > 85 88 O 0.65542850687457 0.52165108551702 0.80121531988472 15.999 > 85 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.6320584 0.0000000 -0.5314139 0.0000000 4.8159829 0.0000000 -0.5314108 0.0000000 4.8044032 -------------------------- Born effective charges -------------------------- 1 Na 1.5318320 0.0803211 0.1899411 -0.0160157 1.0453235 -0.0009172 0.1761087 -0.0001562 1.1302102 2 Na 1.5196940 0.0000000 0.1561623 -0.0000000 1.0711323 0.0000000 0.1808494 0.0000000 1.1155478 3 Na 1.5318320 -0.0803211 0.1899411 0.0160157 1.0453235 0.0009172 0.1761087 0.0001562 1.1302102 4 Na 1.5196940 0.0000000 0.1561623 -0.0000000 1.0711323 0.0000000 0.1808494 0.0000000 1.1155478 5 U 4.7538430 0.0000000 -0.5501641 -0.0000000 6.9686999 0.0000000 -0.5186444 0.0000000 5.9266492 6 U 4.8519382 0.2940365 -0.8768618 0.5493755 5.4141661 -0.7160247 -0.8979821 -1.2176518 6.7487016 7 U 4.7538430 0.0000000 -0.5501641 -0.0000000 6.9686999 0.0000000 -0.5186444 0.0000000 5.9266492 8 U 4.8519382 -0.2940365 -0.8768618 -0.5493755 5.4141661 0.7160247 -0.8979821 1.2176518 6.7487016 9 O -2.5651454 0.0873142 -0.5947362 0.1623995 -0.8743834 0.0905593 -0.5978854 0.1219114 -1.1681771 10 O -0.8700881 0.2808536 1.2495368 0.3851872 -3.3372979 -1.0866798 1.2332669 -0.8297088 -3.7356311 11 O -2.5537300 0.0000000 -0.6864461 -0.0000000 -0.9488381 0.0000000 -0.4872724 0.0000000 -1.0350306 12 O -2.5537300 0.0000000 -0.6864461 -0.0000000 -0.9488381 0.0000000 -0.4872724 0.0000000 -1.0350306 13 O -0.8700881 0.2808536 1.2495368 0.3851872 -3.3372979 -1.0866798 1.2332669 -0.8297088 -3.7356311 14 O -2.5651454 -0.0873142 -0.5947362 -0.1623995 -0.8743834 -0.0905593 -0.5978854 -0.1219114 -1.1681771 15 O -2.5651454 0.0873142 -0.5947362 0.1623995 -0.8743834 0.0905593 -0.5978854 0.1219114 -1.1681771 16 O -0.7729467 0.0000000 0.9911916 -0.0000000 -4.2594284 0.0000000 0.9866743 0.0000000 -2.9565526 17 O -0.8700881 -0.2808536 1.2495368 -0.3851872 -3.3372979 1.0866798 1.2332669 0.8297088 -3.7356311 18 O -2.4601635 0.0000000 -0.5334243 -0.0000000 -0.8676929 0.0000000 -0.7104965 0.0000000 -1.1219092 19 O -2.4601635 0.0000000 -0.5334243 -0.0000000 -0.8676929 0.0000000 -0.7104965 0.0000000 -1.1219092 20 O -0.8700881 -0.2808536 1.2495368 -0.3851872 -3.3372979 1.0866798 1.2332669 0.8297088 -3.7356311 21 O -0.7729467 0.0000000 0.9911916 -0.0000000 -4.2594284 0.0000000 0.9866743 0.0000000 -2.9565526 22 O -2.5651454 -0.0873142 -0.5947362 -0.1623995 -0.8743834 -0.0905593 -0.5978854 -0.1219114 -1.1681771 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000011 (yzy) -0.00000011 (yzy) -0.00000011 (yyz) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- 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 ... [ 8 6 8 ] 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: 0.61, Number of G-points: 299, Lambda: 0.13 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/136) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 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 1.501 ( 0.000 0.000 0.000) 0.000 2.312 ( 0.000 0.000 0.000) 0.000 2.346 ( 0.000 0.000 0.000) 0.000 2.597 ( 0.000 0.000 0.000) 0.000 2.598 ( 0.000 0.000 0.000) 0.000 2.744 ( 0.000 0.000 0.000) 0.000 2.828 ( 0.000 0.000 0.000) 0.000 3.095 ( 0.000 0.000 0.000) 0.000 3.095 ( 0.000 0.000 0.000) 0.000 3.175 ( 0.000 0.000 0.000) 0.000 3.255 ( 0.000 0.000 0.000) 0.000 3.392 ( 0.000 0.000 0.000) 0.000 3.456 ( 0.000 0.000 0.000) 0.000 3.547 ( 0.000 0.000 0.000) 0.000 3.712 ( 0.000 0.000 0.000) 0.000 3.972 ( 0.000 0.000 0.000) 0.000 4.226 ( 0.000 0.000 0.000) 0.000 4.282 ( 0.000 0.000 0.000) 0.000 4.373 ( 0.000 0.000 0.000) 0.000 4.470 ( 0.000 0.000 0.000) 0.000 4.663 ( 0.000 0.000 0.000) 0.000 4.743 ( 0.000 0.000 0.000) 0.000 5.141 ( 0.000 0.000 0.000) 0.000 5.181 ( 0.000 0.000 0.000) 0.000 5.358 ( 0.000 0.000 0.000) 0.000 5.887 ( 0.000 0.000 0.000) 0.000 6.021 ( 0.000 0.000 0.000) 0.000 6.261 ( 0.000 0.000 0.000) 0.000 6.576 ( 0.000 0.000 0.000) 0.000 6.666 ( 0.000 0.000 0.000) 0.000 6.879 ( 0.000 0.000 0.000) 0.000 7.024 ( 0.000 0.000 0.000) 0.000 7.488 ( 0.000 0.000 0.000) 0.000 7.712 ( 0.000 0.000 0.000) 0.000 7.753 ( 0.000 0.000 0.000) 0.000 7.894 ( 0.000 0.000 0.000) 0.000 8.053 ( 0.000 0.000 0.000) 0.000 8.358 ( 0.000 0.000 0.000) 0.000 8.754 ( 0.000 0.000 0.000) 0.000 8.796 ( 0.000 0.000 0.000) 0.000 9.003 ( 0.000 0.000 0.000) 0.000 9.255 ( 0.000 0.000 0.000) 0.000 9.334 ( 0.000 0.000 0.000) 0.000 9.437 ( 0.000 0.000 0.000) 0.000 9.459 ( 0.000 0.000 0.000) 0.000 9.551 ( 0.000 0.000 0.000) 0.000 10.252 ( 0.000 0.000 0.000) 0.000 11.536 ( 0.000 0.000 0.000) 0.000 12.457 ( 0.000 0.000 0.000) 0.000 13.141 ( 0.000 0.000 0.000) 0.000 13.953 ( 0.000 0.000 0.000) 0.000 16.865 ( 0.000 0.000 0.000) 0.000 17.028 ( 0.000 0.000 0.000) 0.000 17.179 ( 0.000 0.000 0.000) 0.000 18.606 ( 0.000 0.000 0.000) 0.000 22.460 ( 0.000 0.000 0.000) 0.000 22.469 ( 0.000 0.000 0.000) 0.000 22.506 ( 0.000 0.000 0.000) 0.000 22.627 ( 0.000 0.000 0.000) 0.000 23.155 ( 0.000 0.000 0.000) 0.000 23.417 ( 0.000 0.000 0.000) 0.000 24.026 ( 0.000 0.000 0.000) 0.000 24.312 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/136) ======================= q-point: ( 0.12 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.361 ( 16.269 0.000 4.665) 16.925 0.407 ( 17.687 0.000 7.099) 19.059 0.609 ( 31.159 0.000 -2.620) 31.269 1.513 ( 2.309 0.000 -3.252) 3.989 2.221 ( -12.300 0.000 0.706) 12.321 2.271 ( -2.555 0.000 -3.970) 4.721 2.465 ( -10.726 0.000 6.191) 12.384 2.578 ( -2.114 0.000 -0.302) 2.135 2.735 ( -0.206 0.000 -0.399) 0.449 2.984 ( 10.012 0.000 1.365) 10.104 3.080 ( -2.822 0.000 -0.721) 2.912 3.107 ( -0.308 0.000 -3.777) 3.790 3.204 ( -1.527 0.000 -13.495) 13.581 3.216 ( 6.062 0.000 -10.961) 12.525 3.340 ( -1.567 0.000 5.544) 5.761 3.583 ( -0.138 0.000 0.138) 0.195 3.729 ( -0.295 0.000 5.783) 5.791 3.764 ( 9.113 0.000 8.139) 12.218 4.149 ( 0.002 0.000 -0.889) 0.889 4.245 ( 3.090 0.000 -2.092) 3.732 4.259 ( -1.912 0.000 -1.557) 2.465 4.446 ( -3.181 0.000 2.085) 3.803 4.461 ( 3.900 0.000 3.912) 5.524 4.642 ( -2.108 0.000 0.613) 2.195 5.117 ( -2.978 0.000 1.567) 3.365 5.177 ( -0.147 0.000 0.310) 0.343 5.318 ( -0.634 0.000 -1.602) 1.723 5.765 ( -10.598 0.000 20.071) 22.697 6.005 ( -1.658 0.000 0.633) 1.775 6.155 ( 1.330 0.000 -4.333) 4.532 6.234 ( -2.502 0.000 -0.277) 2.517 6.609 ( -1.202 0.000 -8.997) 9.077 6.618 ( 3.898 0.000 0.633) 3.950 6.946 ( -2.214 0.000 14.263) 14.433 7.035 ( 0.620 0.000 0.998) 1.175 7.512 ( 4.695 0.000 -7.195) 8.591 7.740 ( -1.201 0.000 0.374) 1.257 7.747 ( 4.092 0.000 -2.468) 4.779 7.923 ( 2.103 0.000 -0.238) 2.116 8.032 ( -0.702 0.000 -2.174) 2.284 8.334 ( -2.887 0.000 1.734) 3.368 8.752 ( -0.706 0.000 1.348) 1.522 8.801 ( 4.553 0.000 -11.865) 12.709 9.020 ( 3.292 0.000 -10.331) 10.843 9.238 ( -2.714 0.000 3.156) 4.162 9.329 ( -2.984 0.000 5.124) 5.930 9.403 ( -5.776 0.000 3.873) 6.954 9.450 ( 0.131 0.000 2.041) 2.045 9.592 ( 4.812 0.000 -5.146) 7.045 10.238 ( -1.669 0.000 0.549) 1.757 11.534 ( 0.521 0.000 -1.581) 1.665 12.476 ( 0.930 0.000 2.323) 2.502 13.140 ( -0.198 0.000 0.430) 0.474 13.956 ( 0.321 0.000 -0.072) 0.329 16.893 ( -3.109 0.000 -1.056) 3.283 17.008 ( -0.861 0.000 13.660) 13.687 17.177 ( -0.111 0.000 -0.056) 0.124 18.439 ( -15.389 0.000 -1.133) 15.431 22.444 ( -5.822 0.000 2.240) 6.238 22.474 ( 1.389 0.000 -2.929) 3.241 22.616 ( 13.472 0.000 1.035) 13.512 23.233 ( 5.638 0.000 1.676) 5.882 23.421 ( 0.334 0.000 0.098) 0.348 23.787 ( -9.342 0.000 -6.687) 11.489 24.186 ( 10.905 0.000 -1.396) 10.994 26.395 ( 1.517 0.000 -3.360) 3.686 ======================= Grid point 2 (3/136) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.683 ( 13.253 0.000 4.271) 13.925 0.772 ( 14.544 0.000 6.005) 15.735 1.140 ( 24.732 0.000 -1.555) 24.781 1.534 ( 2.697 0.000 -4.968) 5.653 1.957 ( -14.608 0.000 2.239) 14.778 2.170 ( -3.280 0.000 -6.238) 7.048 2.345 ( -7.117 0.000 10.288) 12.510 2.512 ( -4.204 0.000 -0.478) 4.231 2.742 ( 1.221 0.000 -0.435) 1.296 2.957 ( -4.619 0.000 -7.415) 8.736 3.042 ( -2.170 0.000 -3.658) 4.254 3.111 ( -2.894 0.000 -0.750) 2.990 3.125 ( -0.169 0.000 -14.086) 14.087 3.252 ( 8.698 0.000 1.606) 8.845 3.419 ( 5.070 0.000 1.350) 5.246 3.594 ( 1.816 0.000 -2.458) 3.056 3.787 ( 0.036 0.000 10.002) 10.002 3.952 ( 5.003 0.000 5.339) 7.317 4.105 ( -0.296 0.000 -7.715) 7.721 4.270 ( 1.708 0.000 1.666) 2.386 4.319 ( 7.614 0.000 -11.316) 13.639 4.392 ( -5.564 0.000 12.100) 13.319 4.538 ( -1.378 0.000 7.357) 7.485 4.629 ( 2.891 0.000 -2.259) 3.669 5.056 ( -4.721 0.000 2.904) 5.542 5.153 ( -2.545 0.000 -1.132) 2.786 5.285 ( -2.328 0.000 1.225) 2.631 5.703 ( -5.567 0.000 7.233) 9.127 5.976 ( -1.660 0.000 0.721) 1.810 6.140 ( -4.024 0.000 7.210) 8.257 6.173 ( -3.166 0.000 -0.671) 3.237 6.526 ( 1.940 0.000 -14.034) 14.167 6.723 ( 5.714 0.000 1.922) 6.029 7.002 ( -0.852 0.000 8.648) 8.690 7.055 ( 0.408 0.000 0.833) 0.928 7.573 ( 4.292 0.000 -0.434) 4.314 7.712 ( -2.276 0.000 0.625) 2.360 7.811 ( 4.377 0.000 -3.698) 5.730 7.906 ( -3.510 0.000 -0.897) 3.623 8.053 ( 5.106 0.000 -3.521) 6.203 8.287 ( -3.770 0.000 3.583) 5.202 8.744 ( -1.576 0.000 2.301) 2.789 8.782 ( 3.206 0.000 -13.787) 14.155 9.019 ( 1.584 0.000 -2.736) 3.161 9.210 ( -1.956 0.000 2.420) 3.111 9.299 ( -3.742 0.000 4.894) 6.161 9.320 ( -4.964 0.000 2.676) 5.639 9.476 ( 1.910 0.000 -0.291) 1.932 9.643 ( 3.950 0.000 -4.422) 5.929 10.195 ( -3.180 0.000 0.684) 3.253 11.535 ( 0.889 0.000 -1.743) 1.957 12.515 ( 0.783 0.000 2.977) 3.078 13.140 ( -0.259 0.000 0.602) 0.655 13.963 ( 0.435 0.000 -0.093) 0.445 16.718 ( -10.444 0.000 -1.658) 10.574 17.175 ( -0.053 0.000 -0.074) 0.091 17.213 ( 6.448 0.000 18.350) 19.450 18.076 ( -19.088 0.000 -1.298) 19.132 22.344 ( -4.234 0.000 -0.410) 4.254 22.500 ( 1.722 0.000 0.944) 1.964 22.932 ( 16.522 0.000 1.171) 16.564 23.335 ( 3.746 0.000 -1.471) 4.024 23.428 ( 0.222 0.000 0.161) 0.274 23.533 ( -9.385 0.000 -10.824) 14.326 24.403 ( 12.103 0.000 -1.618) 12.210 26.401 ( 0.921 0.000 -1.483) 1.745 ======================= Grid point 3 (4/136) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.919 ( 7.941 0.000 2.888) 8.450 1.033 ( 8.294 0.000 3.465) 8.988 1.519 ( 14.360 0.000 0.240) 14.362 1.539 ( 1.219 0.000 -3.748) 3.941 1.725 ( -9.140 0.000 -0.716) 9.168 2.082 ( -1.139 0.000 -4.889) 5.020 2.365 ( -1.936 0.000 18.898) 18.997 2.425 ( -3.782 0.000 -0.444) 3.808 2.768 ( 1.431 0.000 -0.301) 1.463 2.842 ( -2.788 0.000 -3.618) 4.567 2.876 ( -5.800 0.000 -21.734) 22.495 3.004 ( -2.343 0.000 -1.993) 3.077 3.062 ( -1.825 0.000 -0.214) 1.837 3.455 ( 7.975 0.000 2.996) 8.519 3.514 ( 3.425 0.000 0.670) 3.490 3.603 ( 0.633 0.000 -1.303) 1.449 3.854 ( -0.610 0.000 7.908) 7.931 4.057 ( 3.233 0.000 3.894) 5.061 4.058 ( 1.283 0.000 -6.701) 6.823 4.260 ( -2.894 0.000 -6.783) 7.374 4.296 ( -0.259 0.000 0.332) 0.421 4.495 ( 4.580 0.000 5.360) 7.050 4.557 ( -0.530 0.000 6.250) 6.272 4.693 ( 3.837 0.000 -1.840) 4.256 4.990 ( -3.975 0.000 3.082) 5.030 5.063 ( -4.837 0.000 -1.492) 5.062 5.256 ( -1.526 0.000 1.239) 1.966 5.667 ( -1.800 0.000 2.417) 3.014 5.956 ( -0.830 0.000 0.470) 0.954 6.109 ( -4.319 0.000 7.194) 8.391 6.114 ( -2.098 0.000 -0.705) 2.213 6.484 ( 2.878 0.000 -10.530) 10.917 6.854 ( 5.713 0.000 2.730) 6.332 7.036 ( -0.822 0.000 4.959) 5.027 7.050 ( -1.317 0.000 -0.479) 1.402 7.657 ( 3.567 0.000 1.271) 3.786 7.665 ( -2.393 0.000 -0.055) 2.393 7.824 ( -3.388 0.000 -0.995) 3.531 7.850 ( 2.269 0.000 -3.615) 4.268 8.133 ( 4.664 0.000 -2.500) 5.292 8.248 ( -2.487 0.000 2.620) 3.613 8.726 ( -1.765 0.000 2.005) 2.671 8.736 ( 0.596 0.000 -7.384) 7.408 9.035 ( 1.564 0.000 -1.902) 2.462 9.202 ( 0.131 0.000 -0.133) 0.187 9.259 ( -2.620 0.000 1.204) 2.884 9.264 ( -3.138 0.000 4.108) 5.169 9.516 ( 2.005 0.000 0.073) 2.007 9.677 ( 2.200 0.000 -2.404) 3.258 10.134 ( -3.140 0.000 0.373) 3.162 11.542 ( 0.824 0.000 -1.126) 1.395 12.543 ( 0.193 0.000 1.914) 1.924 13.139 ( -0.167 0.000 0.422) 0.454 13.970 ( 0.295 0.000 -0.059) 0.301 16.527 ( -7.292 0.000 -0.955) 7.354 17.175 ( 0.169 0.000 -0.042) 0.174 17.456 ( 5.142 0.000 13.407) 14.359 17.751 ( -12.383 0.000 -0.770) 12.407 22.283 ( -1.886 0.000 -0.211) 1.897 22.551 ( 1.931 0.000 2.599) 3.238 23.218 ( 11.493 0.000 0.674) 11.513 23.236 ( -5.930 0.000 -13.323) 14.583 23.418 ( 0.245 0.000 1.025) 1.054 23.425 ( -0.974 0.000 0.136) 0.984 24.597 ( 7.938 0.000 -0.725) 7.971 26.407 ( 0.491 0.000 -0.635) 0.802 ======================= Grid point 4 (5/136) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.011 ( 0.000 0.000 -0.000) 0.000 1.127 ( 0.000 0.000 0.000) 0.000 1.536 ( 0.000 0.000 0.000) 0.000 1.627 ( 0.000 0.000 0.000) 0.000 1.667 ( 0.000 0.000 -0.000) 0.000 2.055 ( 0.000 0.000 0.000) 0.000 2.383 ( 0.000 0.000 0.000) 0.000 2.486 ( 0.000 0.000 0.000) 0.000 2.660 ( 0.000 0.000 -0.000) 0.000 2.783 ( 0.000 0.000 0.000) 0.000 2.801 ( 0.000 0.000 -0.000) 0.000 2.974 ( 0.000 0.000 0.000) 0.000 3.042 ( 0.000 0.000 0.000) 0.000 3.551 ( 0.000 0.000 0.000) 0.000 3.552 ( 0.000 0.000 0.000) 0.000 3.605 ( 0.000 0.000 0.000) 0.000 3.872 ( 0.000 0.000 -0.000) 0.000 4.052 ( 0.000 0.000 0.000) 0.000 4.152 ( -0.000 0.000 -0.000) 0.000 4.155 ( 0.000 0.000 0.000) 0.000 4.287 ( 0.000 0.000 0.000) 0.000 4.567 ( 0.000 0.000 -0.000) 0.000 4.586 ( 0.000 0.000 -0.000) 0.000 4.725 ( 0.000 0.000 0.000) 0.000 4.961 ( 0.000 0.000 0.000) 0.000 4.999 ( -0.000 0.000 0.000) 0.000 5.246 ( 0.000 0.000 -0.000) 0.000 5.660 ( 0.000 0.000 0.000) 0.000 5.950 ( 0.000 0.000 0.000) 0.000 6.090 ( 0.000 0.000 0.000) 0.000 6.092 ( 0.000 0.000 0.000) 0.000 6.475 ( 0.000 0.000 0.000) 0.000 6.950 ( 0.000 0.000 -0.000) 0.000 7.009 ( 0.000 0.000 0.000) 0.000 7.046 ( 0.000 0.000 0.000) 0.000 7.638 ( 0.000 0.000 0.000) 0.000 7.703 ( 0.000 0.000 -0.000) 0.000 7.784 ( 0.000 0.000 0.000) 0.000 7.854 ( 0.000 0.000 0.000) 0.000 8.173 ( 0.000 0.000 0.000) 0.000 8.233 ( 0.000 0.000 0.000) 0.000 8.713 ( 0.000 0.000 0.000) 0.000 8.715 ( 0.000 0.000 0.000) 0.000 9.044 ( 0.000 0.000 0.000) 0.000 9.205 ( 0.000 0.000 0.000) 0.000 9.238 ( 0.000 0.000 0.000) 0.000 9.247 ( 0.000 0.000 -0.000) 0.000 9.539 ( 0.000 0.000 0.000) 0.000 9.690 ( 0.000 0.000 -0.000) 0.000 10.100 ( 0.000 0.000 0.000) 0.000 11.547 ( 0.000 0.000 0.000) 0.000 12.551 ( 0.000 0.000 -0.000) 0.000 13.139 ( 0.000 0.000 0.000) 0.000 13.972 ( 0.000 0.000 0.000) 0.000 16.450 ( 0.000 0.000 0.000) 0.000 17.178 ( 0.000 0.000 0.000) 0.000 17.561 ( 0.000 0.000 0.000) 0.000 17.624 ( 0.000 0.000 0.000) 0.000 22.264 ( 0.000 0.000 -0.000) 0.000 22.588 ( 0.000 0.000 -0.000) 0.000 23.111 ( 0.000 0.000 -0.000) 0.000 23.370 ( 0.000 0.000 0.000) 0.000 23.380 ( -0.000 0.000 -0.000) 0.000 23.427 ( 0.000 0.000 0.000) 0.000 24.674 ( 0.000 0.000 -0.000) 0.000 26.410 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 9 (6/136) ======================= q-point: ( 0.00 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.388 ( 0.000 18.195 0.000) 18.195 0.618 ( 0.000 28.099 0.000) 28.099 0.900 ( 0.000 40.175 0.000) 40.175 1.938 ( 0.000 -10.562 0.000) 10.562 2.052 ( 0.000 -8.556 0.000) 8.556 2.582 ( 0.000 7.101 0.000) 7.101 2.627 ( 0.000 2.588 0.000) 2.588 2.747 ( 0.000 7.420 0.000) 7.420 2.846 ( 0.000 1.333 0.000) 1.333 2.921 ( 0.000 -1.689 0.000) 1.689 2.960 ( 0.000 -10.835 0.000) 10.835 3.089 ( 0.000 -1.615 0.000) 1.615 3.161 ( 0.000 1.383 0.000) 1.383 3.370 ( 0.000 -2.190 0.000) 2.190 3.418 ( 0.000 3.588 0.000) 3.588 3.519 ( 0.000 -2.309 0.000) 2.309 3.758 ( 0.000 7.931 0.000) 7.931 3.888 ( 0.000 -8.208 0.000) 8.208 3.910 ( 0.000 14.433 0.000) 14.433 4.200 ( 0.000 -7.482 0.000) 7.482 4.231 ( 0.000 0.818 0.000) 0.818 4.416 ( 0.000 4.086 0.000) 4.086 4.445 ( 0.000 -2.091 0.000) 2.091 4.692 ( 0.000 -4.506 0.000) 4.506 4.714 ( 0.000 5.078 0.000) 5.078 5.104 ( 0.000 -8.275 0.000) 8.275 5.224 ( 0.000 4.843 0.000) 4.843 5.268 ( 0.000 -7.836 0.000) 7.836 5.701 ( 0.000 -12.676 0.000) 12.676 6.124 ( 0.000 -12.322 0.000) 12.322 6.527 ( 0.000 -5.210 0.000) 5.210 6.605 ( 0.000 0.148 0.000) 0.148 6.802 ( 0.000 7.844 0.000) 7.844 6.978 ( 0.000 7.913 0.000) 7.913 7.461 ( 0.000 -0.884 0.000) 0.884 7.646 ( 0.000 -1.777 0.000) 1.777 7.687 ( 0.000 -2.002 0.000) 2.002 7.810 ( 0.000 3.714 0.000) 3.714 8.086 ( 0.000 3.113 0.000) 3.113 8.262 ( 0.000 -7.456 0.000) 7.456 8.616 ( 0.000 -6.731 0.000) 6.731 8.706 ( 0.000 -2.108 0.000) 2.108 8.787 ( 0.000 0.232 0.000) 0.232 9.162 ( 0.000 5.748 0.000) 5.748 9.331 ( 0.000 -0.514 0.000) 0.514 9.354 ( 0.000 8.708 0.000) 8.708 9.437 ( 0.000 4.474 0.000) 4.474 9.558 ( 0.000 0.113 0.000) 0.113 9.620 ( 0.000 11.323 0.000) 11.323 10.208 ( 0.000 -4.011 0.000) 4.011 11.544 ( 0.000 1.368 0.000) 1.368 12.375 ( 0.000 -7.411 0.000) 7.411 14.109 ( 0.000 14.088 0.000) 14.088 15.696 ( 0.000 -5.534 0.000) 5.534 16.821 ( 0.000 -3.444 0.000) 3.444 16.990 ( 0.000 -3.346 0.000) 3.346 18.639 ( 0.000 2.967 0.000) 2.967 19.200 ( 0.000 -6.492 0.000) 6.492 22.495 ( 0.000 0.856 0.000) 0.856 22.532 ( 0.000 5.356 0.000) 5.356 22.533 ( 0.000 2.395 0.000) 2.395 22.618 ( 0.000 -0.787 0.000) 0.787 23.150 ( 0.000 -0.413 0.000) 0.413 23.391 ( 0.000 -2.376 0.000) 2.376 24.035 ( 0.000 0.954 0.000) 0.954 24.287 ( 0.000 -2.202 0.000) 2.202 ======================= Grid point 10 (7/136) ======================= q-point: ( 0.12 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.589 ( 17.788 10.060 -3.503) 20.733 0.711 ( 8.690 23.702 0.405) 25.248 1.026 ( 10.559 31.970 2.099) 33.734 1.838 ( -6.517 -1.768 -5.903) 8.969 1.971 ( -3.860 -6.971 -5.823) 9.869 2.439 ( -15.291 6.724 11.606) 20.340 2.573 ( -2.466 6.009 -1.400) 6.644 2.687 ( -5.966 5.817 -0.851) 8.376 2.876 ( -1.539 4.563 -2.189) 5.290 2.937 ( 4.062 -5.235 -0.444) 6.641 3.018 ( 4.933 -2.960 1.804) 6.029 3.091 ( -0.086 -3.115 0.474) 3.152 3.183 ( 4.116 -0.292 -8.914) 9.823 3.218 ( -5.700 2.110 -10.643) 12.257 3.433 ( 4.208 -0.904 1.082) 4.438 3.647 ( -0.163 2.391 4.564) 5.155 3.766 ( -6.123 7.267 7.601) 12.168 3.830 ( 6.655 7.823 2.537) 10.579 4.014 ( 5.406 -7.137 -5.123) 10.315 4.183 ( -0.769 -6.697 -0.575) 6.765 4.255 ( 4.127 0.782 -4.000) 5.800 4.443 ( 1.350 -1.995 -2.563) 3.517 4.456 ( -1.215 3.124 8.923) 9.532 4.690 ( -1.680 4.773 -0.444) 5.080 4.833 ( 8.363 -15.410 5.994) 18.530 5.093 ( -1.134 -9.245 -0.691) 9.340 5.177 ( -4.174 -0.314 2.572) 4.913 5.317 ( 2.772 -3.519 2.527) 5.143 5.692 ( -0.912 -11.650 0.085) 11.686 6.077 ( -1.651 -11.396 -5.030) 12.565 6.515 ( -1.693 -0.519 3.592) 4.005 6.631 ( 0.151 -0.064 -1.946) 1.953 6.790 ( -1.451 4.888 3.882) 6.409 6.987 ( 0.415 5.718 2.366) 6.202 7.488 ( 2.818 -0.534 -0.423) 2.899 7.594 ( -4.352 3.910 -5.092) 7.756 7.704 ( 2.163 -2.045 -1.031) 3.151 7.814 ( 0.179 2.721 -0.171) 2.732 8.067 ( -2.067 3.888 -0.598) 4.444 8.249 ( -1.690 -6.824 1.252) 7.141 8.398 ( -18.746 20.121 -7.248) 28.439 8.611 ( -1.055 -5.016 -1.791) 5.430 8.812 ( 3.893 -3.104 -1.119) 5.103 9.124 ( -2.857 4.996 -3.022) 6.500 9.322 ( -1.765 0.306 2.241) 2.869 9.336 ( -1.230 8.693 -0.635) 8.802 9.450 ( 0.620 3.028 1.451) 3.415 9.557 ( -1.339 6.403 1.440) 6.698 9.619 ( 2.094 5.758 -4.569) 7.643 10.193 ( -1.753 -4.035 0.653) 4.447 11.542 ( 0.447 1.317 -1.540) 2.075 12.367 ( -1.632 -7.694 2.681) 8.310 14.114 ( 0.416 14.247 0.122) 14.254 14.886 ( -57.554 63.047 -23.069) 88.428 16.690 ( -8.165 -10.890 6.585) 15.120 16.900 ( -6.992 -4.093 -5.546) 9.818 17.809 ( -32.999 35.967 -5.137) 49.080 18.456 ( -16.524 1.429 -1.278) 16.635 22.438 ( -3.783 -0.017 0.227) 3.790 22.529 ( 1.398 4.499 -1.486) 4.940 22.679 ( 12.285 5.115 1.590) 13.402 23.201 ( 4.836 -3.282 2.223) 6.253 23.391 ( 0.773 -2.877 -0.147) 2.983 23.589 ( 6.482 -17.107 -0.709) 18.308 24.189 ( 11.584 0.452 -0.698) 11.614 25.053 ( 58.192 -54.514 17.671) 81.672 ======================= Grid point 11 (8/136) ======================= q-point: ( 0.25 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.878 ( 12.678 13.585 -3.849) 18.976 0.949 ( 13.014 11.008 5.510) 17.914 1.248 ( 9.963 10.823 -1.562) 14.793 1.686 ( -3.409 3.009 -5.519) 7.150 1.860 ( -1.867 0.666 -7.404) 7.664 2.279 ( -11.119 7.957 16.943) 21.772 2.488 ( -4.099 8.285 -3.670) 9.945 2.562 ( -6.075 3.099 0.702) 6.856 2.848 ( 0.065 5.763 -2.225) 6.178 2.945 ( -1.078 -3.422 -4.656) 5.878 3.037 ( -1.502 -2.135 -0.992) 2.792 3.049 ( -3.552 1.396 -4.635) 6.004 3.149 ( 1.573 2.338 -9.565) 9.972 3.245 ( 7.101 -5.572 2.564) 9.384 3.509 ( 3.932 0.640 -2.323) 4.611 3.594 ( -2.812 8.470 -1.120) 8.995 3.785 ( -1.429 -0.555 11.241) 11.345 3.971 ( 3.477 1.785 3.978) 5.577 4.042 ( 3.080 -3.625 -7.079) 8.528 4.194 ( 2.913 -6.415 -2.661) 7.531 4.325 ( 5.609 0.286 -8.128) 9.880 4.425 ( -2.357 0.890 9.119) 9.460 4.518 ( -0.425 0.506 7.678) 7.706 4.667 ( 0.769 4.112 -1.724) 4.525 4.978 ( 1.490 -14.287 3.980) 14.906 5.037 ( -3.919 -9.102 -1.018) 9.963 5.135 ( -1.270 -6.660 2.540) 7.240 5.398 ( 2.313 -5.674 5.576) 8.285 5.670 ( -1.371 -9.353 0.003) 9.453 6.030 ( 0.839 -8.727 -4.566) 9.885 6.515 ( -0.523 1.769 1.679) 2.494 6.559 ( -5.708 4.970 1.151) 7.656 6.802 ( -0.066 -0.500 0.538) 0.738 7.036 ( 2.014 2.508 3.587) 4.818 7.413 ( -7.826 16.649 -7.310) 19.796 7.552 ( 3.506 -0.730 0.217) 3.588 7.716 ( -1.110 -0.431 0.500) 1.291 7.822 ( 1.307 1.469 -2.082) 2.864 7.971 ( -5.458 6.564 -0.892) 8.583 8.168 ( -0.043 8.456 -6.787) 10.843 8.228 ( -2.580 -2.721 4.086) 5.546 8.575 ( -1.186 -5.582 -2.551) 6.251 8.894 ( 4.724 -2.936 -0.493) 5.584 9.027 ( -5.376 5.090 0.336) 7.411 9.298 ( -1.580 1.419 0.227) 2.136 9.312 ( -0.381 9.118 -0.939) 9.174 9.475 ( 1.277 0.417 -1.206) 1.806 9.522 ( -3.521 13.336 4.291) 14.445 9.639 ( 3.264 -0.175 -4.896) 5.887 10.149 ( -3.254 -4.112 0.724) 5.293 11.542 ( 0.776 1.143 -1.760) 2.237 12.359 ( -1.290 -9.597 2.860) 10.097 13.979 ( -23.561 57.226 -9.643) 62.633 14.125 ( 0.272 14.642 0.951) 14.675 16.641 ( -10.292 -9.694 3.793) 14.638 16.713 ( -1.677 -20.243 -0.772) 20.327 17.620 ( -1.343 17.494 9.698) 20.048 18.087 ( -18.628 0.807 -0.435) 18.651 22.367 ( -3.182 2.217 0.099) 3.879 22.556 ( 1.650 4.503 0.898) 4.879 22.963 ( 14.744 2.681 -0.187) 14.987 23.296 ( 3.138 -3.626 1.020) 4.903 23.401 ( 0.521 -2.553 -1.618) 3.067 23.478 ( -6.513 -4.439 -10.133) 12.838 24.427 ( 13.313 2.437 -0.858) 13.562 25.869 ( 21.202 -38.042 5.980) 43.960 ======================= Grid point 12 (9/136) ======================= q-point: ( 0.38 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.041 ( 7.732 6.955 -7.678) 12.927 1.138 ( -0.764 9.332 8.627) 12.731 1.400 ( 10.030 -8.986 -1.362) 13.535 1.651 ( 1.136 10.018 -2.541) 10.397 1.801 ( 0.225 8.039 -5.105) 9.526 2.259 ( -2.564 11.475 11.061) 16.143 2.407 ( -3.774 4.204 5.451) 7.851 2.472 ( -3.276 3.177 0.858) 4.643 2.804 ( -2.719 1.206 -10.002) 10.435 2.878 ( -1.109 2.333 -2.543) 3.625 2.930 ( -2.774 4.565 -8.107) 9.709 3.021 ( -0.154 -2.019 -0.039) 2.025 3.076 ( -2.077 3.893 -2.653) 5.148 3.409 ( 5.941 -6.397 2.917) 9.205 3.543 ( -0.804 -4.420 -0.831) 4.569 3.577 ( 3.265 8.461 -1.201) 9.148 3.824 ( -1.759 -3.929 6.070) 7.441 4.020 ( 2.563 -0.441 -2.555) 3.645 4.069 ( 0.937 -1.350 2.854) 3.294 4.212 ( 1.204 -2.966 -5.581) 6.434 4.304 ( -1.235 -0.255 -2.595) 2.885 4.519 ( 2.990 2.163 5.388) 6.531 4.566 ( 0.892 0.601 7.031) 7.113 4.688 ( 2.434 0.575 -3.182) 4.047 4.935 ( -3.891 -10.339 -1.482) 11.146 4.982 ( -3.369 -2.166 3.575) 5.369 5.157 ( 1.358 -11.481 0.896) 11.595 5.480 ( 2.065 -8.149 4.993) 9.778 5.636 ( -2.050 -7.296 -0.696) 7.610 6.037 ( 1.792 -5.154 -1.742) 5.728 6.465 ( -3.559 3.753 -0.348) 5.184 6.514 ( -0.871 6.913 0.614) 6.995 6.791 ( -0.430 -5.948 -0.641) 5.998 7.096 ( 1.646 2.097 2.539) 3.682 7.254 ( -4.272 15.564 -3.015) 16.419 7.606 ( 1.227 -1.326 0.187) 1.817 7.695 ( -0.403 -0.065 0.235) 0.471 7.797 ( -2.395 1.759 -0.547) 3.021 7.923 ( 0.771 3.034 -2.158) 3.802 8.166 ( 1.482 -0.283 -1.469) 2.106 8.216 ( -0.405 1.371 0.622) 1.559 8.528 ( -1.494 -7.734 -2.615) 8.300 8.940 ( -3.130 8.144 0.917) 8.773 8.978 ( 2.643 -3.501 1.396) 4.604 9.270 ( -0.951 2.227 -0.679) 2.515 9.309 ( 0.986 9.220 -1.781) 9.442 9.442 ( -2.966 7.749 0.366) 8.305 9.536 ( 1.233 5.650 2.127) 6.162 9.663 ( 1.964 -1.371 -2.583) 3.522 10.086 ( -3.236 -4.259 0.341) 5.359 11.546 ( 0.696 0.899 -1.086) 1.572 12.358 ( -0.594 -11.672 1.553) 11.790 13.667 ( -7.378 39.471 -2.459) 40.230 14.136 ( 0.305 15.019 0.353) 15.026 16.417 ( -9.153 -10.081 -1.897) 13.748 16.751 ( 1.007 -27.326 3.045) 27.513 17.715 ( 1.923 12.220 8.647) 15.093 17.793 ( -10.850 3.602 0.856) 11.464 22.323 ( -1.472 3.699 0.123) 3.983 22.604 ( 1.781 4.279 2.511) 5.272 23.200 ( 9.388 -1.795 -1.241) 9.638 23.238 ( -4.990 0.175 -12.216) 13.197 23.351 ( -0.146 -4.247 2.699) 5.034 23.415 ( 0.350 -2.205 -1.233) 2.551 24.651 ( 8.984 5.213 0.021) 10.387 26.142 ( 6.811 -21.865 1.663) 22.961 ======================= Grid point 13 (10/136) ======================= q-point: (-0.50 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.059 ( 0.000 -6.045 -0.000) 6.045 1.162 ( 0.000 12.757 0.000) 12.757 1.548 ( 0.000 -9.276 0.000) 9.276 1.626 ( 0.000 12.274 0.000) 12.274 1.785 ( 0.000 10.231 -0.000) 10.231 2.279 ( 0.000 16.399 0.000) 16.399 2.403 ( 0.000 0.207 0.000) 0.207 2.480 ( 0.000 1.433 0.000) 1.433 2.663 ( 0.000 1.076 -0.000) 1.076 2.869 ( 0.000 3.013 0.000) 3.013 2.875 ( 0.000 5.854 -0.000) 5.854 3.024 ( -0.000 -2.766 0.000) 2.766 3.043 ( 0.000 6.702 0.000) 6.702 3.499 ( 0.000 -3.035 0.000) 3.035 3.507 ( 0.000 -8.352 -0.000) 8.352 3.620 ( 0.000 6.199 0.000) 6.199 3.820 ( 0.000 -5.500 -0.000) 5.500 4.043 ( 0.000 1.352 0.000) 1.352 4.095 ( 0.000 -6.071 0.000) 6.071 4.188 ( 0.000 2.158 0.000) 2.158 4.279 ( 0.000 -0.716 0.000) 0.716 4.570 ( 0.000 0.649 -0.000) 0.649 4.613 ( 0.000 2.894 -0.000) 2.894 4.702 ( 0.000 -2.374 -0.000) 2.374 4.887 ( 0.000 -8.610 -0.000) 8.610 4.954 ( 0.000 -1.263 0.000) 1.263 5.177 ( 0.000 -10.453 0.000) 10.453 5.535 ( 0.000 -9.074 0.000) 9.074 5.596 ( 0.000 -5.970 -0.000) 5.970 6.052 ( 0.000 -3.203 0.000) 3.203 6.428 ( 0.000 3.505 -0.000) 3.505 6.502 ( 0.000 9.196 0.000) 9.196 6.786 ( 0.000 -10.302 0.000) 10.302 7.129 ( 0.000 2.083 0.000) 2.083 7.198 ( 0.000 13.572 0.000) 13.572 7.610 ( 0.000 -0.028 0.000) 0.028 7.701 ( -0.000 -2.917 0.000) 2.917 7.766 ( 0.000 2.903 -0.000) 2.903 7.926 ( 0.000 2.912 0.000) 2.912 8.176 ( 0.000 -3.753 0.000) 3.753 8.217 ( 0.000 4.083 0.000) 4.083 8.499 ( 0.000 -9.251 0.000) 9.251 8.911 ( 0.000 8.506 0.000) 8.506 9.014 ( 0.000 -2.398 0.000) 2.398 9.258 ( -0.000 2.542 0.000) 2.542 9.315 ( 0.000 9.101 -0.000) 9.101 9.409 ( 0.000 8.655 0.000) 8.655 9.560 ( 0.000 4.455 0.000) 4.455 9.673 ( 0.000 -1.635 -0.000) 1.635 10.051 ( 0.000 -4.400 0.000) 4.400 11.550 ( 0.000 0.777 0.000) 0.777 12.358 ( 0.000 -12.420 0.000) 12.420 13.593 ( 0.000 34.321 0.000) 34.321 14.140 ( 0.000 15.179 0.000) 15.179 16.315 ( 0.000 -12.068 0.000) 12.068 16.773 ( 0.000 -27.801 0.000) 27.801 17.684 ( 0.000 5.043 0.000) 5.043 17.779 ( 0.000 10.750 0.000) 10.750 22.309 ( 0.000 4.151 -0.000) 4.151 22.638 ( 0.000 4.043 -0.000) 4.043 23.125 ( 0.000 1.333 -0.000) 1.333 23.296 ( 0.000 -5.617 0.000) 5.617 23.360 ( 0.000 -1.878 0.000) 1.878 23.411 ( 0.000 -2.250 0.000) 2.250 24.742 ( 0.000 6.418 -0.000) 6.418 26.209 ( 0.000 -17.234 0.000) 17.234 ======================= Grid point 18 (11/136) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.782 ( 0.000 18.576 0.000) 18.576 1.186 ( 0.000 24.343 0.000) 24.343 1.538 ( 0.000 -5.963 0.000) 5.963 1.728 ( 0.000 14.679 0.000) 14.679 1.937 ( 0.000 -2.275 0.000) 2.275 2.641 ( 0.000 -11.885 0.000) 11.885 2.704 ( 0.000 5.046 0.000) 5.046 2.717 ( 0.000 -0.736 0.000) 0.736 2.855 ( 0.000 3.073 0.000) 3.073 2.887 ( 0.000 3.992 0.000) 3.992 2.997 ( 0.000 7.385 0.000) 7.385 3.031 ( 0.000 -3.728 0.000) 3.728 3.278 ( 0.000 8.599 0.000) 8.599 3.288 ( 0.000 -5.631 0.000) 5.631 3.468 ( 0.000 -2.171 0.000) 2.171 3.513 ( 0.000 5.441 0.000) 5.441 3.602 ( 0.000 -18.320 0.000) 18.320 3.981 ( 0.000 -12.297 0.000) 12.297 4.003 ( 0.000 14.505 0.000) 14.505 4.192 ( 0.000 10.190 0.000) 10.190 4.279 ( 0.000 4.203 0.000) 4.203 4.387 ( 0.000 -3.280 0.000) 3.280 4.553 ( 0.000 8.829 0.000) 8.829 4.565 ( 0.000 -6.997 0.000) 6.997 4.803 ( 0.000 -18.168 0.000) 18.168 4.896 ( 0.000 11.694 0.000) 11.694 5.062 ( 0.000 -11.324 0.000) 11.324 5.370 ( 0.000 8.488 0.000) 8.488 5.440 ( 0.000 -11.818 0.000) 11.818 5.832 ( 0.000 -13.298 0.000) 13.298 6.437 ( 0.000 -2.605 0.000) 2.605 6.534 ( 0.000 -5.496 0.000) 5.496 6.977 ( 0.000 7.743 0.000) 7.743 7.116 ( 0.000 2.975 0.000) 2.975 7.502 ( 0.000 4.518 0.000) 4.518 7.635 ( 0.000 1.577 0.000) 1.577 7.644 ( 0.000 -1.905 0.000) 1.905 7.845 ( 0.000 -2.063 0.000) 2.063 8.139 ( 0.000 -1.426 0.000) 1.426 8.172 ( 0.000 4.211 0.000) 4.211 8.498 ( 0.000 -4.627 0.000) 4.627 8.571 ( 0.000 -8.716 0.000) 8.716 8.857 ( 0.000 5.424 0.000) 5.424 9.138 ( 0.000 -5.586 0.000) 5.586 9.384 ( 0.000 4.319 0.000) 4.319 9.515 ( 0.000 0.773 0.000) 0.773 9.580 ( 0.000 7.610 0.000) 7.610 9.602 ( 0.000 7.421 0.000) 7.421 9.858 ( 0.000 8.526 0.000) 8.526 10.090 ( 0.000 -6.457 0.000) 6.457 11.630 ( 0.000 7.405 0.000) 7.405 12.153 ( 0.000 -12.774 0.000) 12.774 14.519 ( 0.000 23.032 0.000) 23.032 15.474 ( 0.000 -15.740 0.000) 15.740 16.765 ( 0.000 -0.818 0.000) 0.818 16.897 ( 0.000 -4.964 0.000) 4.964 18.729 ( 0.000 5.320 0.000) 5.320 19.033 ( 0.000 -8.338 0.000) 8.338 22.516 ( 0.000 1.189 0.000) 1.189 22.574 ( 0.000 -0.425 0.000) 0.425 22.622 ( 0.000 2.699 0.000) 2.699 22.653 ( 0.000 4.407 0.000) 4.407 23.151 ( 0.000 1.111 0.000) 1.111 23.317 ( 0.000 -4.451 0.000) 4.451 24.072 ( 0.000 2.523 0.000) 2.523 24.223 ( 0.000 -3.637 0.000) 3.637 ======================= Grid point 19 (12/136) ======================= q-point: ( 0.12 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.844 ( 8.207 13.705 -5.066) 16.759 1.226 ( 4.267 22.643 -1.088) 23.067 1.480 ( -3.987 -7.665 -5.312) 10.142 1.776 ( 4.867 14.523 -1.074) 15.354 1.931 ( 0.261 1.651 -1.284) 2.108 2.551 ( -8.844 -1.403 5.158) 10.334 2.645 ( -5.510 -0.489 3.509) 6.550 2.713 ( -2.019 -1.002 1.362) 2.633 2.854 ( -1.256 3.583 -3.285) 5.021 2.930 ( 1.657 0.490 2.231) 2.822 2.986 ( 1.030 -0.566 0.988) 1.536 3.056 ( 2.196 2.307 0.754) 3.273 3.215 ( -4.057 -1.380 -6.963) 8.176 3.275 ( 2.524 6.202 -6.380) 9.249 3.447 ( 1.245 3.106 0.286) 3.359 3.605 ( -0.706 -10.615 9.169) 14.044 3.633 ( 3.937 -8.278 -0.269) 9.170 3.978 ( 1.170 -11.609 -3.568) 12.202 4.041 ( 4.103 11.629 -1.908) 12.478 4.152 ( -2.198 10.969 -2.105) 11.383 4.300 ( 3.210 3.607 -2.372) 5.379 4.384 ( -0.142 -3.296 -1.555) 3.647 4.568 ( 0.581 2.518 4.081) 4.830 4.611 ( 1.188 -3.639 6.071) 7.177 4.792 ( -0.644 -15.910 -0.779) 15.942 4.879 ( -1.829 11.804 0.767) 11.969 5.065 ( -1.676 -9.251 3.551) 10.050 5.377 ( 1.553 6.979 -1.239) 7.256 5.441 ( 0.122 -11.580 0.453) 11.590 5.810 ( 0.420 -12.266 -4.329) 13.014 6.464 ( 1.004 -2.273 2.750) 3.706 6.559 ( 1.769 -5.415 0.631) 5.732 6.929 ( -5.330 7.218 2.965) 9.450 7.089 ( -2.601 1.801 1.051) 3.334 7.533 ( 2.854 4.685 -0.326) 5.496 7.616 ( -0.134 1.031 -4.854) 4.964 7.667 ( 2.980 -1.295 -2.949) 4.388 7.832 ( -0.609 -2.477 -0.988) 2.735 8.124 ( -1.735 -0.279 1.426) 2.263 8.172 ( 0.305 3.194 -1.777) 3.668 8.492 ( -2.359 -3.238 2.036) 4.494 8.547 ( -3.161 -5.719 -0.235) 6.539 8.820 ( -1.465 5.788 -0.790) 6.022 9.116 ( -2.709 -4.849 1.730) 5.817 9.377 ( -0.276 4.405 -1.033) 4.533 9.511 ( 0.116 0.993 -1.281) 1.625 9.559 ( -1.359 9.290 -0.080) 9.389 9.616 ( 2.258 4.504 -3.991) 6.427 9.838 ( -2.091 8.593 0.420) 8.854 10.076 ( -1.845 -6.454 0.828) 6.763 11.627 ( -0.022 7.285 -0.837) 7.332 12.144 ( -1.571 -12.708 1.676) 12.914 14.529 ( 0.551 23.266 0.956) 23.292 15.384 ( -10.038 -3.912 -3.490) 11.325 16.560 ( -19.629 -0.168 -1.886) 19.720 16.787 ( -9.801 -6.329 -4.735) 12.591 18.342 ( -38.214 13.586 -7.402) 41.227 18.490 ( -20.286 1.332 -2.016) 20.430 22.462 ( -1.509 2.508 -0.706) 3.010 22.604 ( 1.547 0.604 -1.014) 1.945 22.808 ( 12.885 6.585 2.552) 14.693 23.073 ( 11.456 -7.375 7.536) 15.570 23.268 ( 11.082 -5.808 0.178) 12.513 23.335 ( 3.699 -5.176 -0.497) 6.381 24.214 ( 12.779 2.103 0.242) 12.953 24.454 ( 27.145 -12.418 5.495) 30.352 ======================= Grid point 20 (13/136) ======================= q-point: ( 0.25 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.008 ( 11.678 3.782 -4.839) 13.194 1.267 ( -0.659 1.274 -13.411) 13.487 1.374 ( -0.044 12.363 4.271) 13.079 1.857 ( 4.265 6.412 -3.492) 8.455 1.952 ( 2.847 11.468 -0.517) 11.828 2.435 ( -8.272 2.286 10.164) 13.303 2.574 ( -4.338 0.737 2.907) 5.273 2.637 ( -4.984 2.217 -0.148) 5.457 2.829 ( 0.252 -1.943 -0.212) 1.971 2.919 ( -1.884 1.340 0.299) 2.331 3.010 ( 0.588 -1.868 -4.079) 4.524 3.097 ( -2.734 1.640 -4.705) 5.683 3.152 ( 4.235 -0.029 4.821) 6.417 3.258 ( 1.296 7.640 -9.611) 12.346 3.476 ( 0.844 0.804 0.962) 1.511 3.634 ( -0.374 -14.028 3.455) 14.452 3.686 ( 0.036 -2.029 2.233) 3.017 3.955 ( -0.711 -10.647 -3.988) 11.392 4.118 ( 1.129 9.282 -0.758) 9.381 4.130 ( 5.311 6.413 -2.594) 8.721 4.321 ( 0.844 -1.411 -6.418) 6.625 4.410 ( 3.842 0.303 3.431) 5.160 4.599 ( -2.354 1.670 7.009) 7.580 4.684 ( 3.061 -8.896 2.224) 9.667 4.777 ( -1.727 -7.542 2.306) 8.074 4.851 ( -0.477 9.980 -0.472) 10.003 5.035 ( -4.184 -5.901 4.085) 8.307 5.400 ( 0.753 -2.356 -0.310) 2.493 5.471 ( 2.933 -3.552 0.868) 4.687 5.822 ( 4.489 -10.055 -4.434) 11.871 6.489 ( -0.743 -1.656 2.017) 2.713 6.575 ( -0.919 -3.877 0.236) 3.992 6.848 ( -4.931 5.801 3.428) 8.350 7.059 ( -0.974 -1.271 1.454) 2.163 7.542 ( -3.482 2.431 -0.184) 4.251 7.607 ( 5.338 4.669 -7.610) 10.402 7.687 ( 0.949 -2.083 -2.629) 3.486 7.823 ( 0.728 -3.145 -1.517) 3.567 8.094 ( -3.604 3.577 2.520) 5.669 8.149 ( -0.574 1.860 -2.795) 3.406 8.386 ( -6.703 4.077 -0.754) 7.882 8.478 ( -3.973 -4.549 0.018) 6.039 8.846 ( 3.058 1.626 2.133) 4.068 9.073 ( -3.135 -2.349 3.220) 5.070 9.361 ( -0.338 4.696 -1.402) 4.913 9.505 ( 0.754 1.578 -2.476) 3.032 9.536 ( -0.490 9.297 -1.208) 9.388 9.625 ( 1.923 1.113 -4.740) 5.235 9.791 ( -3.150 8.768 1.579) 9.450 10.031 ( -3.378 -6.412 0.889) 7.301 11.620 ( 0.053 6.857 -1.025) 6.933 12.120 ( -2.110 -12.702 1.745) 12.994 14.551 ( 0.834 23.785 1.129) 23.827 14.983 ( -23.434 29.310 -8.702) 38.522 16.215 ( -10.622 -17.109 1.599) 20.202 16.468 ( -17.323 -11.874 -6.763) 22.064 17.921 ( -9.362 10.272 7.077) 15.596 18.099 ( -17.248 -0.035 1.649) 17.327 22.443 ( -0.870 4.917 0.963) 5.086 22.634 ( 1.540 0.890 1.085) 2.084 23.034 ( 9.651 3.888 -2.527) 10.707 23.210 ( 2.657 -3.115 4.502) 6.085 23.325 ( 2.118 -3.922 -5.220) 6.864 23.378 ( -0.617 -4.477 -7.596) 8.839 24.521 ( 17.222 6.679 1.574) 18.539 25.149 ( 29.937 -26.303 8.616) 40.771 ======================= Grid point 21 (14/136) ======================= q-point: ( 0.38 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.071 ( -4.206 -0.788 -9.308) 10.244 1.211 ( 7.910 -7.186 -2.178) 10.906 1.471 ( 4.195 17.855 2.938) 18.575 1.895 ( 2.212 5.560 -2.819) 6.614 1.998 ( 1.828 12.261 -1.090) 12.444 2.378 ( -4.251 -1.535 6.054) 7.555 2.523 ( -1.714 5.194 -0.794) 5.527 2.592 ( -1.598 6.538 9.261) 11.448 2.842 ( 0.097 -0.105 -0.398) 0.423 2.876 ( -2.717 -1.680 -0.603) 3.251 2.944 ( -1.646 1.359 -7.863) 8.147 3.028 ( -1.809 3.269 -3.216) 4.930 3.190 ( 0.197 5.257 -5.238) 7.424 3.270 ( 2.636 -3.411 3.639) 5.642 3.488 ( 0.221 -0.489 -0.765) 0.935 3.638 ( -1.283 -10.698 1.884) 10.938 3.696 ( 0.876 -0.962 0.406) 1.363 3.903 ( -2.015 -13.218 -2.414) 13.587 4.141 ( 1.365 7.950 1.074) 8.137 4.216 ( 4.072 4.209 -2.040) 6.201 4.281 ( -0.993 -1.628 -2.505) 3.149 4.528 ( 5.234 -3.667 0.583) 6.418 4.592 ( -1.731 1.034 4.341) 4.787 4.747 ( -0.410 -0.945 2.353) 2.569 4.756 ( 1.303 0.244 -0.598) 1.454 4.857 ( -0.269 -1.324 1.821) 2.267 4.979 ( -3.556 -4.241 2.432) 6.046 5.405 ( 0.118 -9.674 -0.119) 9.675 5.548 ( 3.430 5.171 1.124) 6.306 5.903 ( 5.362 -7.250 -1.852) 9.206 6.456 ( -2.660 -1.032 -0.906) 2.993 6.558 ( -0.468 -4.904 1.399) 5.121 6.780 ( -4.169 6.534 1.094) 7.828 7.070 ( 0.664 -4.220 1.237) 4.447 7.458 ( -3.365 4.330 -2.305) 5.948 7.632 ( 1.051 1.591 -4.173) 4.588 7.695 ( 2.212 0.573 -1.029) 2.506 7.820 ( -1.139 -1.297 -0.327) 1.757 8.007 ( -4.354 5.768 0.854) 7.277 8.141 ( 0.435 1.209 -0.181) 1.297 8.312 ( -0.580 3.239 -1.458) 3.599 8.382 ( -4.765 -5.977 -0.857) 7.691 8.930 ( 2.962 -0.006 2.536) 3.899 9.051 ( -1.588 0.837 2.896) 3.407 9.346 ( -0.294 5.280 -0.881) 5.362 9.502 ( 1.121 2.972 -3.271) 4.560 9.523 ( -0.243 7.771 -0.609) 7.798 9.623 ( 1.078 -1.519 -3.170) 3.677 9.755 ( -1.763 8.496 2.078) 8.922 9.966 ( -3.466 -6.357 0.352) 7.249 11.615 ( 0.109 6.250 -0.652) 6.285 12.094 ( -1.365 -12.925 0.864) 13.025 14.548 ( -11.937 37.720 -9.013) 40.578 14.573 ( -1.310 24.426 5.018) 24.971 16.109 ( -13.567 -18.096 -2.419) 22.746 16.132 ( -1.308 -28.472 0.007) 28.502 17.872 ( -7.382 4.102 2.763) 8.886 17.903 ( -1.865 4.468 7.503) 8.929 22.438 ( -0.434 6.863 0.921) 6.938 22.677 ( 1.364 0.664 2.376) 2.819 23.151 ( 4.513 -1.390 -2.190) 5.205 23.241 ( -2.611 -0.296 -9.025) 9.399 23.275 ( 1.395 -2.260 1.283) 2.950 23.342 ( 0.910 -4.025 -3.156) 5.195 24.829 ( 11.575 11.555 1.820) 16.456 25.617 ( 13.756 -24.529 3.986) 28.405 ======================= Grid point 22 (15/136) ======================= q-point: (-0.50 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.982 ( 0.000 0.444 -0.000) 0.444 1.292 ( 0.000 -9.693 0.000) 9.693 1.531 ( 0.000 16.088 -0.000) 16.088 1.902 ( 0.000 7.629 0.000) 7.629 2.010 ( 0.000 11.099 0.000) 11.099 2.357 ( 0.000 -4.383 0.000) 4.383 2.503 ( 0.000 7.090 -0.000) 7.090 2.707 ( 0.000 1.590 0.000) 1.590 2.713 ( -0.000 13.912 -0.000) 13.912 2.881 ( 0.000 1.774 0.000) 1.774 2.894 ( 0.000 -7.190 -0.000) 7.190 2.994 ( 0.000 3.905 -0.000) 3.905 3.175 ( 0.000 5.473 0.000) 5.473 3.314 ( 0.000 -6.371 0.000) 6.371 3.482 ( 0.000 -1.005 -0.000) 1.005 3.629 ( 0.000 -9.426 0.000) 9.426 3.714 ( 0.000 -0.113 0.000) 0.113 3.866 ( 0.000 -15.410 0.000) 15.410 4.165 ( 0.000 6.613 -0.000) 6.613 4.247 ( 0.000 5.282 -0.000) 5.282 4.259 ( 0.000 -1.117 0.000) 1.117 4.567 ( 0.000 -7.197 -0.000) 7.197 4.615 ( 0.000 1.146 0.000) 1.146 4.741 ( 0.000 8.646 -0.000) 8.646 4.781 ( 0.000 0.136 0.000) 0.136 4.856 ( 0.000 -7.361 0.000) 7.361 4.952 ( 0.000 -4.460 0.000) 4.460 5.406 ( 0.000 -11.777 0.000) 11.777 5.591 ( 0.000 8.495 0.000) 8.495 5.958 ( 0.000 -5.771 0.000) 5.771 6.417 ( 0.000 -0.757 -0.000) 0.757 6.569 ( 0.000 -8.984 -0.000) 8.984 6.729 ( 0.000 9.973 0.000) 9.973 7.085 ( 0.000 -5.490 0.000) 5.490 7.411 ( 0.000 5.842 0.000) 5.842 7.621 ( 0.000 -1.310 0.000) 1.310 7.729 ( -0.000 4.433 0.000) 4.433 7.786 ( 0.000 -0.052 -0.000) 0.052 7.978 ( 0.000 3.042 0.000) 3.042 8.145 ( 0.000 0.735 0.000) 0.735 8.307 ( 0.000 2.733 -0.000) 2.733 8.324 ( -0.000 -6.533 0.000) 6.533 8.972 ( 0.000 -0.520 0.000) 0.520 9.047 ( 0.000 2.351 0.000) 2.351 9.340 ( 0.000 5.642 -0.000) 5.642 9.502 ( 0.000 3.831 -0.000) 3.831 9.517 ( -0.000 6.963 0.000) 6.963 9.623 ( 0.000 -2.348 -0.000) 2.348 9.749 ( 0.000 8.056 0.000) 8.056 9.927 ( 0.000 -6.477 0.000) 6.477 11.614 ( 0.000 5.949 0.000) 5.949 12.084 ( 0.000 -13.076 0.000) 13.076 14.399 ( 0.000 37.247 0.000) 37.247 14.581 ( 0.000 24.329 0.000) 24.329 15.959 ( 0.000 -20.201 -0.000) 20.201 16.127 ( 0.000 -30.795 0.000) 30.795 17.809 ( 0.000 5.956 0.000) 5.956 17.924 ( 0.000 2.770 0.000) 2.770 22.437 ( 0.000 7.556 0.000) 7.556 22.704 ( 0.000 0.187 0.000) 0.187 23.168 ( 0.000 2.549 -0.000) 2.549 23.186 ( 0.000 -2.973 0.000) 2.973 23.300 ( 0.000 -3.595 0.000) 3.595 23.336 ( 0.000 -4.164 -0.000) 4.164 24.952 ( 0.000 13.181 0.000) 13.181 25.760 ( 0.000 -22.586 0.000) 22.586 ======================= Grid point 27 (16/136) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.182 ( 0.000 -18.603 0.000) 18.603 1.182 ( 0.000 18.603 0.000) 18.603 1.631 ( 0.000 -16.310 0.000) 16.310 1.631 ( 0.000 16.310 0.000) 16.310 2.284 ( 0.000 -19.099 0.000) 19.099 2.284 ( 0.000 19.099 0.000) 19.099 2.755 ( 0.000 -0.682 0.000) 0.682 2.755 ( 0.000 0.682 0.000) 0.682 2.937 ( 0.000 -4.662 0.000) 4.662 2.937 ( 0.000 4.662 0.000) 4.662 3.121 ( 0.000 -12.834 0.000) 12.834 3.121 ( 0.000 12.834 0.000) 12.834 3.182 ( 0.000 -14.154 0.000) 14.154 3.182 ( 0.000 14.154 0.000) 14.154 3.421 ( 0.000 -3.484 0.000) 3.484 3.421 ( 0.000 3.484 0.000) 3.484 3.703 ( 0.000 -12.463 0.000) 12.463 3.703 ( 0.000 12.463 0.000) 12.463 4.294 ( 0.000 -6.956 0.000) 6.956 4.294 ( 0.000 6.956 0.000) 6.956 4.386 ( 0.000 -12.279 0.000) 12.279 4.386 ( 0.000 12.279 0.000) 12.279 4.432 ( 0.000 -11.147 0.000) 11.147 4.432 ( 0.000 11.147 0.000) 11.147 4.792 ( 0.000 -12.891 0.000) 12.891 4.792 ( 0.000 12.891 0.000) 12.891 5.174 ( 0.000 -13.154 0.000) 13.154 5.174 ( 0.000 13.154 0.000) 13.154 5.576 ( 0.000 -10.676 0.000) 10.676 5.576 ( 0.000 10.676 0.000) 10.676 6.435 ( 0.000 -2.622 0.000) 2.622 6.435 ( 0.000 2.622 0.000) 2.622 7.103 ( 0.000 -3.586 0.000) 3.586 7.103 ( 0.000 3.586 0.000) 3.586 7.593 ( 0.000 -3.163 0.000) 3.163 7.593 ( 0.000 3.163 0.000) 3.163 7.729 ( 0.000 -6.512 0.000) 6.512 7.729 ( 0.000 6.512 0.000) 6.512 8.201 ( 0.000 -3.315 0.000) 3.315 8.201 ( 0.000 3.315 0.000) 3.315 8.437 ( 0.000 -0.871 0.000) 0.871 8.437 ( 0.000 0.871 0.000) 0.871 8.995 ( 0.000 -7.031 0.000) 7.031 8.995 ( 0.000 7.031 0.000) 7.031 9.472 ( 0.000 -3.466 0.000) 3.466 9.472 ( 0.000 3.466 0.000) 3.466 9.701 ( 0.000 -1.288 0.000) 1.288 9.701 ( 0.000 1.288 0.000) 1.288 9.969 ( 0.000 -3.969 0.000) 3.969 9.969 ( 0.000 3.969 0.000) 3.969 11.862 ( 0.000 -13.344 0.000) 13.344 11.862 ( 0.000 13.344 0.000) 13.344 15.037 ( 0.000 -23.764 0.000) 23.764 15.037 ( 0.000 23.764 0.000) 23.764 16.799 ( 0.000 -3.649 0.000) 3.649 16.799 ( 0.000 3.649 0.000) 3.649 18.864 ( 0.000 -7.199 0.000) 7.199 18.864 ( 0.000 7.199 0.000) 7.199 22.546 ( 0.000 -1.539 0.000) 1.539 22.546 ( 0.000 1.539 0.000) 1.539 22.682 ( 0.000 -1.579 0.000) 1.579 22.682 ( 0.000 1.579 0.000) 1.579 23.214 ( 0.000 -4.533 0.000) 4.533 23.214 ( 0.000 4.533 0.000) 4.533 24.141 ( 0.000 -3.744 0.000) 3.744 24.141 ( 0.000 3.744 0.000) 3.744 ======================= Grid point 29 (17/136) ======================= q-point: ( 0.12 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.164 ( 0.649 -15.657 -6.284) 16.884 1.164 ( 0.649 15.657 -6.284) 16.884 1.660 ( 3.083 -15.523 -0.614) 15.838 1.660 ( 3.083 15.523 -0.614) 15.838 2.285 ( 0.092 -17.251 -0.229) 17.252 2.285 ( 0.092 17.251 -0.229) 17.252 2.704 ( -6.395 -2.918 4.859) 8.545 2.704 ( -6.395 2.918 4.859) 8.545 2.925 ( -0.991 -2.700 -0.252) 2.887 2.925 ( -0.991 2.700 -0.252) 2.887 3.100 ( -1.564 -8.895 -0.883) 9.074 3.100 ( -1.564 8.895 -0.883) 9.074 3.212 ( 3.250 -13.147 -1.865) 13.671 3.212 ( 3.250 13.147 -1.865) 13.671 3.438 ( 1.467 -5.649 1.454) 6.014 3.438 ( 1.467 5.649 1.454) 6.014 3.716 ( 1.415 -11.021 -2.102) 11.309 3.716 ( 1.415 11.021 -2.102) 11.309 4.285 ( 0.415 -6.039 -3.618) 7.052 4.285 ( 0.415 6.039 -3.618) 7.052 4.359 ( -1.334 -8.223 -2.172) 8.609 4.359 ( -1.334 8.223 -2.172) 8.609 4.459 ( 1.066 -0.713 4.671) 4.844 4.459 ( 1.066 0.713 4.671) 4.844 4.831 ( 1.388 -11.408 4.431) 12.317 4.831 ( 1.388 11.408 4.431) 12.317 5.167 ( -0.822 -13.645 0.210) 13.671 5.167 ( -0.822 13.645 0.210) 13.671 5.570 ( 1.310 -10.139 -3.230) 10.721 5.570 ( 1.310 10.139 -3.230) 10.721 6.463 ( 1.587 -2.533 1.848) 3.514 6.463 ( 1.587 2.533 1.848) 3.514 7.057 ( -4.764 -4.180 1.914) 6.621 7.057 ( -4.764 4.180 1.914) 6.621 7.620 ( 3.509 -2.026 -3.641) 5.447 7.620 ( 3.509 2.026 -3.641) 5.447 7.711 ( -1.066 -6.543 -1.165) 6.731 7.711 ( -1.066 6.543 -1.165) 6.731 8.190 ( -0.335 -3.430 -1.506) 3.761 8.190 ( -0.335 3.430 -1.506) 3.761 8.443 ( -1.305 -0.650 3.184) 3.502 8.443 ( -1.305 0.650 3.184) 3.502 8.975 ( -1.858 -7.545 0.571) 7.791 8.975 ( -1.858 7.545 0.571) 7.791 9.469 ( 0.320 -3.660 -1.321) 3.904 9.469 ( 0.320 3.660 -1.321) 3.904 9.689 ( -0.280 -1.395 -2.298) 2.703 9.689 ( -0.280 1.395 -2.298) 2.703 9.953 ( -1.947 -4.202 0.806) 4.701 9.953 ( -1.947 4.202 0.806) 4.701 11.855 ( -0.842 -13.196 0.428) 13.230 11.855 ( -0.842 13.196 0.428) 13.230 15.045 ( 0.143 -22.944 1.346) 22.984 15.045 ( 0.143 22.944 1.346) 22.984 16.644 ( -15.134 -6.380 -4.187) 16.949 16.644 ( -15.134 6.380 -4.187) 16.949 18.489 ( -27.330 -2.163 -3.918) 27.694 18.489 ( -27.330 2.163 -3.918) 27.694 22.543 ( 1.009 -4.569 -0.856) 4.757 22.543 ( 1.009 4.569 -0.856) 4.757 22.946 ( 14.662 -5.791 6.078) 16.895 22.946 ( 14.662 5.791 6.078) 16.895 23.244 ( 3.688 -2.733 -1.380) 4.793 23.244 ( 3.688 2.733 -1.380) 4.793 24.287 ( 15.792 -4.925 1.361) 16.598 24.287 ( 15.792 4.925 1.361) 16.598 ======================= Grid point 31 (18/136) ======================= q-point: ( 0.25 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.124 ( 1.323 -7.217 -8.884) 11.522 1.124 ( 1.323 7.217 -8.884) 11.522 1.733 ( 4.671 -13.734 -0.590) 14.519 1.733 ( 4.671 13.734 -0.590) 14.519 2.276 ( -1.235 -13.026 0.067) 13.085 2.276 ( -1.235 13.026 0.067) 13.085 2.622 ( -5.154 -2.653 6.252) 8.525 2.622 ( -5.154 2.653 6.252) 8.525 2.898 ( -1.120 -4.540 -1.362) 4.870 2.898 ( -1.120 4.540 -1.362) 4.870 3.068 ( -1.514 -5.786 0.339) 5.991 3.068 ( -1.514 5.786 0.339) 5.991 3.241 ( 1.429 -10.021 -3.016) 10.562 3.241 ( 1.429 10.021 -3.016) 10.562 3.502 ( 3.418 -3.084 1.489) 4.838 3.502 ( 3.418 3.084 1.489) 4.838 3.696 ( -1.845 -8.608 -3.292) 9.399 3.696 ( -1.845 8.608 -3.292) 9.399 4.257 ( -0.428 -4.086 -3.015) 5.096 4.257 ( -0.428 4.086 -3.015) 5.096 4.340 ( 1.082 -10.527 -1.182) 10.648 4.340 ( 1.082 10.527 -1.182) 10.648 4.538 ( 3.262 -3.534 4.881) 6.852 4.538 ( 3.262 3.534 4.881) 6.852 4.868 ( -1.413 -8.475 4.237) 9.580 4.868 ( -1.413 8.475 4.237) 9.580 5.147 ( -1.361 -14.501 0.360) 14.569 5.147 ( -1.361 14.501 0.360) 14.569 5.611 ( 5.656 -9.360 -3.083) 11.363 5.611 ( 5.656 9.360 -3.083) 11.363 6.492 ( -0.479 -2.406 1.493) 2.872 6.492 ( -0.479 2.406 1.493) 2.872 6.981 ( -4.047 -5.528 2.237) 7.207 6.981 ( -4.047 5.528 2.237) 7.207 7.623 ( -1.071 -4.026 -4.170) 5.895 7.623 ( -1.071 4.026 -4.170) 5.895 7.711 ( 2.909 -5.411 -1.896) 6.429 7.711 ( 2.909 5.411 -1.896) 6.429 8.174 ( -0.230 -2.396 -1.543) 2.860 8.174 ( -0.230 2.396 -1.543) 2.860 8.401 ( -5.330 -0.927 2.414) 5.924 8.401 ( -5.330 0.927 2.414) 5.924 8.959 ( -0.221 -6.886 2.112) 7.206 8.959 ( -0.221 6.886 2.112) 7.206 9.467 ( 0.634 -4.259 -1.479) 4.552 9.467 ( 0.634 4.259 -1.479) 4.552 9.659 ( -0.377 -1.665 -3.748) 4.119 9.659 ( -0.377 1.665 -3.748) 4.119 9.910 ( -3.161 -4.306 1.271) 5.491 9.910 ( -3.161 4.306 1.271) 5.491 11.837 ( -1.218 -12.705 0.399) 12.769 11.837 ( -1.218 12.705 0.399) 12.769 15.050 ( -1.088 -18.407 1.101) 18.472 15.050 ( -1.088 18.407 1.101) 18.472 16.185 ( -24.135 -12.031 -7.682) 28.041 16.185 ( -24.135 12.031 -7.682) 28.041 18.065 ( -14.585 -3.629 4.240) 15.616 18.065 ( -14.585 3.629 4.240) 15.616 22.566 ( 1.071 -5.875 1.321) 6.116 22.566 ( 1.071 5.875 1.321) 6.116 23.136 ( 4.291 -4.995 0.275) 6.590 23.136 ( 4.291 4.995 0.275) 6.590 23.298 ( 2.927 -2.243 -5.725) 6.810 23.298 ( 2.927 2.243 -5.725) 6.810 24.733 ( 23.813 -13.724 5.280) 27.987 24.733 ( 23.813 13.724 5.280) 27.987 ======================= Grid point 33 (19/136) ======================= q-point: ( 0.38 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.093 ( 1.218 -3.382 -6.099) 7.079 1.093 ( 1.218 3.382 -6.099) 7.079 1.817 ( 3.797 -11.962 -0.105) 12.550 1.817 ( 3.797 11.962 -0.105) 12.550 2.241 ( -1.954 -9.466 -0.027) 9.666 2.241 ( -1.954 9.466 -0.027) 9.666 2.615 ( -0.292 -2.535 5.169) 5.765 2.615 ( -0.292 2.535 5.169) 5.765 2.862 ( -1.865 -2.476 -0.576) 3.153 2.862 ( -1.865 2.476 -0.576) 3.153 3.038 ( -1.229 -3.477 -1.719) 4.069 3.038 ( -1.229 3.477 -1.719) 4.069 3.247 ( 1.013 -7.916 -0.129) 7.981 3.247 ( 1.013 7.916 -0.129) 7.981 3.534 ( -0.567 -13.076 -5.208) 14.086 3.534 ( -0.567 13.076 -5.208) 14.086 3.637 ( -1.316 -3.972 2.057) 4.662 3.637 ( -1.316 3.972 2.057) 4.662 4.236 ( -0.173 -2.654 -1.229) 2.930 4.236 ( -0.173 2.654 -1.229) 2.930 4.374 ( 2.474 -8.330 -0.352) 8.696 4.374 ( 2.474 8.330 -0.352) 8.696 4.640 ( 3.491 -4.096 3.214) 6.269 4.640 ( 3.491 4.096 3.214) 6.269 4.847 ( -2.415 -5.354 2.229) 6.282 4.847 ( -2.415 5.354 2.229) 6.282 5.120 ( -1.513 -14.997 0.005) 15.074 5.120 ( -1.513 14.997 0.005) 15.074 5.725 ( 6.536 -9.143 -1.089) 11.291 5.725 ( 6.536 9.143 -1.089) 11.291 6.465 ( -2.459 -2.456 0.350) 3.493 6.465 ( -2.459 2.456 0.350) 3.493 6.940 ( -1.705 -7.314 1.360) 7.632 6.940 ( -1.705 7.314 1.360) 7.632 7.559 ( -2.063 -5.500 -2.573) 6.412 7.559 ( -2.063 5.500 -2.573) 6.412 7.762 ( 3.088 -3.476 -1.625) 4.926 7.762 ( 3.088 3.476 -1.625) 4.926 8.136 ( -3.397 -4.436 -0.511) 5.610 8.136 ( -3.397 4.436 -0.511) 5.610 8.317 ( -2.804 -1.170 0.430) 3.068 8.317 ( -2.804 1.170 0.430) 3.068 8.990 ( 1.086 -4.610 2.298) 5.264 8.990 ( 1.086 4.610 2.298) 5.264 9.474 ( 0.768 -5.307 -0.398) 5.377 9.474 ( 0.768 5.307 -0.398) 5.377 9.624 ( -0.367 -2.556 -3.543) 4.384 9.624 ( -0.367 2.556 -3.543) 4.384 9.859 ( -2.641 -3.192 1.105) 4.288 9.859 ( -2.641 3.192 1.105) 4.288 11.818 ( -0.854 -12.071 0.143) 12.102 11.818 ( -0.854 12.071 0.143) 12.102 15.007 ( -3.260 -5.659 -0.510) 6.550 15.007 ( -3.260 5.659 -0.510) 6.550 15.763 ( -12.886 -4.797 -3.662) 14.229 15.763 ( -12.886 4.797 -3.662) 14.229 17.933 ( -4.689 -1.195 5.331) 7.199 17.933 ( -4.689 1.195 5.331) 7.199 22.597 ( 0.675 -7.023 1.779) 7.276 22.597 ( 0.675 7.023 1.779) 7.276 23.186 ( 1.847 -3.754 -1.219) 4.358 23.186 ( 1.847 3.754 -1.219) 4.358 23.276 ( 0.137 -1.693 -5.539) 5.794 23.276 ( 0.137 1.693 -5.539) 5.794 25.150 ( 14.165 -18.483 3.595) 23.563 25.150 ( 14.165 18.483 3.595) 23.563 ======================= Grid point 35 (20/136) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.083 ( 0.000 -8.226 -0.000) 8.226 1.083 ( 0.000 8.226 0.000) 8.226 1.857 ( 0.000 -11.143 -0.000) 11.143 1.857 ( 0.000 11.143 -0.000) 11.143 2.219 ( 0.000 -8.323 0.000) 8.323 2.219 ( 0.000 8.323 0.000) 8.323 2.645 ( 0.000 -5.218 0.000) 5.218 2.645 ( 0.000 5.218 0.000) 5.218 2.834 ( 0.000 -1.520 0.000) 1.520 2.834 ( 0.000 1.520 -0.000) 1.520 3.012 ( 0.000 -3.477 0.000) 3.477 3.012 ( 0.000 3.477 -0.000) 3.477 3.267 ( 0.000 -9.360 0.000) 9.360 3.267 ( 0.000 9.360 0.000) 9.360 3.482 ( 0.000 -18.029 0.000) 18.029 3.482 ( 0.000 18.029 -0.000) 18.029 3.646 ( 0.000 -4.796 -0.000) 4.796 3.646 ( 0.000 4.796 0.000) 4.796 4.230 ( 0.000 -1.635 0.000) 1.635 4.230 ( 0.000 1.635 0.000) 1.635 4.402 ( 0.000 -7.187 0.000) 7.187 4.402 ( 0.000 7.187 -0.000) 7.187 4.689 ( 0.000 -4.902 0.000) 4.902 4.689 ( 0.000 4.902 0.000) 4.902 4.831 ( 0.000 -3.337 -0.000) 3.337 4.831 ( 0.000 3.337 0.000) 3.337 5.101 ( 0.000 -15.640 0.000) 15.640 5.101 ( 0.000 15.640 0.000) 15.640 5.795 ( 0.000 -9.320 0.000) 9.320 5.795 ( 0.000 9.320 0.000) 9.320 6.436 ( 0.000 -3.172 -0.000) 3.172 6.436 ( 0.000 3.172 0.000) 3.172 6.929 ( 0.000 -8.536 0.000) 8.536 6.929 ( 0.000 8.536 0.000) 8.536 7.527 ( 0.000 -5.794 0.000) 5.794 7.527 ( 0.000 5.794 0.000) 5.794 7.790 ( 0.000 -0.614 0.000) 0.614 7.790 ( 0.000 0.614 -0.000) 0.614 8.085 ( 0.000 -6.163 0.000) 6.163 8.085 ( 0.000 6.163 -0.000) 6.163 8.299 ( 0.000 -2.640 0.000) 2.640 8.299 ( 0.000 2.640 0.000) 2.640 9.012 ( 0.000 -3.519 0.000) 3.519 9.012 ( 0.000 3.519 0.000) 3.519 9.483 ( 0.000 -6.305 0.000) 6.305 9.483 ( 0.000 6.305 0.000) 6.305 9.604 ( 0.000 -3.844 -0.000) 3.844 9.604 ( 0.000 3.844 -0.000) 3.844 9.836 ( 0.000 -1.598 0.000) 1.598 9.836 ( 0.000 1.598 0.000) 1.598 11.810 ( 0.000 -11.780 0.000) 11.780 11.810 ( 0.000 11.780 0.000) 11.780 14.962 ( 0.000 -3.289 0.000) 3.289 14.962 ( 0.000 3.289 -0.000) 3.289 15.634 ( 0.000 -3.405 0.000) 3.405 15.634 ( 0.000 3.405 0.000) 3.405 17.913 ( 0.000 -3.223 0.000) 3.223 17.913 ( 0.000 3.223 0.000) 3.223 22.611 ( 0.000 -7.688 0.000) 7.688 22.611 ( 0.000 7.688 0.000) 7.688 23.198 ( 0.000 -2.293 0.000) 2.293 23.198 ( 0.000 2.293 0.000) 2.293 23.254 ( 0.000 -2.477 -0.000) 2.477 23.254 ( 0.000 2.477 -0.000) 2.477 25.302 ( 0.000 -19.295 0.000) 19.295 25.302 ( 0.000 19.295 0.000) 19.295 ======================= Grid point 63 (21/136) ======================= q-point: ( 0.00 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.329 ( -10.788 0.000 17.261) 20.355 0.535 ( -4.587 0.000 26.121) 26.520 1.029 ( -17.977 0.000 51.187) 54.252 1.683 ( -8.677 0.000 15.250) 17.546 2.284 ( 2.299 0.000 -6.231) 6.642 2.313 ( -3.983 0.000 0.624) 4.032 2.486 ( 8.745 0.000 -9.258) 12.735 2.598 ( -0.267 0.000 -0.066) 0.275 2.706 ( 0.710 0.000 -3.767) 3.833 2.869 ( 3.023 0.000 1.225) 3.262 2.995 ( 0.424 0.000 -15.654) 15.659 3.069 ( -6.576 0.000 -1.374) 6.718 3.114 ( -1.427 0.000 -1.371) 1.979 3.291 ( -8.118 0.000 5.595) 9.859 3.467 ( -3.772 0.000 2.061) 4.298 3.477 ( 3.535 0.000 -3.966) 5.313 3.537 ( 10.183 0.000 -6.247) 11.947 3.722 ( 6.179 0.000 9.221) 11.100 4.026 ( 4.074 0.000 -10.108) 10.898 4.141 ( 2.000 0.000 6.327) 6.636 4.247 ( -0.102 0.000 -2.552) 2.554 4.442 ( 1.349 0.000 4.918) 5.100 4.656 ( -3.651 0.000 8.959) 9.674 4.691 ( 5.476 0.000 3.116) 6.301 4.808 ( 6.023 0.000 2.363) 6.470 5.181 ( -0.260 0.000 -0.356) 0.441 5.242 ( -2.489 0.000 10.961) 11.240 5.375 ( 4.678 0.000 -1.338) 4.865 5.922 ( -0.230 0.000 -1.400) 1.418 5.942 ( 3.493 0.000 -7.354) 8.141 6.273 ( -1.037 0.000 0.593) 1.195 6.555 ( 0.937 0.000 -8.085) 8.139 6.584 ( 0.737 0.000 1.422) 1.602 6.995 ( 2.332 0.000 4.050) 4.674 7.026 ( 0.999 0.000 0.080) 1.002 7.656 ( -0.225 0.000 -5.188) 5.193 7.705 ( 0.340 0.000 -2.337) 2.362 7.733 ( 0.845 0.000 -2.352) 2.499 7.867 ( 0.829 0.000 -2.514) 2.647 8.023 ( -0.812 0.000 -2.177) 2.323 8.442 ( 3.757 0.000 -7.055) 7.993 8.683 ( -1.436 0.000 -12.053) 12.139 8.692 ( 3.703 0.000 -7.008) 7.926 8.956 ( 1.113 0.000 -3.837) 3.995 9.304 ( -1.595 0.000 3.268) 3.637 9.469 ( 1.318 0.000 4.610) 4.795 9.635 ( -5.912 0.000 16.997) 17.995 9.665 ( -7.285 0.000 7.806) 10.677 9.675 ( -2.944 0.000 -0.708) 3.028 10.242 ( 1.149 0.000 -1.012) 1.531 12.527 ( -1.164 0.000 6.863) 6.961 12.914 ( 7.534 0.000 -18.834) 20.285 14.133 ( -5.432 0.000 14.279) 15.277 14.835 ( -60.733 0.000 -9.473) 61.468 16.981 ( 7.062 0.000 11.189) 13.231 17.176 ( 0.056 0.000 -0.298) 0.303 18.589 ( -0.635 0.000 -1.654) 1.772 18.728 (-129.219 0.000 -5.172) 129.322 22.402 ( 0.644 0.000 -5.724) 5.760 22.478 ( 0.815 0.000 0.895) 1.211 22.549 ( -6.137 0.000 -0.279) 6.143 23.150 ( 14.800 0.000 -0.735) 14.819 23.221 ( 93.626 0.000 3.030) 93.675 23.400 ( 0.700 0.000 -1.595) 1.742 24.032 ( 2.706 0.000 0.694) 2.794 24.400 ( 18.465 0.000 2.733) 18.666 ======================= Grid point 64 (22/136) ======================= q-point: ( 0.12 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.596 ( 20.983 0.000 7.322) 22.224 0.738 ( 5.614 0.000 21.104) 21.838 1.142 ( -8.631 0.000 46.706) 47.496 1.647 ( -6.053 0.000 13.984) 15.237 2.123 ( -9.909 0.000 -6.900) 12.074 2.202 ( -6.385 0.000 -2.703) 6.933 2.578 ( -2.287 0.000 0.483) 2.338 2.579 ( 3.977 0.000 -4.123) 5.729 2.691 ( 1.305 0.000 -4.182) 4.381 2.866 ( -0.019 0.000 -14.843) 14.843 2.917 ( -3.609 0.000 -1.136) 3.784 3.069 ( 9.143 0.000 -1.659) 9.292 3.114 ( 0.123 0.000 0.196) 0.231 3.190 ( -6.729 0.000 5.486) 8.682 3.427 ( -1.826 0.000 3.981) 4.380 3.478 ( 2.852 0.000 -8.523) 8.988 3.704 ( 9.767 0.000 -3.239) 10.290 3.883 ( 5.783 0.000 -1.449) 5.962 4.074 ( 6.100 0.000 -2.727) 6.682 4.138 ( -4.174 0.000 0.382) 4.192 4.257 ( 1.328 0.000 0.297) 1.361 4.522 ( 3.439 0.000 0.992) 3.579 4.633 ( -4.849 0.000 7.825) 9.205 4.718 ( -3.679 0.000 8.281) 9.062 5.120 ( 17.967 0.000 -14.324) 22.979 5.181 ( 0.846 0.000 -0.317) 0.904 5.255 ( -5.181 0.000 12.790) 13.800 5.519 ( 15.338 0.000 -8.329) 17.454 5.856 ( -5.701 0.000 -0.048) 5.701 5.937 ( 1.543 0.000 -7.068) 7.235 6.228 ( -2.992 0.000 -0.928) 3.132 6.507 ( -0.170 0.000 -9.026) 9.028 6.655 ( 4.059 0.000 3.691) 5.486 7.046 ( 0.946 0.000 0.059) 0.948 7.069 ( 1.925 0.000 3.900) 4.349 7.625 ( 0.920 0.000 -3.942) 4.048 7.710 ( 1.265 0.000 -0.807) 1.500 7.735 ( 0.550 0.000 -1.024) 1.163 7.882 ( 3.434 0.000 -5.362) 6.368 7.966 ( -3.081 0.000 -2.131) 3.746 8.412 ( -1.655 0.000 -5.114) 5.375 8.572 ( -0.799 0.000 -11.103) 11.132 8.703 ( 2.634 0.000 -6.995) 7.474 8.949 ( 0.448 0.000 -0.747) 0.872 9.297 ( -1.899 0.000 3.375) 3.872 9.503 ( -3.733 0.000 6.652) 7.628 9.572 ( -6.475 0.000 1.988) 6.773 9.604 ( -2.244 0.000 5.766) 6.187 9.634 ( -7.215 0.000 17.312) 18.755 10.239 ( -0.965 0.000 -0.523) 1.098 12.523 ( -10.122 0.000 10.479) 14.570 12.921 ( 7.327 0.000 -18.577) 19.970 13.097 ( -89.743 0.000 62.516) 109.371 14.135 ( -5.221 0.000 14.250) 15.176 17.096 ( -22.441 0.000 16.252) 27.708 17.173 ( -0.031 0.000 -0.318) 0.320 17.378 ( -7.023 0.000 19.666) 20.882 18.407 ( -15.268 0.000 -1.988) 15.397 22.335 ( -1.974 0.000 -7.830) 8.075 22.513 ( 0.274 0.000 2.070) 2.088 22.639 ( 13.571 0.000 1.164) 13.621 23.247 ( 4.352 0.000 -0.371) 4.368 23.406 ( 1.026 0.000 -1.527) 1.840 23.615 ( -9.945 0.000 -9.522) 13.769 24.165 ( 9.145 0.000 -0.949) 9.194 25.577 ( 61.150 0.000 -38.937) 72.494 ======================= Grid point 65 (23/136) ======================= q-point: ( 0.25 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.999 ( 6.556 0.000 15.001) 16.371 1.065 ( 20.032 0.000 7.277) 21.312 1.332 ( -4.094 0.000 35.739) 35.973 1.654 ( -4.001 0.000 14.093) 14.650 1.870 ( -10.130 0.000 -5.388) 11.473 2.058 ( -4.361 0.000 -4.968) 6.610 2.516 ( -4.320 0.000 1.552) 4.591 2.619 ( 2.929 0.000 -6.358) 7.000 2.704 ( 2.607 0.000 -3.221) 4.144 2.741 ( -10.871 0.000 -0.121) 10.872 2.804 ( 1.354 0.000 -6.565) 6.704 3.093 ( -1.916 0.000 -0.705) 2.041 3.102 ( -5.267 0.000 3.893) 6.549 3.274 ( 10.298 0.000 -0.236) 10.301 3.460 ( 2.162 0.000 2.419) 3.244 3.482 ( 4.071 0.000 -8.658) 9.567 3.867 ( 8.209 0.000 -0.592) 8.231 3.947 ( 5.848 0.000 -8.288) 10.144 4.045 ( -5.815 0.000 2.271) 6.243 4.170 ( 2.918 0.000 0.703) 3.001 4.286 ( 1.508 0.000 -0.581) 1.617 4.570 ( 2.251 0.000 -3.446) 4.116 4.598 ( -3.683 0.000 6.122) 7.145 4.719 ( -2.595 0.000 9.896) 10.231 5.154 ( -2.464 0.000 0.820) 2.597 5.232 ( -7.514 0.000 14.500) 16.331 5.247 ( 3.922 0.000 -6.065) 7.223 5.709 ( -2.390 0.000 -5.687) 6.169 5.800 ( 15.075 0.000 -13.005) 19.909 5.910 ( 1.238 0.000 -6.950) 7.059 6.159 ( -3.133 0.000 -1.067) 3.310 6.408 ( -3.082 0.000 -7.962) 8.538 6.777 ( 5.475 0.000 3.734) 6.627 7.056 ( -0.076 0.000 -0.677) 0.681 7.114 ( -0.048 0.000 2.952) 2.952 7.645 ( 3.461 0.000 -2.046) 4.021 7.711 ( -2.562 0.000 -1.141) 2.805 7.735 ( 1.882 0.000 -1.232) 2.249 7.879 ( -2.435 0.000 -3.660) 4.396 7.943 ( 5.857 0.000 -4.602) 7.449 8.332 ( -2.165 0.000 -5.231) 5.662 8.505 ( 1.627 0.000 -9.202) 9.344 8.690 ( 1.580 0.000 -7.774) 7.933 8.964 ( 1.334 0.000 -0.372) 1.385 9.276 ( -3.291 0.000 5.379) 6.306 9.436 ( -7.307 0.000 8.501) 11.210 9.500 ( -1.944 0.000 1.334) 2.358 9.614 ( -7.595 0.000 16.673) 18.322 9.655 ( 1.724 0.000 5.405) 5.674 10.196 ( -3.069 0.000 -0.532) 3.114 12.103 ( -34.843 0.000 37.715) 51.346 12.684 ( -8.005 0.000 16.516) 18.354 12.924 ( 7.023 0.000 -18.459) 19.750 14.140 ( -5.086 0.000 14.102) 14.991 16.748 ( -16.261 0.000 3.490) 16.631 17.171 ( 0.061 0.000 -0.287) 0.294 17.604 ( 3.378 0.000 20.991) 21.261 18.049 ( -18.452 0.000 -1.310) 18.498 22.241 ( -1.161 0.000 -7.944) 8.028 22.577 ( 3.093 0.000 5.357) 6.186 22.949 ( 16.141 0.000 0.451) 16.147 23.210 ( -7.126 0.000 -8.894) 11.396 23.402 ( -1.386 0.000 -4.592) 4.797 23.415 ( 0.881 0.000 -1.478) 1.721 24.377 ( 12.511 0.000 -1.208) 12.569 26.097 ( 22.264 0.000 -20.968) 30.584 ======================= Grid point 66 (24/136) ======================= q-point: ( 0.38 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.175 ( 1.593 0.000 10.112) 10.236 1.405 ( -2.688 0.000 31.369) 31.484 1.482 ( 5.971 0.000 1.933) 6.276 1.695 ( -3.071 0.000 15.540) 15.841 1.705 ( -4.599 0.000 1.480) 4.831 2.001 ( 1.557 0.000 -2.340) 2.810 2.375 ( -7.449 0.000 -24.720) 25.818 2.452 ( -3.958 0.000 3.596) 5.348 2.734 ( 2.530 0.000 -2.640) 3.657 2.787 ( 2.049 0.000 17.936) 18.053 2.803 ( 0.879 0.000 -0.207) 0.903 3.047 ( -3.508 0.000 5.131) 6.215 3.051 ( -1.448 0.000 -0.585) 1.562 3.429 ( 7.220 0.000 -4.926) 8.740 3.497 ( 3.628 0.000 -8.826) 9.542 3.513 ( 2.052 0.000 -0.588) 2.135 3.943 ( -3.236 0.000 0.008) 3.236 4.006 ( 6.602 0.000 -9.557) 11.616 4.019 ( 3.612 0.000 4.528) 5.792 4.186 ( -1.317 0.000 1.849) 2.270 4.295 ( -0.059 0.000 -0.869) 0.871 4.564 ( 0.160 0.000 -4.294) 4.297 4.583 ( -1.371 0.000 2.190) 2.584 4.754 ( -0.349 0.000 5.654) 5.665 5.095 ( -4.678 0.000 4.273) 6.336 5.178 ( -9.097 0.000 14.568) 17.175 5.249 ( 0.129 0.000 -2.655) 2.658 5.612 ( -1.267 0.000 -6.246) 6.373 5.887 ( 1.700 0.000 -7.091) 7.292 5.941 ( 6.852 0.000 -15.190) 16.664 6.105 ( -1.569 0.000 -0.416) 1.623 6.332 ( 3.242 0.000 -6.613) 7.365 6.906 ( 4.905 0.000 2.450) 5.483 7.022 ( -2.240 0.000 -2.303) 3.213 7.105 ( -2.351 0.000 1.102) 2.596 7.647 ( -1.870 0.000 -2.158) 2.856 7.715 ( 3.893 0.000 -0.572) 3.934 7.758 ( 2.241 0.000 -2.670) 3.486 7.813 ( -2.445 0.000 -0.047) 2.445 8.041 ( 7.366 0.000 -5.680) 9.302 8.261 ( -1.456 0.000 -4.540) 4.768 8.500 ( 5.038 0.000 -9.726) 10.954 8.651 ( 0.850 0.000 -8.843) 8.883 8.985 ( 1.184 0.000 -1.042) 1.577 9.264 ( -2.827 0.000 7.786) 8.283 9.370 ( -6.025 0.000 9.238) 11.029 9.499 ( -0.233 0.000 2.371) 2.382 9.592 ( -6.331 0.000 14.291) 15.631 9.726 ( 0.776 0.000 6.498) 6.544 10.123 ( -3.234 0.000 -1.165) 3.438 11.882 ( -15.477 0.000 29.236) 33.080 12.662 ( -5.391 0.000 10.649) 11.936 12.922 ( 6.787 0.000 -18.556) 19.758 14.144 ( -5.097 0.000 13.925) 14.829 16.525 ( -8.040 0.000 0.594) 8.062 17.173 ( 0.296 0.000 -0.225) 0.371 17.703 ( -6.386 0.000 11.283) 12.965 17.739 ( -11.700 0.000 -0.400) 11.707 22.181 ( 1.104 0.000 -8.396) 8.469 22.669 ( -0.947 0.000 7.656) 7.714 23.052 ( 1.382 0.000 -4.879) 5.071 23.219 ( 11.127 0.000 -0.535) 11.140 23.393 ( 1.485 0.000 -3.366) 3.679 23.411 ( -0.422 0.000 -1.435) 1.496 24.584 ( 8.591 0.000 -0.623) 8.613 26.265 ( 8.921 0.000 -11.629) 14.656 ======================= Grid point 67 (25/136) ======================= q-point: (-0.50 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( -5.649 0.000 6.997) 8.993 1.401 ( -15.748 0.000 23.314) 28.134 1.568 ( 2.646 0.000 -3.936) 4.742 1.666 ( -3.977 0.000 2.996) 4.979 1.760 ( -3.284 0.000 18.632) 18.920 2.067 ( 4.608 0.000 1.889) 4.980 2.169 ( 1.533 0.000 -10.160) 10.275 2.426 ( -1.559 0.000 4.423) 4.689 2.756 ( 1.244 0.000 -2.015) 2.368 2.835 ( 1.672 0.000 2.859) 3.312 2.966 ( 3.420 0.000 9.818) 10.397 3.037 ( 0.367 0.000 -0.384) 0.531 3.071 ( 1.341 0.000 11.700) 11.776 3.459 ( -0.876 0.000 -10.709) 10.745 3.490 ( 4.696 0.000 -8.151) 9.407 3.525 ( 0.214 0.000 -2.146) 2.156 3.874 ( -4.523 0.000 1.959) 4.929 4.023 ( 1.404 0.000 -7.890) 8.014 4.114 ( 2.394 0.000 4.379) 4.991 4.191 ( 1.444 0.000 -0.807) 1.654 4.288 ( 0.206 0.000 0.269) 0.339 4.503 ( -2.216 0.000 -6.776) 7.129 4.563 ( -1.653 0.000 0.287) 1.677 4.771 ( -1.154 0.000 2.206) 2.490 5.076 ( -0.940 0.000 6.227) 6.298 5.105 ( -8.359 0.000 13.379) 15.776 5.227 ( -0.288 0.000 -1.989) 2.010 5.560 ( 0.630 0.000 -8.694) 8.717 5.859 ( 0.454 0.000 -18.300) 18.305 5.870 ( 2.280 0.000 -7.895) 8.217 6.098 ( 0.719 0.000 0.711) 1.011 6.439 ( 9.221 0.000 -3.329) 9.804 6.912 ( -4.094 0.000 -3.425) 5.338 7.015 ( 2.608 0.000 0.125) 2.611 7.048 ( -3.390 0.000 -0.706) 3.463 7.627 ( 1.071 0.000 -1.210) 1.616 7.735 ( -1.566 0.000 1.885) 2.450 7.797 ( 0.524 0.000 1.290) 1.392 7.813 ( 4.827 0.000 -3.942) 6.232 8.120 ( 4.149 0.000 -4.563) 6.167 8.211 ( -0.287 0.000 -3.943) 3.953 8.557 ( 8.095 0.000 -9.437) 12.433 8.604 ( 1.827 0.000 -9.973) 10.139 8.992 ( 0.487 0.000 -1.507) 1.584 9.272 ( -2.561 0.000 7.778) 8.189 9.339 ( -4.315 0.000 9.470) 10.407 9.513 ( -2.711 0.000 9.307) 9.694 9.575 ( -4.440 0.000 9.225) 10.238 9.775 ( -1.003 0.000 7.444) 7.511 10.078 ( 0.231 0.000 -1.972) 1.985 11.887 ( -7.560 0.000 32.157) 33.034 12.627 ( -5.197 0.000 7.970) 9.515 12.915 ( 6.741 0.000 -18.816) 19.987 14.146 ( -5.232 0.000 13.826) 14.783 16.460 ( 0.839 0.000 1.307) 1.553 17.176 ( 0.101 0.000 -0.183) 0.209 17.529 ( -13.437 0.000 -3.325) 13.842 17.627 ( 0.614 0.000 0.326) 0.695 22.161 ( 3.342 0.000 -8.690) 9.310 22.630 ( -4.787 0.000 2.990) 5.644 23.220 ( 10.690 0.000 9.056) 14.010 23.359 ( -4.489 0.000 -1.389) 4.699 23.363 ( 4.751 0.000 -1.355) 4.941 23.398 ( 1.006 0.000 -1.290) 1.636 24.675 ( 0.738 0.000 0.202) 0.765 26.297 ( 3.222 0.000 -11.199) 11.653 ======================= Grid point 68 (26/136) ======================= q-point: (-0.38 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.064 ( -13.025 0.000 6.336) 14.485 1.212 ( -16.108 0.000 12.902) 20.638 1.553 ( 6.496 0.000 -15.807) 17.090 1.587 ( -13.218 0.000 17.174) 21.672 1.821 ( -6.167 0.000 20.932) 21.822 2.185 ( 4.481 0.000 5.512) 7.104 2.235 ( 5.050 0.000 5.671) 7.594 2.456 ( 1.741 0.000 2.808) 3.304 2.749 ( -0.419 0.000 -1.535) 1.591 2.920 ( 4.760 0.000 3.292) 5.788 3.052 ( 1.689 0.000 4.338) 4.655 3.052 ( 1.543 0.000 -1.042) 1.862 3.226 ( 2.315 0.000 5.256) 5.743 3.327 ( -2.790 0.000 -5.577) 6.236 3.495 ( -2.094 0.000 -0.738) 2.220 3.509 ( 4.016 0.000 -9.333) 10.160 3.785 ( -6.167 0.000 1.791) 6.422 3.962 ( -2.424 0.000 -5.606) 6.108 4.176 ( 0.401 0.000 -10.399) 10.407 4.181 ( 1.272 0.000 5.226) 5.379 4.303 ( -1.002 0.000 1.558) 1.852 4.420 ( 0.877 0.000 -6.694) 6.751 4.547 ( -1.616 0.000 6.266) 6.471 4.729 ( -4.173 0.000 0.161) 4.176 5.078 ( -3.755 0.000 11.895) 12.474 5.136 ( 2.765 0.000 3.584) 4.527 5.211 ( 0.444 0.000 -3.417) 3.445 5.462 ( -1.259 0.000 -17.953) 17.997 5.782 ( 4.887 0.000 -14.470) 15.273 5.863 ( 3.435 0.000 -8.689) 9.344 6.135 ( 2.145 0.000 1.318) 2.517 6.579 ( 6.700 0.000 -2.613) 7.191 6.797 ( -4.737 0.000 -3.349) 5.801 6.975 ( -3.196 0.000 -1.257) 3.434 7.041 ( 0.499 0.000 -1.409) 1.495 7.656 ( 2.289 0.000 -1.024) 2.507 7.710 ( -2.746 0.000 3.418) 4.384 7.848 ( 1.176 0.000 -3.507) 3.698 7.849 ( 3.413 0.000 1.564) 3.754 8.121 ( -1.117 0.000 -3.289) 3.473 8.204 ( 2.559 0.000 -3.247) 4.134 8.590 ( 4.659 0.000 -10.465) 11.455 8.668 ( 10.193 0.000 -9.532) 13.956 8.979 ( -1.041 0.000 -0.997) 1.442 9.276 ( -1.762 0.000 5.364) 5.646 9.340 ( -2.640 0.000 8.891) 9.275 9.530 ( -5.934 0.000 17.885) 18.844 9.566 ( -1.609 0.000 5.723) 5.944 9.795 ( -2.867 0.000 8.154) 8.643 10.103 ( 3.599 0.000 -2.514) 4.390 12.083 ( -2.128 0.000 51.378) 51.422 12.581 ( -4.810 0.000 6.462) 8.056 12.908 ( 6.927 0.000 -19.079) 20.297 14.145 ( -5.418 0.000 13.861) 14.882 16.579 ( 8.928 0.000 5.194) 10.329 17.174 ( -0.063 0.000 -0.165) 0.176 17.201 ( -12.790 0.000 -12.102) 17.608 17.767 ( 12.863 0.000 0.708) 12.882 22.183 ( 5.442 0.000 -8.425) 10.030 22.572 ( -3.365 0.000 3.103) 4.577 23.196 ( -11.512 0.000 -1.458) 11.604 23.353 ( 0.796 0.000 -5.460) 5.518 23.406 ( 1.419 0.000 -1.671) 2.192 23.549 ( 7.378 0.000 17.720) 19.194 24.619 ( -6.979 0.000 1.790) 7.205 26.215 ( -0.473 0.000 -20.448) 20.454 ======================= Grid point 69 (27/136) ======================= q-point: (-0.25 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.819 ( -17.566 0.000 10.040) 20.233 0.965 ( -19.612 0.000 12.637) 23.331 1.373 ( -25.632 0.000 29.760) 39.277 1.695 ( 20.869 0.000 -17.489) 27.229 1.815 ( -9.701 0.000 19.652) 21.916 2.300 ( 2.063 0.000 6.711) 7.021 2.391 ( 4.152 0.000 8.752) 9.687 2.524 ( 3.547 0.000 0.771) 3.630 2.726 ( -0.650 0.000 -1.519) 1.653 3.023 ( -4.368 0.000 -10.741) 11.595 3.040 ( 2.936 0.000 1.384) 3.246 3.089 ( 6.343 0.000 -4.281) 7.653 3.190 ( -0.010 0.000 5.967) 5.967 3.382 ( 2.512 0.000 0.850) 2.652 3.443 ( -3.983 0.000 4.388) 5.926 3.510 ( 3.481 0.000 -10.543) 11.103 3.661 ( -8.467 0.000 2.563) 8.847 3.834 ( -6.280 0.000 -6.514) 9.048 4.092 ( 0.871 0.000 -12.156) 12.187 4.236 ( -0.878 0.000 -1.302) 1.570 4.254 ( -1.663 0.000 5.562) 5.805 4.454 ( 2.445 0.000 -0.014) 2.445 4.590 ( -0.855 0.000 10.063) 10.100 4.624 ( -3.983 0.000 -4.716) 6.173 5.124 ( -0.495 0.000 10.443) 10.455 5.150 ( -1.916 0.000 -18.880) 18.977 5.202 ( 1.750 0.000 -0.569) 1.840 5.298 ( -0.353 0.000 -11.027) 11.033 5.819 ( 6.426 0.000 -7.435) 9.828 5.878 ( 4.710 0.000 -8.763) 9.949 6.194 ( 2.736 0.000 1.528) 3.134 6.639 ( 2.664 0.000 -6.312) 6.852 6.690 ( -4.258 0.000 -1.874) 4.652 6.922 ( -1.684 0.000 1.018) 1.968 7.026 ( -0.319 0.000 -1.910) 1.936 7.690 ( -1.691 0.000 3.150) 3.575 7.691 ( 2.318 0.000 -1.651) 2.846 7.810 ( -1.846 0.000 -3.815) 4.238 7.925 ( 2.355 0.000 0.975) 2.549 8.050 ( -2.667 0.000 -3.234) 4.192 8.265 ( 5.772 0.000 -2.518) 6.297 8.622 ( 5.765 0.000 -9.407) 11.033 8.787 ( 9.766 0.000 -13.551) 16.703 8.939 ( -2.713 0.000 1.575) 3.137 9.293 ( -0.144 0.000 3.807) 3.809 9.366 ( -0.925 0.000 7.429) 7.486 9.562 ( -3.651 0.000 17.318) 17.698 9.596 ( -1.498 0.000 9.940) 10.052 9.784 ( -4.646 0.000 8.514) 9.699 10.162 ( 3.971 0.000 -2.413) 4.647 12.525 ( -1.903 0.000 6.533) 6.804 12.718 ( 14.071 0.000 97.454) 98.464 12.905 ( 7.252 0.000 -19.185) 20.510 14.140 ( -5.564 0.000 14.004) 15.069 16.892 ( 14.815 0.000 18.570) 23.756 16.921 ( -5.346 0.000 -9.667) 11.046 17.174 ( 0.133 0.000 -0.185) 0.227 18.095 ( 19.241 0.000 0.544) 19.248 22.245 ( 7.022 0.000 -8.335) 10.898 22.546 ( -1.871 0.000 3.766) 4.205 22.908 ( -16.361 0.000 -1.189) 16.404 23.291 ( -3.024 0.000 -4.916) 5.772 23.409 ( 0.398 0.000 -1.726) 1.771 23.766 ( 3.107 0.000 10.254) 10.714 24.452 ( -11.905 0.000 3.608) 12.440 25.905 ( -9.775 0.000 -47.508) 48.504 ======================= Grid point 70 (28/136) ======================= q-point: (-0.12 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.580 ( -16.520 0.000 19.278) 25.388 0.634 ( -23.214 0.000 10.518) 25.486 1.113 ( -27.291 0.000 45.132) 52.742 1.751 ( -10.384 0.000 17.312) 20.187 2.040 ( 23.940 0.000 -12.805) 27.150 2.347 ( -1.157 0.000 3.658) 3.836 2.477 ( -0.520 0.000 3.252) 3.293 2.586 ( 1.808 0.000 0.404) 1.853 2.711 ( 0.773 0.000 -2.485) 2.602 2.876 ( -1.348 0.000 -8.323) 8.431 3.045 ( 0.411 0.000 -4.023) 4.044 3.171 ( 3.483 0.000 -9.810) 10.410 3.240 ( -1.428 0.000 0.442) 1.495 3.384 ( -1.940 0.000 -0.360) 1.974 3.444 ( -5.299 0.000 -4.845) 7.180 3.454 ( 0.616 0.000 9.462) 9.482 3.522 ( -2.242 0.000 -3.914) 4.511 3.668 ( -5.898 0.000 -0.765) 5.947 4.042 ( 2.652 0.000 -11.342) 11.648 4.151 ( -6.218 0.000 2.247) 6.612 4.280 ( -0.522 0.000 -1.500) 1.588 4.427 ( -3.373 0.000 2.580) 4.246 4.592 ( 3.525 0.000 -3.286) 4.819 4.640 ( -1.925 0.000 10.033) 10.216 4.888 ( -8.658 0.000 -9.111) 12.568 5.193 ( -0.499 0.000 10.071) 10.083 5.196 ( -0.851 0.000 -0.413) 0.946 5.311 ( 3.539 0.000 -2.177) 4.155 5.892 ( 4.713 0.000 -3.784) 6.044 5.913 ( 5.059 0.000 -8.056) 9.513 6.254 ( 1.838 0.000 1.661) 2.478 6.605 ( 0.185 0.000 -7.995) 7.997 6.608 ( -2.967 0.000 -0.669) 3.041 6.933 ( 0.904 0.000 3.461) 3.577 7.014 ( 0.374 0.000 -0.978) 1.047 7.685 ( -0.001 0.000 -1.192) 1.192 7.721 ( 2.046 0.000 -1.836) 2.749 7.741 ( -1.796 0.000 -3.933) 4.323 7.905 ( -2.597 0.000 -2.189) 3.396 8.028 ( 1.335 0.000 -1.555) 2.049 8.372 ( 7.447 0.000 -5.192) 9.078 8.664 ( 4.919 0.000 -7.940) 9.340 8.788 ( 0.697 0.000 -12.728) 12.747 8.941 ( 2.647 0.000 -2.375) 3.556 9.309 ( -1.000 0.000 3.018) 3.179 9.411 ( 0.622 0.000 5.599) 5.634 9.614 ( -4.563 0.000 16.590) 17.206 9.663 ( 1.868 0.000 5.121) 5.451 9.739 ( -6.329 0.000 8.380) 10.501 10.213 ( 2.800 0.000 -1.690) 3.271 12.511 ( -2.081 0.000 5.264) 5.660 12.907 ( 7.508 0.000 -19.082) 20.506 14.136 ( -5.576 0.000 14.176) 15.233 14.346 ( 65.849 0.000 89.607) 111.200 16.837 ( 2.299 0.000 -0.152) 2.304 17.175 ( 0.167 0.000 -0.241) 0.293 17.842 ( 68.369 0.000 89.104) 112.311 18.447 ( 14.919 0.000 -0.396) 14.924 22.311 ( 5.719 0.000 -9.176) 10.813 22.557 ( -0.114 0.000 4.212) 4.213 22.603 ( -12.785 0.000 -0.273) 12.788 23.183 ( -3.930 0.000 -3.632) 5.352 23.402 ( 0.349 0.000 -1.673) 1.709 23.683 ( -23.694 0.000 -29.844) 38.106 24.181 ( -17.376 0.000 -5.098) 18.108 24.907 ( -46.935 0.000 -61.815) 77.614 ======================= Grid point 71 (29/136) ======================= q-point: ( 0.00 0.17 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.499 ( -9.286 13.579 10.646) 19.595 0.778 ( -4.190 19.296 16.560) 25.771 1.352 ( -12.480 24.366 35.376) 44.732 1.856 ( -3.189 -0.973 -3.611) 4.915 2.009 ( -5.126 -9.647 -0.814) 10.954 2.477 ( 16.618 3.625 -12.261) 20.968 2.568 ( -2.646 5.785 -1.591) 6.557 2.730 ( -0.307 6.464 -2.377) 6.894 2.779 ( 3.398 -2.629 -8.294) 9.341 2.845 ( 0.921 3.337 -4.368) 5.574 2.961 ( 0.103 -6.265 -3.466) 7.161 3.049 ( -3.424 -1.265 -0.819) 3.741 3.223 ( -4.677 1.702 -2.801) 5.712 3.308 ( -6.978 -2.570 4.380) 8.630 3.412 ( -2.785 4.962 0.466) 5.709 3.585 ( 8.125 4.612 -9.045) 13.004 3.697 ( 9.328 1.560 8.133) 12.474 3.762 ( -1.504 17.054 -5.921) 18.115 4.009 ( 3.219 -1.507 -10.857) 11.424 4.074 ( -3.676 -4.681 8.864) 10.677 4.225 ( 0.019 -1.611 -1.166) 1.989 4.431 ( 0.315 -0.725 4.370) 4.441 4.613 ( 0.308 -2.468 3.227) 4.074 4.699 ( 0.482 1.008 6.838) 6.928 4.790 ( 0.343 -0.438 4.716) 4.749 5.095 ( -0.069 -7.860 -0.816) 7.902 5.259 ( 3.824 -4.925 2.000) 6.548 5.307 ( -3.088 0.844 6.244) 7.017 5.705 ( -0.229 -12.094 -0.068) 12.097 6.029 ( -2.698 -11.218 -8.485) 14.322 6.348 ( 11.974 6.472 -17.055) 21.821 6.597 ( 1.321 0.092 -3.125) 3.394 6.689 ( 3.123 6.522 -2.674) 7.709 7.011 ( 0.920 5.332 2.564) 5.987 7.198 ( 2.482 10.029 -10.194) 14.514 7.633 ( 0.064 -1.730 -4.233) 4.573 7.653 ( -0.836 -2.834 -2.864) 4.115 7.799 ( 0.798 2.913 -1.705) 3.469 7.996 ( 3.964 8.637 -12.837) 15.972 8.046 ( 0.382 2.401 -3.669) 4.401 8.360 ( 3.395 -5.719 -8.692) 10.944 8.511 ( 3.033 -4.965 -9.233) 10.913 8.754 ( 0.525 -1.529 -2.357) 2.859 8.976 ( 4.195 -0.287 -9.653) 10.529 9.338 ( -1.524 2.716 3.048) 4.358 9.498 ( 0.634 2.407 2.071) 3.238 9.655 ( -7.719 1.739 11.614) 14.053 9.701 ( -5.521 3.701 8.275) 10.614 9.837 ( -5.362 13.602 13.040) 19.591 10.208 ( 0.848 -2.873 0.262) 3.007 12.102 ( -8.969 -20.896 18.091) 29.058 12.729 ( -10.979 -13.568 31.611) 36.110 13.984 ( 0.395 11.118 -8.681) 14.111 15.447 ( -13.001 17.359 -18.094) 28.245 16.697 ( 4.935 -13.259 -4.376) 14.809 17.122 ( -2.637 -5.732 8.774) 10.807 18.621 ( -1.255 2.903 -1.763) 3.621 18.962 ( -62.119 6.885 -13.968) 64.042 22.431 ( 5.302 3.201 -4.762) 7.813 22.478 ( -4.782 0.048 -1.183) 4.926 22.586 ( -0.240 2.706 0.770) 2.824 22.928 ( 51.923 -11.621 15.837) 55.515 23.157 ( 5.087 -0.850 1.190) 5.293 23.372 ( 0.483 -2.617 -1.883) 3.260 24.044 ( 2.022 1.197 0.934) 2.529 24.338 ( 1.458 -3.633 4.027) 5.616 ======================= Grid point 72 (30/136) ======================= q-point: ( 0.12 0.17 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.630 ( 14.016 4.811 6.535) 16.195 0.885 ( 1.928 13.785 15.848) 21.093 1.421 ( -6.660 18.286 30.252) 35.971 1.754 ( -5.227 -0.541 1.052) 5.359 1.873 ( -6.522 -3.563 -2.023) 7.702 2.474 ( -5.009 8.311 -3.960) 10.481 2.583 ( 2.012 2.297 -5.295) 6.112 2.672 ( -2.981 5.016 -1.248) 5.967 2.770 ( 1.539 5.838 -8.682) 10.575 2.872 ( 4.304 -0.209 -10.043) 10.928 2.937 ( -3.470 -2.543 -0.341) 4.316 2.977 ( 2.157 -1.464 -3.403) 4.287 3.178 ( -0.935 0.966 5.076) 5.251 3.236 ( -3.679 -2.592 5.857) 7.386 3.389 ( 2.134 3.585 -6.186) 7.462 3.630 ( -2.584 10.613 -2.022) 11.109 3.747 ( 8.184 5.798 -6.986) 12.223 3.893 ( 6.057 1.408 0.444) 6.234 4.023 ( 4.430 -4.842 -3.454) 7.417 4.059 ( -3.242 -5.858 4.193) 7.900 4.245 ( 1.772 -0.872 0.945) 2.190 4.495 ( 2.614 -2.640 3.885) 5.375 4.640 ( -1.564 0.419 5.458) 5.694 4.719 ( -3.198 1.714 5.637) 6.704 4.893 ( 7.568 -10.374 0.920) 12.874 5.083 ( -0.992 -9.091 -0.356) 9.152 5.279 ( -5.563 0.133 9.012) 10.591 5.366 ( 5.487 -5.626 2.142) 8.145 5.678 ( -1.508 -10.045 -2.121) 10.377 5.922 ( -0.676 -10.620 -8.742) 13.772 6.422 ( 6.134 6.849 -13.053) 15.966 6.596 ( 0.329 3.335 -4.797) 5.852 6.716 ( 2.271 4.064 -2.098) 5.107 7.043 ( 0.717 1.028 1.926) 2.298 7.188 ( 3.244 10.341 -7.759) 13.329 7.599 ( -0.177 -1.792 -3.321) 3.778 7.657 ( 3.382 -4.452 -3.661) 6.683 7.793 ( -0.081 2.079 -1.667) 2.666 7.981 ( 3.836 7.949 -11.223) 14.278 8.007 ( -1.539 4.456 -4.506) 6.521 8.324 ( -1.277 -7.409 -4.545) 8.785 8.479 ( 0.593 -0.398 -9.272) 9.300 8.778 ( 3.718 -0.308 -3.148) 4.881 8.973 ( 1.874 1.178 -6.773) 7.126 9.327 ( -1.903 2.486 3.276) 4.531 9.507 ( -1.805 1.352 0.593) 2.332 9.587 ( -5.961 0.664 8.988) 10.805 9.647 ( -5.962 5.541 9.878) 12.800 9.816 ( -7.115 13.226 14.670) 20.994 10.206 ( -1.532 -2.654 0.918) 3.199 12.034 ( -14.023 -18.385 23.076) 32.667 12.682 ( -17.068 -11.836 29.619) 36.176 13.817 ( -6.837 27.803 -22.405) 36.355 14.755 ( -35.236 42.802 3.633) 55.559 16.716 ( -0.104 -22.058 -2.533) 22.203 17.016 ( -17.465 -7.536 13.831) 23.519 17.900 ( -21.381 25.905 8.930) 34.755 18.429 ( -15.785 1.817 -1.217) 15.936 22.358 ( -1.592 1.720 -6.769) 7.163 22.537 ( 2.842 2.555 1.154) 3.992 22.695 ( 11.124 4.605 0.234) 12.041 23.220 ( 4.310 -2.332 -0.311) 4.911 23.370 ( 0.990 -3.336 -1.843) 3.938 23.506 ( -3.546 -9.262 -5.868) 11.523 24.178 ( 9.795 1.320 -0.378) 9.891 25.074 ( 54.978 -31.780 -7.866) 63.988 ======================= Grid point 73 (31/136) ======================= q-point: ( 0.25 0.17 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.968 ( 8.666 -0.523 7.999) 11.805 1.069 ( 11.806 1.263 5.929) 13.272 1.462 ( -7.458 0.486 16.537) 18.147 1.720 ( -2.722 9.775 11.995) 15.711 1.788 ( -2.034 4.921 3.581) 6.417 2.334 ( -4.951 12.114 -4.515) 13.844 2.548 ( -2.760 1.233 -1.438) 3.348 2.638 ( -0.843 3.591 4.372) 5.720 2.674 ( -4.513 2.283 -14.034) 14.917 2.844 ( 1.074 3.395 -8.223) 8.961 2.873 ( -1.417 3.947 2.190) 4.731 3.019 ( 1.308 -4.617 -0.667) 4.845 3.169 ( -4.328 3.242 7.486) 9.235 3.303 ( 5.933 -6.156 0.276) 8.554 3.398 ( 4.602 4.139 -7.745) 9.915 3.560 ( -2.034 7.422 -1.937) 7.936 3.871 ( 7.141 -1.445 -5.751) 9.282 3.945 ( 1.735 -0.134 -0.929) 1.973 4.024 ( -0.807 -0.211 1.427) 1.653 4.121 ( 3.956 -3.877 1.539) 5.749 4.282 ( 1.148 -0.535 0.079) 1.269 4.561 ( 1.674 -1.298 1.108) 2.390 4.641 ( -1.180 3.319 2.761) 4.476 4.695 ( -3.534 -0.776 8.586) 9.317 5.020 ( 1.327 -15.008 -0.203) 15.068 5.051 ( 1.185 -10.038 -0.614) 10.127 5.222 ( -7.544 -1.883 10.310) 12.913 5.476 ( 3.372 -7.419 1.903) 8.369 5.631 ( -0.885 -6.423 -3.460) 7.349 5.903 ( 5.081 -8.418 -7.167) 12.167 6.395 ( 0.850 8.463 -10.232) 13.305 6.525 ( -2.350 7.729 -8.320) 11.597 6.752 ( 2.059 -3.690 -0.512) 4.256 7.072 ( 1.994 -0.225 -1.238) 2.358 7.194 ( 1.004 9.679 -2.931) 10.163 7.591 ( 1.575 -3.843 -2.797) 5.007 7.698 ( 2.381 -3.123 -2.690) 4.760 7.780 ( 0.326 2.778 -1.482) 3.165 7.925 ( -3.328 5.427 -3.365) 7.201 7.996 ( 5.669 5.558 -8.844) 11.885 8.270 ( -1.695 -7.602 -1.829) 8.001 8.410 ( 0.342 -0.102 -10.678) 10.684 8.824 ( 4.067 3.383 -7.018) 8.789 8.962 ( 0.661 0.987 -1.876) 2.221 9.314 ( -2.309 2.830 4.459) 5.764 9.451 ( -3.767 1.847 2.088) 4.686 9.542 ( -5.604 4.000 9.806) 11.981 9.659 ( 0.093 0.998 6.519) 6.596 9.782 ( -7.731 12.595 15.486) 21.406 10.161 ( -3.763 -2.885 0.759) 4.802 11.909 ( -16.432 -9.521 25.978) 32.180 12.551 ( -12.766 -9.345 17.756) 23.782 13.526 ( -1.997 39.040 -23.313) 45.514 14.413 ( -12.603 24.391 15.100) 31.333 16.588 ( -10.619 -16.060 -4.503) 19.773 16.847 ( -6.189 -19.317 8.849) 22.130 17.860 ( -1.582 14.409 13.739) 19.971 18.087 ( -17.306 3.115 0.764) 17.601 22.283 ( -0.672 3.792 -7.094) 8.072 22.617 ( 3.588 3.184 4.377) 6.493 22.953 ( 13.911 0.392 -0.867) 13.943 23.197 ( -5.647 -1.220 -8.537) 10.309 23.355 ( -0.979 -3.950 -3.550) 5.400 23.380 ( 1.016 -3.075 -1.509) 3.573 24.418 ( 13.853 4.005 -0.252) 14.422 25.784 ( 27.001 -24.687 -10.276) 38.001 ======================= Grid point 74 (32/136) ======================= q-point: ( 0.38 0.17 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.053 ( -0.701 -6.941 6.490) 9.528 1.375 ( 13.188 -8.337 -2.230) 15.761 1.450 ( -5.604 0.971 16.581) 17.529 1.759 ( -2.691 14.809 12.808) 19.764 1.836 ( -1.019 6.665 12.919) 14.572 2.258 ( -0.101 12.913 -1.576) 13.009 2.357 ( -8.959 4.080 -21.493) 23.640 2.523 ( -3.289 2.923 1.809) 4.757 2.709 ( 3.046 0.757 7.339) 7.982 2.824 ( 1.371 2.779 -3.476) 4.656 2.896 ( 0.354 2.858 4.570) 5.402 3.024 ( -0.119 -2.308 0.455) 2.356 3.142 ( -3.856 7.047 7.689) 11.119 3.374 ( 4.819 -8.806 -9.277) 13.668 3.474 ( 5.104 2.269 -1.537) 5.793 3.524 ( 0.832 3.554 -4.213) 5.574 3.870 ( -1.773 -6.065 -2.185) 6.686 4.023 ( 3.441 1.492 3.269) 4.975 4.037 ( 1.796 -0.173 -3.652) 4.074 4.189 ( 2.233 0.882 2.293) 3.320 4.284 ( -0.616 -0.968 -0.496) 1.250 4.570 ( 0.068 0.974 -2.127) 2.340 4.624 ( -1.925 3.386 -0.571) 3.937 4.726 ( -0.211 -2.274 7.453) 7.795 4.957 ( -4.798 -11.594 4.009) 13.172 5.110 ( 3.187 -11.601 -5.660) 13.295 5.146 ( -7.902 -4.128 11.614) 14.642 5.520 ( 2.443 -7.787 -3.005) 8.697 5.585 ( -2.684 -3.477 -1.157) 4.543 5.990 ( 6.045 -5.485 -2.702) 8.598 6.347 ( 3.429 9.032 -12.513) 15.809 6.407 ( -2.494 7.880 -7.594) 11.224 6.776 ( 0.609 -9.671 -0.637) 9.711 7.101 ( 2.802 4.346 -3.124) 6.041 7.176 ( -1.758 5.469 -0.372) 5.756 7.605 ( 1.749 -4.600 -3.376) 5.968 7.698 ( -0.477 1.643 -0.017) 1.711 7.788 ( 0.859 2.218 -1.463) 2.793 7.863 ( 0.008 2.979 -2.569) 3.934 8.068 ( 7.186 2.971 -6.921) 10.410 8.223 ( -2.023 -4.417 -1.854) 5.200 8.360 ( 3.262 -4.745 -10.739) 12.186 8.814 ( 1.762 7.054 -10.080) 12.429 8.975 ( 1.023 -0.456 -0.059) 1.122 9.304 ( -2.551 3.105 5.106) 6.497 9.415 ( -2.530 3.154 5.598) 6.905 9.532 ( -2.241 4.233 7.846) 9.192 9.715 ( 0.321 -0.848 6.710) 6.771 9.749 ( -7.473 12.297 15.585) 21.212 10.084 ( -3.837 -3.398 -0.242) 5.131 11.821 ( -11.031 -3.801 23.802) 26.508 12.469 ( -6.485 -10.672 9.832) 15.894 13.399 ( 3.303 33.515 -17.764) 38.075 14.346 ( -6.960 18.041 14.549) 24.199 16.368 ( -7.164 -14.439 -2.877) 16.373 16.821 ( -2.647 -25.026 3.848) 25.458 17.788 ( -10.182 5.533 0.497) 11.599 17.902 ( -6.928 9.950 8.028) 14.541 22.232 ( 1.100 4.694 -7.855) 9.217 22.705 ( -0.822 2.703 6.263) 6.871 23.057 ( 2.502 0.411 -4.890) 5.508 23.185 ( 8.788 -2.642 -1.023) 9.233 23.360 ( 2.629 -3.054 -2.857) 4.940 23.382 ( -0.303 -2.489 -0.685) 2.599 24.650 ( 9.075 6.199 -0.224) 10.992 26.064 ( 10.702 -17.106 -8.096) 21.742 ======================= Grid point 75 (33/136) ======================= q-point: (-0.50 0.17 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.110 ( 0.955 -5.156 7.501) 9.152 1.409 ( -8.456 0.204 10.611) 13.569 1.501 ( -0.257 -4.585 0.329) 4.604 1.824 ( -3.225 14.476 17.717) 23.105 1.905 ( -1.685 6.970 12.724) 14.605 2.047 ( -4.283 3.712 -20.838) 21.595 2.306 ( 4.516 9.386 1.424) 10.512 2.501 ( -1.772 4.210 4.638) 6.510 2.809 ( 2.721 2.156 -0.425) 3.498 2.856 ( 3.371 1.183 2.270) 4.232 2.948 ( 1.620 -0.250 4.261) 4.565 3.025 ( -0.468 -1.827 0.759) 2.033 3.161 ( -0.368 7.598 10.523) 12.984 3.365 ( 2.037 -8.745 -11.517) 14.604 3.492 ( 0.364 -2.023 -1.618) 2.616 3.559 ( 3.303 7.725 -4.496) 9.529 3.819 ( -2.492 -5.065 -0.417) 5.661 4.016 ( -0.792 -1.985 -2.774) 3.502 4.089 ( 0.500 0.112 2.884) 2.929 4.251 ( 1.836 2.869 1.549) 3.742 4.277 ( 1.302 -0.190 0.082) 1.319 4.525 ( -2.387 2.118 -6.496) 7.237 4.561 ( -3.201 0.222 -0.000) 3.209 4.759 ( -0.746 -0.579 2.682) 2.843 4.941 ( -0.800 -10.623 5.933) 12.194 5.060 ( -5.425 -4.095 6.800) 9.615 5.120 ( -0.205 -12.737 -3.877) 13.316 5.498 ( -4.879 -0.750 -1.530) 5.168 5.552 ( 3.602 -6.884 -4.431) 8.944 6.043 ( 0.866 -3.999 -1.463) 4.345 6.286 ( 2.799 15.844 -15.979) 22.676 6.427 ( 6.323 -1.229 -2.945) 7.083 6.764 ( -0.046 -10.414 -3.009) 10.840 7.114 ( -1.426 7.701 -3.471) 8.567 7.148 ( 1.854 3.670 -0.654) 4.163 7.609 ( 1.438 -0.735 -2.466) 2.948 7.712 ( 1.142 -0.608 1.299) 1.834 7.777 ( -0.809 2.277 0.516) 2.471 7.884 ( 3.288 1.188 -3.279) 4.793 8.148 ( 5.084 2.017 -5.089) 7.470 8.170 ( -1.170 -2.462 -3.107) 4.133 8.380 ( 5.959 -7.604 -9.134) 13.295 8.769 ( 2.261 6.597 -10.946) 12.978 8.982 ( -0.270 -0.974 -0.807) 1.293 9.288 ( -2.171 2.748 3.638) 5.049 9.432 ( -1.689 5.085 8.750) 10.260 9.559 ( -1.188 4.481 8.146) 9.373 9.718 ( -7.564 12.285 15.684) 21.310 9.762 ( -1.019 -1.074 7.677) 7.818 10.036 ( 0.023 -3.696 -1.316) 3.923 11.834 ( -6.654 -3.540 26.097) 27.163 12.432 ( -4.193 -10.779 8.104) 14.123 13.375 ( 7.263 32.680 -16.357) 37.260 14.337 ( -5.203 17.027 14.643) 23.052 16.308 ( 2.544 -14.031 -0.642) 14.275 16.782 ( -3.364 -26.153 0.924) 26.385 17.679 ( -0.379 5.056 -0.584) 5.104 17.755 ( -9.528 10.538 -2.218) 14.379 22.212 ( 2.966 4.630 -8.354) 10.001 22.665 ( -4.130 2.538 1.630) 5.114 23.211 ( 8.259 -1.459 4.256) 9.405 23.294 ( 4.517 -3.486 2.746) 6.332 23.345 ( -3.363 -1.329 -0.773) 3.698 23.406 ( 2.515 -0.883 0.074) 2.666 24.738 ( 0.067 5.991 -0.273) 5.997 26.112 ( 1.205 -15.918 -9.637) 18.647 ======================= Grid point 76 (34/136) ======================= q-point: (-0.38 0.17 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.124 ( -5.863 6.409 4.569) 9.814 1.265 ( -12.298 3.489 6.687) 14.427 1.497 ( -1.265 -4.644 8.059) 9.387 1.802 ( -5.788 18.091 5.463) 19.764 1.936 ( -0.646 5.166 4.355) 6.788 1.984 ( 0.108 -3.570 6.256) 7.204 2.430 ( 6.217 6.589 2.859) 9.499 2.518 ( 0.203 4.508 4.248) 6.198 2.835 ( 1.863 1.638 -2.913) 3.826 2.948 ( 3.561 1.748 2.518) 4.699 2.997 ( 0.478 -2.207 -0.148) 2.263 3.028 ( 1.044 -0.622 1.770) 2.147 3.242 ( 1.099 0.612 -0.790) 1.485 3.312 ( -0.403 -4.208 1.038) 4.353 3.485 ( 0.992 -2.560 -5.666) 6.296 3.572 ( 1.036 10.757 -0.291) 10.811 3.751 ( -4.450 -3.053 -0.895) 5.471 3.980 ( -1.310 1.322 -2.113) 2.816 4.097 ( -0.577 -2.897 1.112) 3.156 4.282 ( -0.014 1.769 1.308) 2.200 4.298 ( -0.151 2.935 -3.066) 4.247 4.427 ( -0.666 1.138 -6.645) 6.774 4.519 ( -2.365 -2.289 5.603) 6.498 4.729 ( -3.128 0.735 -0.179) 3.218 4.971 ( -0.864 -12.071 1.244) 12.165 5.042 ( -1.554 -5.548 7.034) 9.092 5.081 ( 0.542 -11.718 -4.388) 12.525 5.394 ( -4.324 2.763 -0.948) 5.218 5.594 ( 3.949 -7.852 -4.352) 9.808 6.033 ( 1.001 -4.468 -3.737) 5.910 6.261 ( 6.078 15.246 -15.127) 22.320 6.509 ( 3.229 -4.178 -2.010) 5.650 6.746 ( 1.229 -6.956 -5.451) 8.923 7.045 ( -2.829 4.485 -2.358) 5.803 7.195 ( 4.406 10.740 -4.396) 12.413 7.634 ( 2.560 0.243 -1.974) 3.241 7.718 ( -2.121 -0.042 3.298) 3.921 7.808 ( 3.294 1.343 0.041) 3.557 7.913 ( 1.658 0.866 -2.338) 2.994 8.147 ( 1.706 -1.910 -3.651) 4.460 8.175 ( 1.134 2.166 -3.804) 4.522 8.437 ( 6.351 -7.555 -9.348) 13.594 8.763 ( 5.956 2.786 -11.954) 13.643 8.954 ( -1.853 -1.786 -0.482) 2.618 9.283 ( -0.499 3.006 2.632) 4.026 9.458 ( -2.478 6.122 8.663) 10.893 9.597 ( -1.894 4.435 9.624) 10.765 9.706 ( -5.646 13.714 17.857) 23.213 9.786 ( -2.566 -0.785 8.344) 8.765 10.062 ( 3.435 -3.559 -1.947) 5.316 11.942 ( -5.081 -8.211 33.551) 34.912 12.429 ( -3.273 -8.859 11.725) 15.055 13.459 ( 14.680 37.364 -16.032) 43.227 14.370 ( -2.653 20.284 17.310) 26.798 16.438 ( 9.304 -14.319 0.197) 17.078 16.715 ( -2.406 -21.600 -0.014) 21.734 17.556 ( -5.212 13.528 -6.689) 15.966 17.788 ( 11.244 1.798 0.100) 11.387 22.225 ( 4.743 3.843 -8.181) 10.207 22.609 ( -2.786 2.791 1.745) 4.312 23.212 ( -9.556 0.952 0.282) 9.607 23.268 ( 0.832 -5.534 -5.634) 7.941 23.415 ( 0.791 -0.452 -0.963) 1.326 23.534 ( 5.803 -1.300 16.737) 17.762 24.656 ( -8.221 3.696 0.852) 9.054 25.955 ( -8.251 -21.146 -17.360) 28.576 ======================= Grid point 77 (35/136) ======================= q-point: (-0.25 0.17 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.973 ( -12.866 11.834 7.620) 19.069 1.040 ( -16.187 6.769 7.648) 19.140 1.525 ( -11.380 10.281 22.582) 27.297 1.795 ( 5.171 10.315 0.270) 11.542 1.965 ( 2.616 7.300 -0.064) 7.755 2.048 ( 1.921 -10.272 5.597) 11.855 2.556 ( 3.210 2.571 1.143) 4.269 2.585 ( 5.066 6.504 3.714) 9.042 2.841 ( 1.642 0.983 -4.842) 5.206 2.956 ( -2.436 2.165 -6.573) 7.337 2.997 ( 0.163 -4.688 0.202) 4.695 3.077 ( 1.929 -3.694 0.895) 4.262 3.243 ( 4.095 1.536 0.805) 4.447 3.350 ( -1.250 -1.493 5.907) 6.220 3.449 ( 1.051 -2.434 -7.499) 7.954 3.606 ( 2.150 12.131 -1.445) 12.404 3.634 ( -7.127 -1.342 -0.273) 7.257 3.914 ( -4.637 6.888 -0.896) 8.351 4.078 ( 0.366 -1.466 -6.212) 6.393 4.224 ( -5.937 -1.250 1.976) 6.381 4.263 ( 0.214 1.899 -2.443) 3.102 4.428 ( 0.655 -1.187 0.554) 1.465 4.553 ( 0.255 -1.795 6.914) 7.148 4.665 ( -1.511 2.682 -2.166) 3.764 4.886 ( -5.064 -13.591 -4.680) 15.240 5.088 ( 0.787 -9.999 2.061) 10.240 5.102 ( 2.268 -3.844 3.102) 5.435 5.331 ( -2.212 4.286 0.985) 4.923 5.641 ( 3.424 -10.282 -2.205) 11.059 6.047 ( 3.575 -6.909 -4.215) 8.848 6.274 ( 6.876 13.715 -17.258) 23.091 6.546 ( 3.253 -2.513 -2.235) 4.679 6.708 ( -0.765 -5.111 -6.900) 8.621 6.986 ( -1.565 5.325 -0.813) 5.610 7.238 ( 4.477 13.074 -8.900) 16.437 7.666 ( 1.611 0.177 -1.104) 1.961 7.705 ( -0.696 0.238 0.776) 1.070 7.833 ( -1.004 2.007 -1.445) 2.669 7.946 ( 3.971 1.669 -1.790) 4.664 8.126 ( -0.846 6.101 -6.114) 8.678 8.208 ( 5.738 -4.447 -3.064) 7.880 8.481 ( 5.501 -7.552 -9.737) 13.494 8.799 ( 5.167 -2.626 -11.178) 12.591 8.925 ( 0.659 -0.780 -2.067) 2.306 9.307 ( 0.669 2.930 2.733) 4.063 9.466 ( -2.521 5.912 7.253) 9.691 9.632 ( -2.711 4.769 12.799) 13.925 9.757 ( -3.459 14.266 17.507) 22.847 9.785 ( -3.737 0.459 8.540) 9.333 10.121 ( 3.801 -3.597 -1.922) 5.575 12.083 ( -5.998 -17.781 29.398) 34.876 12.506 ( -3.137 -8.642 27.090) 28.608 13.732 ( 22.219 33.779 -11.892) 42.144 14.580 ( 13.343 36.968 25.769) 46.997 16.524 ( 1.946 -21.782 -5.318) 22.506 16.834 ( 10.641 -6.716 9.480) 15.755 17.539 ( 8.748 19.551 3.675) 21.732 18.099 ( 19.396 0.231 0.726) 19.411 22.276 ( 6.394 2.783 -7.636) 10.341 22.582 ( -1.579 2.777 2.386) 3.987 22.956 ( -15.810 4.276 -0.969) 16.407 23.223 ( -1.587 -5.585 -5.253) 7.829 23.402 ( -0.764 -0.960 -1.167) 1.693 23.695 ( -1.206 -6.031 9.297) 11.147 24.461 ( -12.845 1.003 2.648) 13.153 25.467 ( -26.115 -30.388 -31.380) 50.893 ======================= Grid point 78 (36/136) ======================= q-point: (-0.12 0.17 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.735 ( -18.649 8.804 9.427) 22.675 0.824 ( -11.381 18.726 12.197) 25.079 1.407 ( -18.868 23.186 33.428) 44.844 1.892 ( 0.939 -0.998 1.057) 1.730 2.050 ( 1.489 -5.131 1.238) 5.484 2.189 ( 17.878 1.838 -10.207) 20.668 2.598 ( 0.334 4.130 0.697) 4.202 2.703 ( 4.288 5.724 0.392) 7.163 2.803 ( 0.888 -4.062 -11.680) 12.398 2.872 ( -0.575 4.598 -3.474) 5.792 2.986 ( -1.074 -5.001 -0.071) 5.115 3.093 ( -0.509 -4.908 -0.723) 4.988 3.309 ( -0.510 -0.181 -3.194) 3.240 3.406 ( 0.694 -0.931 -2.678) 2.919 3.450 ( 3.017 -1.855 9.415) 10.059 3.489 ( -4.825 1.708 1.603) 5.363 3.588 ( 0.083 13.031 -9.338) 16.032 3.821 ( -3.018 13.940 -0.941) 14.294 4.038 ( 1.954 -0.590 -10.065) 10.270 4.124 ( -6.683 -1.854 5.140) 8.633 4.250 ( -0.756 -1.800 -1.742) 2.617 4.417 ( -1.795 -0.004 3.351) 3.802 4.611 ( 3.228 1.231 -4.940) 6.028 4.643 ( -3.240 -1.694 9.785) 10.446 4.782 ( -2.978 -4.079 2.422) 5.601 5.100 ( -0.095 -7.763 0.163) 7.765 5.178 ( 3.184 -5.528 2.194) 6.746 5.314 ( -1.723 3.255 3.898) 5.362 5.687 ( 1.962 -12.209 -0.138) 12.366 6.090 ( 2.151 -11.767 -3.577) 12.485 6.273 ( 8.882 11.713 -21.109) 25.723 6.607 ( 4.398 2.940 -6.700) 8.537 6.642 ( -0.408 -2.745 -1.303) 3.066 6.979 ( 0.535 6.429 1.246) 6.570 7.231 ( 2.552 11.744 -10.718) 16.103 7.667 ( -0.896 -0.836 -1.151) 1.681 7.691 ( -0.123 -1.243 -3.334) 3.561 7.799 ( -0.206 3.172 -1.596) 3.557 8.000 ( 3.955 4.512 -6.878) 9.127 8.067 ( 0.183 5.286 -6.089) 8.066 8.308 ( 7.477 -4.380 -7.134) 11.225 8.506 ( 4.473 -7.702 -9.662) 13.141 8.782 ( -0.090 -3.287 -4.851) 5.861 8.951 ( 5.183 -0.623 -8.639) 10.094 9.335 ( -0.240 2.686 2.881) 3.946 9.475 ( -0.974 4.598 4.760) 6.689 9.672 ( -4.234 3.870 14.755) 15.831 9.748 ( -5.133 1.624 7.283) 9.057 9.822 ( -3.158 13.764 14.023) 19.901 10.175 ( 2.682 -3.380 -0.879) 4.403 12.124 ( -7.122 -20.550 18.574) 28.601 12.654 ( -6.144 -13.135 33.273) 36.295 13.965 ( 7.908 12.594 -6.911) 16.399 15.290 ( 32.231 27.804 7.083) 43.152 16.582 ( 8.092 -13.420 -3.528) 16.063 17.058 ( 4.077 -6.701 6.168) 9.978 18.348 ( 64.747 23.044 43.276) 81.216 18.471 ( 16.516 2.279 0.258) 16.675 22.352 ( 6.601 3.305 -7.410) 10.459 22.586 ( 0.064 2.431 3.383) 4.167 22.635 ( -14.315 2.905 -2.251) 14.779 23.125 ( -7.282 -7.047 -6.644) 12.118 23.357 ( -16.258 -8.009 -8.374) 19.965 23.417 ( -21.979 -10.126 -12.621) 27.293 24.174 ( -15.446 0.375 -2.886) 15.718 24.607 ( -29.557 -12.853 -10.448) 33.882 ======================= Grid point 79 (37/136) ======================= q-point: ( 0.00 0.33 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.832 ( -7.582 16.733 5.271) 19.112 1.234 ( -2.842 20.785 6.331) 21.912 1.572 ( -6.007 -13.498 1.605) 14.861 1.855 ( -4.606 2.787 7.195) 8.987 1.994 ( -4.279 13.552 11.175) 18.079 2.530 ( 9.856 -0.364 -11.711) 15.310 2.662 ( 1.941 -1.209 -3.718) 4.365 2.725 ( 4.646 -2.811 -3.628) 6.531 2.761 ( 5.535 -0.523 -4.380) 7.078 2.821 ( -1.180 3.511 -5.271) 6.442 2.990 ( -2.638 7.811 -0.761) 8.280 3.001 ( -0.135 -2.561 -0.923) 2.726 3.188 ( -1.448 -3.024 -8.928) 9.537 3.362 ( -5.351 4.310 5.325) 8.693 3.462 ( 0.822 -0.042 3.462) 3.558 3.585 ( -1.513 -9.251 0.943) 9.421 3.709 ( 2.580 1.981 10.548) 11.038 3.910 ( -1.142 -3.009 -5.340) 6.235 4.063 ( -3.748 5.748 3.899) 7.892 4.155 ( 0.733 11.642 -6.090) 13.159 4.213 ( -0.904 2.203 -0.848) 2.528 4.412 ( -1.026 -1.150 2.690) 3.100 4.544 ( 1.943 -4.099 0.713) 4.591 4.710 ( 1.706 -0.791 9.128) 9.319 4.817 ( -1.522 -10.966 1.484) 11.170 4.892 ( 1.327 5.024 -0.147) 5.198 5.082 ( 2.889 -8.372 1.859) 9.049 5.384 ( -1.483 1.440 1.443) 2.521 5.466 ( -1.855 -7.057 3.060) 7.912 5.770 ( -2.720 -11.213 -5.920) 12.969 6.369 ( 6.080 -0.775 -8.228) 10.260 6.511 ( 2.362 -6.224 -2.262) 7.031 6.857 ( 6.265 8.211 -9.501) 14.034 7.089 ( 2.520 -0.310 -3.189) 4.076 7.397 ( 0.793 8.249 -7.299) 11.043 7.600 ( -1.996 -1.410 -3.874) 4.580 7.645 ( -2.458 2.626 -0.173) 3.601 7.813 ( 0.463 -2.058 -2.576) 3.330 8.034 ( 3.470 -0.201 -8.730) 9.396 8.145 ( 0.668 3.554 -6.272) 7.240 8.363 ( 6.297 3.084 -14.036) 15.690 8.423 ( 4.671 -3.426 -6.668) 8.833 8.699 ( 1.921 -1.347 -1.921) 3.032 8.908 ( 6.225 -5.798 -12.934) 15.481 9.413 ( -1.594 4.079 2.513) 5.049 9.528 ( -0.385 0.008 0.155) 0.415 9.715 ( -5.896 4.160 5.810) 9.264 9.850 ( -6.751 6.538 13.843) 16.732 10.057 ( -3.981 3.823 8.765) 10.358 10.179 ( -3.927 2.436 14.441) 15.162 11.885 ( -7.901 -0.103 18.119) 19.767 12.396 ( -8.272 -16.800 24.178) 30.582 14.416 ( 4.076 25.654 -9.981) 27.827 15.456 ( -0.796 -13.837 -1.705) 13.965 16.588 ( 2.670 2.849 -14.620) 15.132 16.952 ( -2.545 -9.495 4.184) 10.684 18.707 ( -2.880 5.026 -1.902) 6.097 18.956 ( -21.408 -4.768 -6.512) 22.879 22.480 ( -6.291 0.887 -4.122) 7.573 22.511 ( 3.168 1.750 -2.813) 4.584 22.648 ( 6.788 3.895 2.178) 8.124 22.810 ( 20.105 -1.871 11.159) 23.070 23.148 ( 1.731 0.464 -0.127) 1.797 23.294 ( -0.184 -4.436 -2.140) 4.928 24.087 ( 0.274 2.859 1.488) 3.235 24.255 ( -2.836 -4.185 2.932) 5.844 ======================= Grid point 80 (38/136) ======================= q-point: ( 0.12 0.33 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.807 ( 3.014 10.929 1.805) 11.480 1.212 ( -4.161 9.399 0.537) 10.293 1.474 ( -3.885 -2.743 4.345) 6.442 1.844 ( -1.162 0.243 4.386) 4.544 2.012 ( -2.608 16.621 12.212) 20.789 2.524 ( -0.675 -3.080 -6.186) 6.943 2.667 ( -1.723 4.152 -3.863) 5.927 2.730 ( -1.607 -1.022 -2.972) 3.529 2.790 ( 1.820 -2.027 -0.120) 2.727 2.848 ( 6.908 -1.762 -10.302) 12.528 2.951 ( -0.793 2.176 -1.369) 2.691 2.983 ( 0.698 7.116 -5.657) 9.117 3.129 ( 1.444 -2.481 -4.534) 5.366 3.294 ( -5.524 6.856 7.524) 11.582 3.478 ( -1.385 3.020 2.395) 4.096 3.613 ( 3.886 -12.260 -0.550) 12.873 3.787 ( -2.509 -2.507 4.354) 5.616 3.890 ( 2.187 -6.782 -1.509) 7.284 4.049 ( 0.061 8.813 2.359) 9.123 4.108 ( 0.067 11.732 -3.883) 12.358 4.230 ( 2.162 -0.346 -0.268) 2.206 4.433 ( 0.427 -2.579 4.352) 5.077 4.606 ( 3.354 -4.297 0.975) 5.537 4.776 ( -2.958 -10.232 0.280) 10.655 4.800 ( 0.622 2.163 8.938) 9.217 4.888 ( -1.691 5.454 0.577) 5.739 5.157 ( 0.407 -8.464 5.299) 9.994 5.381 ( 0.300 4.295 2.108) 4.794 5.447 ( -0.558 -11.607 -0.023) 11.621 5.686 ( 0.590 -10.137 -7.793) 12.800 6.437 ( 5.559 -1.502 -6.991) 9.057 6.547 ( 2.252 -5.408 -1.541) 6.058 6.851 ( 0.312 7.626 -8.955) 11.766 7.080 ( -0.920 -0.541 -2.339) 2.570 7.384 ( 3.403 7.029 -8.257) 11.365 7.574 ( 2.599 -3.026 -5.633) 6.903 7.599 ( -1.648 3.116 -0.270) 3.535 7.798 ( -0.014 -2.106 -1.970) 2.884 8.039 ( 3.637 -0.490 -8.360) 9.130 8.107 ( 0.705 3.329 -7.452) 8.192 8.334 ( 0.609 5.623 -11.426) 12.749 8.448 ( 1.597 -2.577 -5.778) 6.526 8.744 ( 3.932 -0.620 -0.897) 4.081 8.934 ( 5.490 -4.895 -10.788) 13.057 9.399 ( -1.742 4.018 2.939) 5.274 9.528 ( 0.530 -0.615 -0.522) 0.965 9.634 ( -6.111 4.823 4.841) 9.167 9.803 ( -7.682 5.492 12.199) 15.427 10.034 ( -5.680 5.025 10.495) 12.948 10.180 ( -6.539 1.512 13.379) 14.969 11.859 ( -8.506 1.075 18.079) 20.009 12.375 ( -10.988 -16.064 21.060) 28.676 14.403 ( 2.932 28.565 -13.273) 31.634 15.322 ( -12.846 4.353 -1.879) 13.693 16.381 ( -10.714 -4.699 -13.065) 17.538 16.800 ( -16.749 -12.054 4.615) 21.145 18.314 ( -24.838 12.304 2.903) 27.870 18.469 ( -17.576 1.378 0.134) 17.630 22.407 ( 0.913 3.152 -4.652) 5.693 22.574 ( 4.275 -0.995 -2.001) 4.824 22.829 ( 8.831 8.126 -0.209) 12.003 23.173 ( 4.916 -1.099 1.744) 5.331 23.246 ( 2.552 -8.656 -1.551) 9.157 23.317 ( 2.862 -6.080 -1.005) 6.795 24.229 ( 12.546 3.572 1.283) 13.107 24.568 ( 32.995 -15.428 5.036) 36.770 ======================= Grid point 81 (39/136) ======================= q-point: ( 0.25 0.33 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.957 ( 9.960 -0.184 -0.350) 9.968 1.073 ( -5.379 -3.187 -5.686) 8.451 1.514 ( 1.127 9.849 9.494) 13.726 1.870 ( 0.883 1.070 3.533) 3.796 2.062 ( -1.814 15.204 11.748) 19.300 2.434 ( -3.407 -1.575 -7.189) 8.110 2.590 ( -2.878 3.620 0.569) 4.660 2.708 ( 0.100 1.233 -1.238) 1.750 2.811 ( -0.951 -0.602 -1.247) 1.680 2.854 ( 1.540 2.591 -7.873) 8.430 2.905 ( -1.050 -2.887 -2.892) 4.219 2.957 ( 0.963 7.026 -4.518) 8.409 3.163 ( 3.549 -3.198 -3.987) 6.223 3.278 ( -2.209 7.005 8.184) 10.996 3.469 ( -0.175 1.089 0.689) 1.300 3.680 ( 2.099 -8.818 1.252) 9.150 3.717 ( -4.190 -1.010 -1.959) 4.734 3.912 ( -0.401 -10.021 1.302) 10.113 4.092 ( 3.470 11.041 -0.518) 11.585 4.141 ( 3.634 5.090 1.283) 6.384 4.262 ( 0.750 -1.213 0.147) 1.434 4.490 ( 1.761 -4.555 5.202) 7.135 4.672 ( 2.672 -2.597 0.175) 3.730 4.711 ( -3.671 -4.525 0.571) 5.855 4.846 ( -2.932 2.238 2.407) 4.405 4.868 ( 0.922 0.909 3.572) 3.800 5.137 ( -6.375 -5.553 6.750) 10.818 5.381 ( -0.399 -6.823 -2.170) 7.171 5.501 ( 4.328 -1.935 2.514) 5.366 5.716 ( 7.836 -8.278 -5.945) 12.855 6.451 ( 0.797 -0.266 -6.345) 6.401 6.562 ( 0.376 -4.802 -1.610) 5.078 6.763 ( -1.473 6.697 -10.344) 12.410 7.049 ( 0.244 -3.503 -2.827) 4.508 7.377 ( 1.622 6.275 -8.308) 10.537 7.563 ( 0.731 1.041 -2.729) 3.011 7.629 ( 3.992 -1.496 -1.755) 4.610 7.791 ( 0.593 -2.250 -1.403) 2.717 8.049 ( 1.450 3.263 -6.754) 7.640 8.072 ( 2.317 2.105 -6.253) 6.993 8.242 ( -1.636 4.984 -8.014) 9.578 8.387 ( -2.612 -2.509 -7.006) 7.887 8.824 ( 5.077 -0.422 -2.791) 5.809 8.961 ( 4.308 -2.802 -7.890) 9.416 9.393 ( -1.506 4.639 3.936) 6.267 9.520 ( -1.114 3.446 -2.384) 4.335 9.585 ( -2.702 0.799 8.200) 8.671 9.746 ( -6.374 4.162 10.390) 12.881 9.996 ( -6.264 5.093 11.198) 13.805 10.125 ( -8.617 1.212 12.198) 14.984 11.824 ( -8.457 2.291 17.456) 19.532 12.296 ( -10.475 -13.861 15.644) 23.379 14.316 ( 0.388 34.328 -19.287) 39.377 15.008 ( -17.001 23.219 6.740) 29.557 16.123 ( -7.134 -21.004 -9.802) 24.252 16.467 ( -17.955 -17.822 5.396) 25.868 18.097 ( -8.435 7.343 9.373) 14.592 18.158 ( -14.490 2.822 4.648) 15.477 22.396 ( 1.096 6.560 -4.989) 8.314 22.656 ( 4.439 -1.301 1.012) 4.735 22.982 ( 8.296 3.178 -2.810) 9.318 23.161 ( -1.728 -2.122 -8.139) 8.587 23.268 ( -0.106 -3.339 -1.314) 3.589 23.296 ( 0.898 -4.240 -0.762) 4.401 24.558 ( 17.703 9.220 1.912) 20.052 25.239 ( 28.304 -23.365 1.161) 36.720 ======================= Grid point 82 (40/136) ======================= q-point: ( 0.38 0.33 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.956 ( -0.384 -1.204 -1.142) 1.703 1.175 ( 9.689 -9.058 -1.607) 13.361 1.600 ( -0.240 11.471 8.705) 14.402 1.929 ( 2.102 2.354 3.772) 4.918 2.103 ( -3.179 11.889 12.482) 17.528 2.310 ( -2.579 -0.243 -10.157) 10.482 2.566 ( -1.793 5.448 3.030) 6.487 2.633 ( -4.127 7.113 -9.915) 12.882 2.785 ( 0.863 -2.963 0.422) 3.115 2.821 ( 0.336 4.454 -1.543) 4.726 2.919 ( 1.506 -3.299 1.846) 4.069 2.962 ( 1.276 3.928 -0.327) 4.143 3.188 ( 3.054 -4.800 -6.376) 8.545 3.296 ( -2.220 7.229 7.842) 10.894 3.495 ( 1.058 -1.382 2.822) 3.316 3.628 ( -1.644 -0.922 -4.256) 4.655 3.711 ( 0.203 -5.145 1.167) 5.280 3.900 ( -1.964 -11.110 2.612) 11.581 4.156 ( 2.822 8.842 -0.197) 9.283 4.231 ( 3.755 2.768 2.473) 5.279 4.260 ( -0.852 -1.026 0.302) 1.367 4.562 ( 1.857 -6.793 3.079) 7.686 4.642 ( -3.630 -0.175 1.150) 3.812 4.714 ( 1.754 -0.062 -2.357) 2.939 4.811 ( -2.103 4.884 2.921) 6.067 4.891 ( -0.178 -5.144 -0.428) 5.165 5.044 ( -7.367 -5.297 5.635) 10.681 5.361 ( 1.088 -9.801 -4.370) 10.786 5.593 ( 2.262 4.107 3.408) 5.797 5.861 ( 8.558 -6.393 -2.275) 10.922 6.398 ( -0.748 0.480 -4.954) 5.033 6.550 ( 0.498 -5.400 -2.455) 5.953 6.653 ( -1.188 7.324 -12.075) 14.173 7.047 ( 1.685 -7.397 -4.109) 8.628 7.337 ( 0.820 7.333 -6.695) 9.964 7.575 ( 2.039 -0.008 -2.008) 2.862 7.690 ( 2.763 -0.849 -0.061) 2.891 7.800 ( 1.174 -1.509 -1.300) 2.312 7.979 ( -2.828 7.208 -3.527) 8.508 8.110 ( 3.883 0.258 -4.189) 5.717 8.191 ( 2.417 2.120 -8.008) 8.629 8.279 ( -1.899 -3.917 -7.262) 8.466 8.876 ( 3.493 0.436 -7.111) 7.935 8.976 ( 2.068 -1.072 -5.330) 5.816 9.389 ( -1.743 5.491 2.807) 6.408 9.493 ( -0.481 4.176 1.702) 4.535 9.624 ( -0.806 0.438 9.828) 9.870 9.720 ( -3.384 1.739 8.378) 9.202 9.965 ( -4.995 3.876 10.565) 12.313 10.037 ( -9.283 2.472 12.044) 15.406 11.798 ( -6.957 2.901 16.671) 18.296 12.222 ( -7.283 -12.467 11.815) 18.656 14.181 ( 1.644 37.242 -18.400) 41.572 14.833 ( -9.012 23.417 11.916) 27.777 15.929 ( -4.411 -24.025 -9.258) 26.122 16.266 ( -8.199 -25.363 7.110) 27.587 17.922 ( -9.853 6.225 2.110) 11.845 18.041 ( -7.617 2.715 6.124) 10.144 22.374 ( 1.133 8.278 -6.513) 10.594 22.719 ( -0.023 -3.241 0.570) 3.291 23.075 ( 5.394 2.074 -2.740) 6.396 23.154 ( 4.242 0.457 -0.391) 4.284 23.275 ( 3.437 -4.310 -2.984) 6.269 23.313 ( 0.080 -3.847 0.961) 3.966 24.852 ( 10.356 12.622 0.404) 16.331 25.625 ( 12.471 -21.811 -2.589) 25.258 ======================= Grid point 83 (41/136) ======================= q-point: (-0.50 0.33 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.044 ( 6.674 -0.150 6.879) 9.586 1.285 ( 2.104 -8.862 -0.704) 9.135 1.609 ( -4.904 11.913 7.219) 14.768 1.986 ( 0.263 1.624 3.771) 4.114 2.110 ( -2.861 8.495 1.532) 9.094 2.197 ( -1.347 6.876 -4.878) 8.537 2.516 ( -1.125 7.134 -2.191) 7.547 2.558 ( -1.837 1.484 1.352) 2.721 2.775 ( 1.450 -2.591 -3.764) 4.795 2.865 ( 1.374 -1.509 0.856) 2.213 2.980 ( 2.047 0.954 1.499) 2.711 3.006 ( 2.844 4.405 5.449) 7.562 3.178 ( 1.881 -5.961 -9.126) 11.061 3.330 ( -1.375 7.718 11.136) 13.619 3.497 ( -1.913 3.036 -0.467) 3.619 3.622 ( 2.201 -9.350 -0.733) 9.633 3.707 ( -0.981 -1.207 -0.121) 1.560 3.898 ( 0.217 -9.955 3.352) 10.506 4.174 ( -1.147 6.948 -0.278) 7.047 4.258 ( 0.612 0.376 1.234) 1.428 4.313 ( 2.015 1.567 4.430) 5.113 4.572 ( -2.540 -3.779 0.140) 4.556 4.580 ( -2.768 2.549 -2.316) 4.418 4.714 ( 0.273 -1.801 -0.515) 1.893 4.820 ( 0.994 5.615 1.195) 5.826 4.849 ( -2.989 -8.929 -2.544) 9.753 4.957 ( -4.246 -5.313 3.295) 7.557 5.362 ( 2.066 -10.694 -4.071) 11.628 5.618 ( -2.282 8.351 2.749) 9.083 5.949 ( 1.211 -5.029 -1.190) 5.308 6.391 ( 2.925 -1.285 -2.640) 4.144 6.532 ( -1.611 -5.745 -4.585) 7.524 6.583 ( 5.765 8.175 -12.751) 16.206 7.036 ( 0.691 -8.834 -5.426) 10.390 7.341 ( 4.183 8.743 -4.838) 10.832 7.610 ( 2.744 -0.872 -1.046) 3.064 7.745 ( 2.891 0.735 0.946) 3.129 7.792 ( -1.662 0.090 0.359) 1.703 7.932 ( 0.969 5.444 -4.152) 6.915 8.130 ( 0.699 0.188 -2.454) 2.559 8.205 ( 4.843 0.306 -7.946) 9.311 8.243 ( 3.390 -4.778 -6.703) 8.903 8.851 ( 0.932 1.715 -10.316) 10.499 8.960 ( 0.118 -1.537 -4.907) 5.144 9.375 ( -0.866 5.742 1.431) 5.980 9.518 ( -0.080 3.070 4.757) 5.663 9.688 ( -0.991 2.116 11.603) 11.836 9.734 ( -1.514 0.734 8.134) 8.306 9.956 ( -3.189 -1.152 4.900) 5.959 9.972 ( -6.726 7.894 17.456) 20.305 11.805 ( -5.282 2.187 17.705) 18.605 12.191 ( -4.581 -11.866 11.118) 16.894 14.149 ( 8.387 37.298 -15.940) 41.420 14.801 ( -3.898 22.784 13.056) 26.548 15.878 ( 5.174 -23.969 -6.062) 25.259 16.210 ( -2.830 -25.965 6.277) 26.863 17.799 ( -2.751 5.591 -0.965) 6.305 17.900 ( -7.635 2.912 -2.276) 8.483 22.351 ( 1.992 8.085 -7.687) 11.333 22.679 ( -1.756 -2.816 -2.923) 4.423 23.166 ( 1.501 -0.490 -0.985) 1.861 23.271 ( 6.900 0.421 6.746) 9.659 23.302 ( -1.140 -2.638 2.187) 3.612 23.361 ( 3.660 -2.814 2.713) 5.355 24.936 ( -1.365 12.426 -1.588) 12.601 25.696 ( -1.643 -21.067 -6.431) 22.088 ======================= Grid point 84 (42/136) ======================= q-point: (-0.38 0.33 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.235 ( -1.205 0.834 5.462) 5.655 1.282 ( 3.806 -2.372 6.720) 8.079 1.535 ( -7.688 11.369 8.554) 16.172 1.971 ( -0.438 3.001 -3.817) 4.875 2.067 ( 2.122 4.583 -7.182) 8.780 2.176 ( -4.892 11.775 9.458) 15.876 2.527 ( 1.189 0.994 3.059) 3.429 2.543 ( 2.223 -3.536 -5.172) 6.648 2.802 ( 1.939 1.952 1.191) 2.998 2.878 ( 0.815 -2.950 -1.757) 3.529 2.998 ( 0.445 -1.424 -3.116) 3.455 3.120 ( 2.198 6.876 5.989) 9.380 3.151 ( 1.343 -4.186 -2.873) 5.252 3.376 ( -1.065 5.651 4.972) 7.602 3.446 ( -1.744 0.840 -2.520) 3.178 3.650 ( -0.374 -5.873 2.460) 6.378 3.689 ( -0.562 -2.645 1.038) 2.896 3.957 ( 2.624 -6.706 2.837) 7.740 4.137 ( -1.596 7.447 -0.450) 7.629 4.284 ( -1.168 1.206 4.946) 5.223 4.370 ( -0.014 0.001 4.274) 4.274 4.486 ( -3.791 1.646 -2.524) 4.843 4.506 ( -2.077 2.752 -3.415) 4.853 4.722 ( -0.624 -4.612 -0.741) 4.713 4.753 ( -3.713 -12.125 -0.641) 12.697 4.837 ( 0.705 5.936 -1.666) 6.206 4.951 ( 1.396 -5.371 1.696) 5.803 5.376 ( 1.905 -10.229 -2.849) 10.788 5.559 ( -5.068 8.500 2.691) 10.255 5.920 ( -2.456 -5.866 -0.767) 6.405 6.427 ( 1.513 -2.602 -3.942) 4.959 6.493 ( 3.324 0.579 -5.525) 6.474 6.620 ( 6.451 2.670 -13.237) 14.965 7.006 ( 0.718 -6.919 -5.458) 8.842 7.410 ( 5.833 8.482 -4.918) 11.409 7.662 ( 3.072 0.089 -0.813) 3.179 7.750 ( -2.716 2.040 2.359) 4.135 7.818 ( 2.701 -2.746 -0.421) 3.874 7.949 ( 4.267 6.427 -4.158) 8.764 8.121 ( 1.335 1.285 -3.571) 4.024 8.233 ( 3.094 0.659 -6.779) 7.481 8.295 ( 6.765 -6.287 -7.707) 12.028 8.781 ( 0.314 0.568 -10.662) 10.682 8.914 ( 0.004 -2.590 -6.773) 7.251 9.381 ( 0.192 5.919 1.622) 6.140 9.542 ( -1.156 1.790 4.776) 5.230 9.746 ( -2.001 2.325 11.749) 12.143 9.777 ( -1.682 4.072 11.303) 12.131 9.955 ( -2.051 2.679 10.927) 11.436 10.001 ( -2.137 3.665 11.275) 12.047 11.847 ( -5.100 0.327 20.022) 20.664 12.207 ( -3.124 -11.652 13.596) 18.176 14.254 ( 13.219 35.163 -16.117) 40.877 14.902 ( 4.939 23.558 15.457) 28.606 15.984 ( 8.464 -22.625 -6.643) 25.053 16.304 ( 8.762 -18.735 8.980) 22.548 17.767 ( -1.221 6.295 -5.506) 8.452 17.829 ( 7.552 1.651 -1.504) 7.875 22.342 ( 3.057 6.912 -7.730) 10.810 22.633 ( -0.790 -2.202 -2.703) 3.575 23.157 ( -0.651 -1.796 -2.144) 2.872 23.241 ( -5.026 -0.463 0.085) 5.048 23.399 ( -0.473 -0.010 2.941) 2.978 23.494 ( 2.996 -2.481 14.004) 14.534 24.789 ( -11.617 8.999 -1.921) 14.820 25.462 ( -16.036 -22.282 -11.437) 29.740 ======================= Grid point 85 (43/136) ======================= q-point: (-0.25 0.33 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.131 ( -10.046 6.489 7.271) 13.996 1.357 ( -5.106 17.394 3.362) 18.437 1.548 ( 1.633 -7.275 12.737) 14.759 1.962 ( -0.948 -1.946 1.939) 2.906 2.057 ( -3.203 12.466 4.243) 13.553 2.155 ( 4.344 10.296 -5.414) 12.417 2.574 ( 5.985 -7.015 -8.526) 12.559 2.592 ( 2.800 -1.348 3.467) 4.656 2.844 ( 1.258 5.212 -2.049) 5.740 2.871 ( -0.614 -4.247 -1.127) 4.437 2.959 ( -0.336 -2.522 -3.520) 4.343 3.110 ( -2.552 5.930 0.877) 6.515 3.249 ( 4.021 -0.306 6.643) 7.771 3.364 ( 0.643 0.050 -5.203) 5.243 3.394 ( -2.174 -0.980 -1.039) 2.601 3.638 ( -3.715 1.028 4.856) 6.199 3.698 ( -0.781 -3.963 2.539) 4.771 4.006 ( 0.252 -4.558 1.301) 4.746 4.123 ( 0.720 8.144 -0.842) 8.219 4.247 ( -7.069 5.034 6.950) 11.118 4.322 ( -2.996 3.032 -4.034) 5.869 4.461 ( -0.497 2.901 -1.383) 3.252 4.499 ( 1.978 -3.252 6.261) 7.327 4.625 ( -4.041 -8.281 -3.728) 9.940 4.765 ( 1.753 -5.593 0.090) 5.862 4.838 ( 1.115 -0.102 -1.864) 2.174 5.003 ( 1.984 -4.234 1.716) 4.981 5.391 ( 1.271 -8.802 -1.469) 9.014 5.491 ( -3.910 6.094 4.010) 8.277 5.870 ( -1.986 -8.502 -0.149) 8.732 6.398 ( 0.615 -0.325 -7.495) 7.527 6.533 ( 1.811 -6.504 -4.563) 8.149 6.652 ( 9.032 8.094 -13.912) 18.456 7.000 ( 2.781 -4.215 -4.708) 6.904 7.463 ( 3.248 8.837 -5.989) 11.159 7.703 ( 1.243 1.661 -1.003) 2.305 7.719 ( -2.216 0.990 2.610) 3.564 7.828 ( -0.388 -4.049 -1.588) 4.367 8.004 ( 3.988 5.073 -5.894) 8.739 8.161 ( 4.560 1.677 -2.283) 5.369 8.234 ( 4.526 1.281 -10.736) 11.721 8.359 ( 6.142 -4.393 -9.818) 12.386 8.720 ( 0.618 -2.022 -7.894) 8.173 8.880 ( 3.138 -4.017 -10.240) 11.439 9.401 ( 0.291 5.542 2.222) 5.978 9.546 ( -1.581 1.317 3.703) 4.236 9.777 ( -3.196 2.308 10.135) 10.875 9.825 ( -3.410 7.438 14.895) 16.994 10.027 ( 1.817 -1.078 6.875) 7.192 10.041 ( -3.552 6.535 15.032) 16.771 11.887 ( -6.208 -1.282 20.054) 21.032 12.268 ( -3.216 -12.890 19.136) 23.296 14.362 ( 8.645 28.472 -13.718) 32.765 15.209 ( 13.444 10.782 9.290) 19.578 16.154 ( 15.940 -6.748 -3.856) 17.733 16.627 ( 14.735 -12.382 7.628) 20.703 17.879 ( 17.650 11.597 4.173) 21.528 18.096 ( 19.831 -0.848 1.322) 19.893 22.362 ( 4.516 5.261 -6.440) 9.464 22.609 ( 0.042 -1.942 -1.906) 2.721 23.066 ( -13.454 5.017 -0.493) 14.367 23.114 ( -2.337 -2.646 -3.667) 5.090 23.370 ( -2.914 -1.312 0.506) 3.235 23.543 ( -8.473 -7.462 6.617) 13.087 24.508 ( -15.644 3.754 0.343) 16.091 24.923 ( -28.340 -18.699 -12.416) 36.152 ======================= Grid point 86 (44/136) ======================= q-point: (-0.12 0.33 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.977 ( -11.336 13.387 7.888) 19.233 1.271 ( -5.668 21.335 5.439) 22.736 1.626 ( -1.962 -13.223 6.390) 14.817 1.917 ( -6.445 -0.354 6.632) 9.254 2.010 ( -6.453 15.756 12.427) 21.079 2.321 ( 18.013 5.640 -14.669) 23.905 2.640 ( 6.685 -6.714 -7.928) 12.354 2.672 ( 2.643 -3.510 2.971) 5.304 2.762 ( -2.131 1.014 -9.097) 9.398 2.862 ( -0.265 3.192 -2.312) 3.950 2.977 ( 1.968 -0.257 0.401) 2.024 3.058 ( -3.414 4.527 1.049) 5.766 3.285 ( -1.588 -3.593 -7.723) 8.665 3.378 ( 0.590 -2.201 2.184) 3.156 3.401 ( 3.951 -0.971 2.881) 4.985 3.594 ( -4.541 3.650 8.432) 10.249 3.675 ( -3.239 -2.453 2.719) 4.889 3.978 ( -2.333 -2.766 -2.249) 4.260 4.121 ( -3.570 4.813 3.202) 6.795 4.168 ( -0.450 10.340 -3.220) 10.839 4.257 ( -2.285 3.790 -0.472) 4.451 4.432 ( -2.008 0.715 0.684) 2.239 4.543 ( -1.827 -5.498 -1.473) 5.978 4.603 ( 2.671 -2.545 7.981) 8.792 4.805 ( 2.086 -6.152 -0.094) 6.496 4.857 ( 1.739 -2.321 -0.623) 2.966 5.040 ( 0.964 -4.987 1.134) 5.204 5.397 ( -0.261 -4.145 0.059) 4.153 5.470 ( -1.948 0.171 4.805) 5.188 5.838 ( -1.253 -10.889 -1.767) 11.103 6.355 ( 2.073 0.142 -9.451) 9.676 6.507 ( 0.670 -7.128 -4.814) 8.627 6.763 ( 10.413 8.678 -10.776) 17.316 7.041 ( 4.471 -1.795 -4.086) 6.317 7.446 ( 0.149 9.128 -6.601) 11.265 7.679 ( -2.616 -0.317 -1.633) 3.100 7.689 ( -2.791 2.397 1.508) 3.976 7.815 ( 1.067 -2.541 -2.729) 3.879 8.026 ( 3.704 1.358 -7.735) 8.683 8.175 ( -0.283 3.114 -2.842) 4.226 8.300 ( 10.179 0.956 -14.400) 17.660 8.392 ( 5.100 -2.991 -9.977) 11.597 8.693 ( 1.110 -2.565 -4.280) 5.112 8.884 ( 5.892 -5.448 -12.988) 15.267 9.417 ( -0.622 4.692 2.505) 5.355 9.538 ( -1.238 0.894 1.785) 2.349 9.768 ( -4.698 3.066 8.043) 9.806 9.856 ( -5.048 7.766 15.407) 17.977 10.059 ( -1.948 1.742 6.441) 6.951 10.123 ( -1.805 3.768 15.661) 16.209 11.898 ( -7.218 -1.156 18.610) 19.994 12.348 ( -5.185 -15.339 23.557) 28.585 14.402 ( 5.185 25.342 -10.551) 27.936 15.420 ( 5.240 -12.075 -0.053) 13.163 16.477 ( 17.160 4.178 -8.927) 19.789 16.882 ( 6.838 -9.659 3.191) 12.257 18.527 ( 19.734 3.288 2.213) 20.128 18.606 ( 41.788 3.170 15.805) 44.789 22.434 ( 6.965 4.162 -3.437) 8.811 22.610 ( 0.807 -1.610 -0.934) 2.028 22.727 ( -16.222 5.323 -4.144) 17.568 22.930 ( -20.964 -6.596 -6.018) 22.786 23.230 ( -13.223 -1.773 -3.405) 13.769 23.326 ( -1.948 -3.773 -1.429) 4.481 24.211 ( -13.217 3.008 0.056) 13.555 24.420 ( -16.074 -6.473 2.606) 17.523 ======================= Grid point 87 (45/136) ======================= q-point: ( 0.00 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.198 ( -7.000 -16.876 1.814) 18.360 1.198 ( -7.000 16.876 1.814) 18.360 1.667 ( -1.823 -15.186 4.561) 15.960 1.667 ( -1.823 15.186 4.561) 15.960 2.337 ( -1.403 -13.695 2.254) 13.950 2.337 ( -1.403 13.695 2.254) 13.950 2.671 ( 9.150 -2.940 -8.307) 12.703 2.671 ( 9.150 2.940 -8.307) 12.703 2.857 ( 0.177 -5.136 -4.051) 6.544 2.857 ( 0.177 5.136 -4.051) 6.544 3.058 ( -0.568 -9.129 -5.302) 10.572 3.058 ( -0.568 9.129 -5.302) 10.572 3.240 ( -2.089 -15.273 3.846) 15.888 3.240 ( -2.089 15.273 3.846) 15.888 3.444 ( 0.010 -2.393 2.362) 3.362 3.444 ( 0.010 2.393 2.362) 3.362 3.805 ( -4.424 -6.225 8.060) 11.103 3.805 ( -4.424 6.225 8.060) 11.103 4.218 ( 0.347 -2.320 -5.342) 5.835 4.218 ( 0.347 2.320 -5.342) 5.835 4.386 ( -2.872 -5.643 0.637) 6.364 4.386 ( -2.872 5.643 0.637) 6.364 4.484 ( 1.896 -5.366 2.732) 6.313 4.484 ( 1.896 5.366 2.732) 6.313 4.839 ( 3.473 -7.869 4.515) 9.714 4.839 ( 3.473 7.869 4.515) 9.714 5.178 ( -0.057 -12.451 0.585) 12.465 5.178 ( -0.057 12.451 0.585) 12.465 5.564 ( -3.517 -8.136 -1.255) 8.952 5.564 ( -3.517 8.136 -1.255) 8.952 6.395 ( 3.785 -3.671 -4.358) 6.841 6.395 ( 3.785 3.671 -4.358) 6.841 7.013 ( 5.367 -5.909 -8.476) 11.643 7.013 ( 5.367 5.909 -8.476) 11.643 7.540 ( -1.965 -4.802 -4.838) 7.094 7.540 ( -1.965 4.802 -4.838) 7.094 7.728 ( -0.994 -4.402 0.248) 4.519 7.728 ( -0.994 4.402 0.248) 4.519 8.115 ( 2.012 -5.717 -8.846) 10.723 8.115 ( 2.012 5.717 -8.846) 10.723 8.387 ( 4.503 -1.727 -4.830) 6.825 8.387 ( 4.503 1.727 -4.830) 6.825 8.763 ( 5.769 -6.486 -11.286) 14.238 8.763 ( 5.769 6.486 -11.286) 14.238 9.494 ( -1.518 -3.015 1.559) 3.718 9.494 ( -1.518 3.015 1.559) 3.718 9.831 ( -3.755 -5.663 3.429) 7.611 9.831 ( -3.755 5.663 3.429) 7.611 10.167 ( -6.757 -5.121 19.062) 20.862 10.167 ( -6.757 5.121 19.062) 20.862 12.051 ( -6.434 -13.825 17.357) 23.104 12.051 ( -6.434 13.825 17.357) 23.104 14.993 ( 2.998 -26.400 -4.428) 26.936 14.993 ( 2.998 26.400 -4.428) 26.936 16.741 ( -0.591 -9.574 -5.393) 11.005 16.741 ( -0.591 9.574 -5.393) 11.005 18.830 ( -7.744 -6.193 -2.967) 10.350 18.830 ( -7.744 6.193 -2.967) 10.350 22.505 ( -3.849 -1.282 -3.503) 5.360 22.505 ( -3.849 1.282 -3.503) 5.360 22.751 ( 13.098 -4.398 5.758) 14.968 22.751 ( 13.098 4.398 5.758) 14.968 23.197 ( -0.242 -4.004 -1.434) 4.260 23.197 ( -0.242 4.004 -1.434) 4.260 24.164 ( -1.841 -4.120 2.134) 4.992 24.164 ( -1.841 4.120 2.134) 4.992 ======================= Grid point 89 (46/136) ======================= q-point: ( 0.12 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.070 ( -5.199 -12.755 -2.614) 14.020 1.070 ( -5.199 12.755 -2.614) 14.020 1.695 ( 0.951 -12.759 5.132) 13.785 1.695 ( 0.951 12.759 5.132) 13.785 2.330 ( -1.077 -12.460 2.006) 12.666 2.330 ( -1.077 12.460 2.006) 12.666 2.704 ( -1.232 -0.902 -4.180) 4.450 2.704 ( -1.232 0.902 -4.180) 4.450 2.842 ( 2.893 -2.279 -5.772) 6.847 2.842 ( 2.893 2.279 -5.772) 6.847 3.027 ( 1.253 -7.555 -6.194) 9.849 3.027 ( 1.253 7.555 -6.194) 9.849 3.235 ( -0.887 -14.838 2.698) 15.107 3.235 ( -0.887 14.838 2.698) 15.107 3.475 ( 1.296 -5.812 3.372) 6.843 3.475 ( 1.296 5.812 3.372) 6.843 3.775 ( -4.195 -2.321 5.625) 7.391 3.775 ( -4.195 2.321 5.625) 7.391 4.210 ( 1.554 -2.947 -2.524) 4.179 4.210 ( 1.554 2.947 -2.524) 4.179 4.340 ( -1.763 -9.649 0.072) 9.809 4.340 ( -1.763 9.649 0.072) 9.809 4.543 ( 2.193 -2.206 3.048) 4.355 4.543 ( 2.193 2.206 3.048) 4.355 4.934 ( 1.360 -7.689 5.830) 9.745 4.934 ( 1.360 7.689 5.830) 9.745 5.175 ( -0.988 -12.951 0.897) 13.020 5.175 ( -0.988 12.951 0.897) 13.020 5.503 ( 0.398 -7.024 -3.547) 7.879 5.503 ( 0.398 7.024 -3.547) 7.879 6.447 ( 3.956 -2.955 -3.828) 6.248 6.447 ( 3.956 2.955 -3.828) 6.248 7.002 ( -0.357 -5.949 -7.165) 9.320 7.002 ( -0.357 5.949 -7.165) 9.320 7.500 ( 2.131 -4.246 -6.746) 8.251 7.500 ( 2.131 4.246 -6.746) 8.251 7.706 ( -1.215 -5.459 0.433) 5.609 7.706 ( -1.215 5.459 0.433) 5.609 8.093 ( 2.564 -3.985 -8.495) 9.727 8.093 ( 2.564 3.985 -8.495) 9.727 8.407 ( 0.898 -1.444 -5.762) 6.008 8.407 ( 0.898 1.444 -5.762) 6.008 8.804 ( 5.866 -5.796 -8.038) 11.515 8.804 ( 5.866 5.796 -8.038) 11.515 9.482 ( -0.838 -3.330 1.808) 3.881 9.482 ( -0.838 3.330 1.808) 3.881 9.770 ( -4.735 -6.320 2.730) 8.356 9.770 ( -4.735 6.320 2.730) 8.356 10.155 ( -8.583 -5.210 18.059) 20.662 10.155 ( -8.583 5.210 18.059) 20.662 12.038 ( -7.700 -13.884 16.251) 22.719 12.038 ( -7.700 13.884 16.251) 22.719 15.011 ( 2.001 -26.034 -4.939) 26.574 15.011 ( 2.001 26.034 -4.939) 26.574 16.523 ( -17.247 -12.772 -6.986) 22.570 16.523 ( -17.247 12.772 -6.986) 22.570 18.462 ( -20.822 -2.677 1.150) 21.025 18.462 ( -20.822 2.677 1.150) 21.025 22.496 ( 3.705 -4.856 -3.579) 7.079 22.496 ( 3.705 4.856 -3.579) 7.079 23.030 ( 7.159 -10.004 1.256) 12.365 23.030 ( 7.159 10.004 1.256) 12.365 23.215 ( 2.512 -3.655 -0.533) 4.467 23.215 ( 2.512 3.655 -0.533) 4.467 24.340 ( 18.993 -7.184 3.620) 20.626 24.340 ( 18.993 7.184 3.620) 20.626 ======================= Grid point 91 (47/136) ======================= q-point: ( 0.25 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.988 ( -0.035 -3.237 -4.463) 5.513 0.988 ( -0.035 3.237 -4.463) 5.513 1.770 ( 2.662 -10.416 4.977) 11.847 1.770 ( 2.662 10.416 4.977) 11.847 2.309 ( -2.357 -8.999 0.848) 9.341 2.309 ( -2.357 8.999 0.848) 9.341 2.650 ( -0.893 -2.640 -1.322) 3.085 2.650 ( -0.893 2.640 -1.322) 3.085 2.845 ( 0.649 -3.426 -4.936) 6.043 2.845 ( 0.649 3.426 -4.936) 6.043 3.000 ( 0.803 -6.438 -5.324) 8.393 3.000 ( 0.803 6.438 -5.324) 8.393 3.245 ( 0.200 -12.162 1.755) 12.290 3.245 ( 0.200 12.163 1.755) 12.290 3.528 ( 0.652 -9.444 3.615) 10.134 3.528 ( 0.652 9.444 3.615) 10.134 3.724 ( -4.197 -3.407 3.526) 6.454 3.724 ( -4.197 3.407 3.526) 6.454 4.227 ( 0.853 -2.378 0.114) 2.529 4.227 ( 0.853 2.378 0.114) 2.529 4.334 ( 1.018 -10.462 0.688) 10.534 4.334 ( 1.018 10.462 0.688) 10.534 4.614 ( 2.996 -0.227 2.161) 3.701 4.614 ( 2.996 0.227 2.161) 3.701 4.950 ( -3.364 -4.990 4.257) 7.372 4.950 ( -3.364 4.990 4.257) 7.372 5.146 ( -2.115 -11.699 -0.308) 11.893 5.146 ( -2.115 11.699 -0.308) 11.893 5.563 ( 7.484 -5.691 -1.752) 9.564 5.563 ( 7.484 5.691 -1.752) 9.564 6.469 ( 0.934 -2.724 -3.882) 4.834 6.469 ( 0.934 2.724 -3.882) 4.834 6.924 ( -1.235 -7.345 -7.886) 10.847 6.924 ( -1.235 7.345 -7.886) 10.847 7.498 ( 1.988 -5.226 -6.303) 8.426 7.498 ( 1.988 5.226 -6.303) 8.426 7.703 ( 0.787 -5.086 0.587) 5.180 7.703 ( 0.787 5.086 0.587) 5.180 8.096 ( 3.564 -1.683 -7.099) 8.120 8.096 ( 3.564 1.683 -7.099) 8.120 8.329 ( -3.766 -2.785 -6.610) 8.101 8.329 ( -3.766 2.785 -6.610) 8.101 8.867 ( 5.719 -4.390 -6.263) 9.550 8.867 ( 5.719 4.390 -6.263) 9.550 9.491 ( 0.027 -3.970 2.777) 4.845 9.491 ( 0.027 3.970 2.777) 4.845 9.699 ( -4.442 -6.686 2.993) 8.567 9.699 ( -4.442 6.686 2.993) 8.567 10.106 ( -9.425 -4.554 16.825) 19.816 10.106 ( -9.425 4.554 16.825) 19.816 11.997 ( -7.821 -12.593 14.343) 20.627 11.997 ( -7.821 12.593 14.343) 20.627 14.983 ( -0.366 -24.608 -7.673) 25.779 14.983 ( -0.366 24.608 -7.673) 25.779 16.076 ( -21.111 -15.884 -2.759) 26.563 16.076 ( -21.111 15.884 -2.759) 26.563 18.182 ( -12.190 -1.012 7.006) 14.097 18.182 ( -12.190 1.012 7.007) 14.097 22.551 ( 3.452 -7.199 -2.555) 8.382 22.551 ( 3.452 7.199 -2.555) 8.382 23.085 ( 3.296 -5.195 -5.342) 8.148 23.085 ( 3.296 5.195 -5.342) 8.148 23.236 ( 0.122 -0.713 -0.497) 0.877 23.236 ( 0.122 0.713 -0.497) 0.877 24.822 ( 23.331 -15.630 3.521) 28.302 24.822 ( 23.331 15.630 3.521) 28.302 ======================= Grid point 93 (48/136) ======================= q-point: ( 0.38 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.010 ( 4.510 -5.759 -2.004) 7.584 1.010 ( 4.510 5.759 -2.004) 7.584 1.853 ( 1.969 -9.621 3.810) 10.534 1.853 ( 1.969 9.621 3.810) 10.534 2.265 ( -2.328 -4.670 0.653) 5.258 2.265 ( -2.328 4.670 0.653) 5.258 2.633 ( -0.745 -3.405 -3.719) 5.097 2.633 ( -0.745 3.405 -3.719) 5.097 2.802 ( -0.167 -4.367 -3.538) 5.622 2.802 ( -0.167 4.367 -3.538) 5.622 3.001 ( 1.432 -3.549 -0.743) 3.899 3.001 ( 1.432 3.549 -0.743) 3.899 3.263 ( 0.494 -13.173 0.841) 13.209 3.263 ( 0.494 13.173 0.841) 13.209 3.545 ( -1.441 -14.016 6.020) 15.322 3.545 ( -1.441 14.016 6.020) 15.322 3.680 ( -2.623 -5.804 1.923) 6.653 3.680 ( -2.623 5.804 1.923) 6.653 4.242 ( 0.216 -0.923 1.421) 1.708 4.242 ( 0.216 0.923 1.421) 1.708 4.376 ( 2.188 -8.674 0.708) 8.974 4.376 ( 2.188 8.674 0.708) 8.974 4.674 ( 1.855 -2.270 -0.211) 2.940 4.674 ( 1.855 2.270 -0.211) 2.940 4.893 ( -4.522 -4.282 2.812) 6.833 4.893 ( -4.522 4.282 2.812) 6.833 5.101 ( -1.391 -13.107 -1.661) 13.285 5.101 ( -1.391 13.107 -1.661) 13.285 5.718 ( 7.578 -6.759 0.201) 10.157 5.718 ( 7.578 6.759 0.201) 10.157 6.433 ( -1.215 -3.529 -3.317) 4.993 6.433 ( -1.215 3.529 -3.317) 4.993 6.855 ( 0.921 -9.695 -9.854) 13.854 6.855 ( 0.921 9.695 -9.854) 13.854 7.487 ( 1.290 -6.661 -3.737) 7.746 7.487 ( 1.290 6.661 -3.737) 7.746 7.740 ( 2.464 -3.656 -0.249) 4.416 7.740 ( 2.464 3.656 -0.249) 4.416 8.104 ( 0.304 -2.968 -3.594) 4.671 8.104 ( 0.304 2.968 -3.594) 4.671 8.215 ( -0.647 -1.143 -7.849) 7.958 8.215 ( -0.647 1.143 -7.849) 7.958 8.914 ( 3.665 -3.351 -6.879) 8.484 8.914 ( 3.665 3.351 -6.879) 8.484 9.512 ( -0.329 -4.248 2.372) 4.877 9.512 ( -0.329 4.248 2.372) 4.877 9.662 ( -1.958 -5.368 5.211) 7.733 9.662 ( -1.958 5.368 5.211) 7.733 10.049 ( -8.674 -3.496 16.130) 18.645 10.049 ( -8.674 3.496 16.130) 18.645 11.957 ( -6.423 -11.125 12.931) 18.227 11.957 ( -6.423 11.125 12.931) 18.227 14.902 ( -0.493 -24.883 -9.116) 26.505 14.902 ( -0.493 24.883 -9.116) 26.505 15.768 ( -10.524 -17.025 3.475) 20.314 15.768 ( -10.524 17.025 3.475) 20.314 18.030 ( -8.863 -3.320 4.100) 10.315 18.030 ( -8.863 3.320 4.100) 10.315 22.569 ( 1.027 -9.220 -4.454) 10.291 22.569 ( 1.027 9.220 -4.454) 10.291 23.149 ( 6.094 -3.303 -0.721) 6.969 23.149 ( 6.094 3.303 -0.721) 6.969 23.233 ( 0.111 -2.457 -0.361) 2.486 23.233 ( 0.111 2.457 -0.361) 2.486 25.186 ( 11.896 -18.417 0.106) 21.925 25.186 ( 11.896 18.417 0.106) 21.925 ======================= Grid point 95 (49/136) ======================= q-point: (-0.50 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.114 ( 5.133 -6.268 3.421) 8.795 1.114 ( 5.133 6.268 3.421) 8.795 1.884 ( -1.358 -11.219 2.615) 11.600 1.884 ( -1.358 11.219 2.615) 11.600 2.236 ( -0.402 -2.927 -1.480) 3.305 2.236 ( -0.402 2.928 -1.480) 3.305 2.545 ( -2.399 -2.396 -7.817) 8.521 2.545 ( -2.399 2.396 -7.817) 8.521 2.828 ( 2.281 -3.711 2.355) 4.952 2.828 ( 2.281 3.711 2.355) 4.952 3.026 ( 1.158 -3.205 -0.070) 3.408 3.026 ( 1.158 3.205 -0.070) 3.408 3.275 ( -0.151 -13.362 2.429) 13.582 3.275 ( -0.151 13.362 2.429) 13.582 3.603 ( 1.928 -7.717 6.755) 10.435 3.603 ( 1.928 7.717 6.755) 10.435 3.633 ( -3.002 -2.332 1.449) 4.068 3.633 ( -3.002 2.332 1.449) 4.068 4.256 ( 0.041 -1.322 1.768) 2.208 4.256 ( 0.041 1.322 1.768) 2.208 4.408 ( 0.186 -7.214 1.074) 7.296 4.408 ( 0.186 7.214 1.074) 7.296 4.666 ( -1.968 -4.662 -2.446) 5.620 4.666 ( -1.968 4.662 -2.446) 5.620 4.831 ( -2.826 -4.905 0.370) 5.673 4.831 ( -2.826 4.905 0.370) 5.673 5.083 ( 0.907 -14.555 -1.657) 14.677 5.083 ( 0.907 14.555 -1.657) 14.677 5.807 ( 0.376 -8.314 1.031) 8.386 5.807 ( 0.376 8.314 1.031) 8.386 6.402 ( 0.955 -3.102 -3.268) 4.606 6.402 ( 0.955 3.102 -3.268) 4.606 6.817 ( 3.127 -10.931 -10.982) 15.808 6.817 ( 3.127 10.931 -10.982) 15.808 7.509 ( 3.072 -7.158 -1.510) 7.935 7.509 ( 3.072 7.158 -1.510) 7.935 7.777 ( 1.433 -1.793 -0.842) 2.445 7.777 ( 1.433 1.793 -0.842) 2.445 8.076 ( 0.685 -6.458 -1.371) 6.638 8.076 ( 0.685 6.458 -1.371) 6.638 8.196 ( 3.218 -2.626 -8.343) 9.320 8.196 ( 3.218 2.626 -8.343) 9.320 8.901 ( 0.850 -3.261 -8.453) 9.100 8.901 ( 0.850 3.261 -8.453) 9.100 9.511 ( -0.916 -4.989 1.744) 5.364 9.511 ( -0.916 4.989 1.744) 5.364 9.700 ( 0.714 -2.934 7.233) 7.838 9.700 ( 0.714 2.934 7.233) 7.838 10.018 ( -6.715 -3.184 16.607) 18.194 10.018 ( -6.715 3.184 16.607) 18.194 11.944 ( -4.678 -10.120 12.982) 17.113 11.944 ( -4.678 10.120 12.982) 17.113 14.873 ( 4.342 -24.917 -7.927) 26.506 14.873 ( 4.342 24.917 -7.927) 26.506 15.705 ( 0.226 -16.950 6.285) 18.079 15.705 ( 0.226 16.950 6.285) 18.079 17.895 ( -5.331 -2.883 -1.733) 6.304 17.895 ( -5.331 2.883 -1.733) 6.304 22.540 ( 0.644 -8.833 -6.586) 11.037 22.540 ( 0.644 8.833 -6.586) 11.037 23.217 ( -0.725 -4.068 0.375) 4.149 23.217 ( -0.725 4.068 0.375) 4.149 23.306 ( 5.731 -2.034 6.337) 8.783 23.306 ( 5.731 2.034 6.337) 8.783 25.266 ( -2.350 -18.183 -3.591) 18.682 25.266 ( -2.350 18.183 -3.591) 18.682 ======================= Grid point 97 (50/136) ======================= q-point: (-0.38 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.235 ( 2.443 -1.003 8.211) 8.625 1.235 ( 2.443 1.003 8.211) 8.625 1.844 ( -4.362 -13.651 2.396) 14.530 1.844 ( -4.362 13.651 2.396) 14.530 2.228 ( 3.336 -6.763 -7.536) 10.662 2.228 ( 3.336 6.763 -7.536) 10.662 2.475 ( -0.579 -2.566 -2.442) 3.590 2.475 ( -0.579 2.566 -2.442) 3.590 2.878 ( 0.980 -2.803 0.788) 3.073 2.878 ( 0.980 2.803 0.788) 3.073 3.050 ( 1.243 -6.984 1.456) 7.242 3.050 ( 1.243 6.984 1.456) 7.242 3.297 ( -0.171 -10.366 3.233) 10.860 3.297 ( -0.171 10.366 3.233) 10.860 3.543 ( -4.056 -6.578 -2.197) 8.034 3.543 ( -4.056 6.578 -2.197) 8.034 3.737 ( 3.304 -10.980 8.943) 14.541 3.737 ( 3.304 10.980 8.943) 14.541 4.273 ( 0.721 -4.213 1.369) 4.488 4.273 ( 0.721 4.213 1.369) 4.488 4.403 ( -2.206 -6.141 3.385) 7.351 4.403 ( -2.206 6.141 3.385) 7.351 4.571 ( -4.731 -5.760 -3.291) 8.148 4.571 ( -4.731 5.760 -3.291) 8.148 4.798 ( 0.079 -7.172 -2.835) 7.713 4.798 ( 0.079 7.172 -2.835) 7.713 5.104 ( 2.098 -14.175 -1.105) 14.372 5.104 ( 2.098 14.175 -1.105) 14.372 5.761 ( -5.258 -9.060 2.449) 10.758 5.761 ( -5.258 9.060 2.449) 10.758 6.415 ( 2.700 -2.172 -4.712) 5.849 6.415 ( 2.700 2.172 -4.712) 5.849 6.813 ( 4.838 -10.159 -11.153) 15.843 6.813 ( 4.838 10.159 -11.153) 15.843 7.577 ( 4.305 -7.054 -0.558) 8.283 7.577 ( 4.305 7.054 -0.558) 8.283 7.776 ( -0.995 -0.889 -0.270) 1.361 7.776 ( -0.995 0.889 -0.270) 1.361 8.130 ( 5.312 -7.910 -2.479) 9.845 8.130 ( 5.312 7.910 -2.479) 9.845 8.192 ( 3.199 -3.323 -8.608) 9.766 8.192 ( 3.199 3.323 -8.608) 9.766 8.835 ( -0.130 -4.073 -10.093) 10.885 8.835 ( -0.130 4.073 -10.093) 10.885 9.511 ( -0.667 -4.885 2.342) 5.458 9.511 ( -0.667 4.885 2.342) 5.458 9.775 ( 1.145 -2.946 7.261) 7.919 9.775 ( 1.145 2.946 7.261) 7.919 10.033 ( -4.909 -3.666 17.885) 18.905 10.033 ( -4.909 3.666 17.885) 18.905 11.964 ( -3.820 -9.758 14.314) 17.740 11.964 ( -3.820 9.758 14.314) 17.740 14.926 ( 5.773 -23.921 -7.713) 25.788 14.926 ( 5.773 23.921 -7.713) 25.788 15.893 ( 14.244 -16.261 8.244) 23.136 15.893 ( 14.244 16.261 8.244) 23.136 17.841 ( 3.253 -1.031 -3.593) 4.955 17.841 ( 3.253 1.031 -3.593) 4.955 22.509 ( 1.286 -7.985 -6.640) 10.464 22.509 ( 1.286 7.985 -6.640) 10.464 23.190 ( -2.048 -3.430 -0.408) 4.016 23.190 ( -2.048 3.430 -0.408) 4.016 23.434 ( 0.140 -2.747 9.411) 9.804 23.434 ( 0.140 2.747 9.411) 9.804 25.052 ( -15.517 -15.679 -6.095) 22.886 25.052 ( -15.517 15.679 -6.095) 22.886 ======================= Grid point 99 (51/136) ======================= q-point: (-0.25 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.307 ( -1.948 -9.828 9.225) 13.620 1.307 ( -1.948 9.828 9.225) 13.620 1.767 ( -5.168 -15.555 2.759) 16.621 1.767 ( -5.168 15.555 2.759) 16.621 2.270 ( 6.998 -4.156 -8.480) 11.753 2.270 ( 6.998 4.156 -8.480) 11.753 2.478 ( 1.551 -4.448 -0.152) 4.713 2.478 ( 1.551 4.448 -0.152) 4.713 2.878 ( 0.290 -3.290 -2.601) 4.205 2.878 ( 0.290 3.290 -2.601) 4.205 3.094 ( 1.076 -10.749 2.699) 11.135 3.094 ( 1.076 10.749 2.699) 11.135 3.295 ( -1.960 -5.214 1.193) 5.696 3.295 ( -1.960 5.214 1.193) 5.696 3.462 ( -2.865 -8.451 -0.099) 8.924 3.462 ( -2.865 8.451 -0.099) 8.924 3.828 ( -0.478 -10.164 7.146) 12.433 3.828 ( -0.478 10.164 7.146) 12.433 4.315 ( 2.029 -7.329 1.160) 7.692 4.315 ( 2.029 7.329 1.160) 7.692 4.367 ( -2.914 -3.682 1.287) 4.869 4.367 ( -2.914 3.682 1.287) 4.869 4.481 ( -3.168 -3.784 1.402) 5.130 4.481 ( -3.168 3.784 1.402) 5.130 4.776 ( 0.650 -7.384 -5.274) 9.097 4.776 ( 0.650 7.384 -5.274) 9.097 5.140 ( 1.818 -12.723 0.068) 12.853 5.140 ( 1.818 12.723 0.068) 12.853 5.680 ( -4.894 -9.306 3.725) 11.154 5.680 ( -4.894 9.306 3.725) 11.154 6.414 ( 1.211 -3.069 -6.409) 7.208 6.414 ( 1.211 3.069 -6.409) 7.208 6.850 ( 7.439 -8.829 -10.541) 15.633 6.850 ( 7.439 8.829 -10.541) 15.633 7.645 ( 2.528 -7.652 -1.092) 8.132 7.645 ( 2.528 7.652 -1.092) 8.132 7.744 ( -1.998 -1.695 0.558) 2.679 7.744 ( -1.998 1.695 0.558) 2.679 8.154 ( 1.686 -6.891 -6.704) 9.761 8.154 ( 1.686 6.891 -6.704) 9.761 8.252 ( 7.279 -5.321 -6.949) 11.384 8.252 ( 7.279 5.321 -6.949) 11.384 8.768 ( 1.925 -5.307 -11.643) 12.939 8.768 ( 1.925 5.307 -11.643) 12.939 9.515 ( -0.911 -4.083 2.603) 4.927 9.515 ( -0.911 4.083 2.603) 4.927 9.838 ( -0.037 -3.918 6.256) 7.382 9.838 ( -0.037 3.918 6.256) 7.382 10.083 ( -4.253 -4.012 19.112) 19.986 10.083 ( -4.253 4.012 19.112) 19.986 12.000 ( -4.077 -10.557 15.990) 19.590 12.000 ( -4.077 10.557 15.990) 19.590 14.959 ( 3.563 -25.292 -7.321) 26.570 14.959 ( 3.563 25.292 -7.321) 26.570 16.320 ( 21.336 -15.136 4.723) 26.583 16.320 ( 21.336 15.136 4.723) 26.583 18.044 ( 20.035 -4.463 2.548) 20.683 18.044 ( 20.035 4.463 2.548) 20.683 22.497 ( 2.212 -6.931 -5.334) 9.021 22.497 ( 2.212 6.931 -5.334) 9.021 23.116 ( -6.244 -0.739 -1.278) 6.417 23.116 ( -6.244 0.739 -1.278) 6.417 23.401 ( -8.992 -4.865 3.569) 10.829 23.401 ( -8.992 4.865 3.569) 10.829 24.639 ( -20.844 -8.910 -3.504) 22.937 24.639 ( -20.844 8.910 -3.504) 22.937 ======================= Grid point 101 (52/136) ======================= q-point: (-0.12 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.292 ( -5.503 -15.517 6.451) 17.683 1.292 ( -5.503 15.517 6.451) 17.683 1.697 ( -4.188 -16.265 3.596) 17.176 1.697 ( -4.188 16.265 3.596) 17.176 2.335 ( 1.879 -8.589 -0.604) 8.812 2.335 ( 1.879 8.589 -0.604) 8.812 2.543 ( 8.437 -4.556 -7.243) 12.016 2.543 ( 8.437 4.556 -7.243) 12.016 2.868 ( 0.912 -5.589 -3.089) 6.451 2.868 ( 0.912 5.589 -3.089) 6.451 3.105 ( -0.568 -11.590 -2.002) 11.775 3.105 ( -0.568 11.590 -2.002) 11.775 3.259 ( -2.596 -10.160 2.920) 10.885 3.259 ( -2.596 10.160 2.920) 10.885 3.435 ( -0.887 -5.316 1.851) 5.698 3.435 ( -0.887 5.316 1.851) 5.698 3.832 ( -3.944 -9.441 7.373) 12.612 3.832 ( -3.944 9.441 7.373) 12.612 4.273 ( -1.923 -1.836 -4.931) 5.602 4.273 ( -1.923 1.836 -4.931) 5.602 4.404 ( 1.534 -10.546 3.230) 11.136 4.404 ( 1.534 10.546 3.230) 11.136 4.449 ( -1.906 -3.554 2.611) 4.805 4.449 ( -1.906 3.554 2.611) 4.805 4.769 ( 1.976 -7.264 -1.330) 7.645 4.769 ( 1.976 7.264 -1.330) 7.645 5.168 ( 0.739 -11.961 0.537) 11.995 5.168 ( 0.739 11.961 0.537) 11.995 5.627 ( -3.430 -9.014 2.444) 9.949 5.627 ( -3.430 9.014 2.444) 9.949 6.384 ( 1.296 -3.505 -6.150) 7.196 6.384 ( 1.296 3.505 -6.150) 7.196 6.937 ( 8.627 -7.051 -9.706) 14.777 6.937 ( 8.627 7.051 -9.706) 14.777 7.623 ( -2.810 -6.437 -2.825) 7.571 7.623 ( -2.810 6.437 -2.825) 7.571 7.733 ( -0.029 -2.539 0.795) 2.660 7.733 ( -0.029 2.539 0.795) 2.660 8.137 ( 2.200 -6.788 -8.261) 10.916 8.137 ( 2.200 6.788 -8.261) 10.916 8.327 ( 5.510 -3.695 -5.803) 8.814 8.327 ( 5.510 3.695 -5.803) 8.814 8.746 ( 4.887 -6.282 -12.646) 14.942 8.746 ( 4.887 6.282 -12.646) 14.942 9.510 ( -1.423 -3.300 2.142) 4.184 9.510 ( -1.423 3.300 2.142) 4.184 9.859 ( -2.043 -4.879 4.733) 7.098 9.859 ( -2.043 4.879 4.733) 7.098 10.138 ( -4.980 -4.537 19.516) 20.646 10.138 ( -4.980 4.537 19.516) 20.646 12.035 ( -5.059 -12.336 17.179) 21.746 12.035 ( -5.059 12.336 17.179) 21.746 14.972 ( 2.997 -26.084 -5.781) 26.885 14.972 ( 2.997 26.084 -5.781) 26.885 16.659 ( 11.810 -10.562 -2.671) 16.068 16.659 ( 11.810 10.562 -2.671) 16.068 18.595 ( 26.874 -2.674 5.955) 27.656 18.595 ( 26.874 2.674 5.955) 27.656 22.529 ( 4.311 -4.684 -1.759) 6.604 22.529 ( 4.311 4.684 -1.759) 6.604 22.834 ( -19.064 -4.248 -4.853) 20.125 22.834 ( -19.064 4.248 -4.853) 20.125 23.247 ( -4.556 -2.931 -1.125) 5.533 23.247 ( -4.556 2.931 -1.125) 5.533 24.298 ( -13.080 -4.992 2.447) 14.213 24.298 ( -13.080 4.992 2.447) 14.213 ======================= Grid point 119 (53/136) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.679 ( -10.072 0.000 18.528) 21.089 1.010 ( -4.099 0.000 22.242) 22.616 1.917 ( -5.707 0.000 5.305) 7.791 1.949 ( -14.232 0.000 37.482) 40.093 2.100 ( 13.992 0.000 -11.151) 17.892 2.319 ( -6.362 0.000 -3.943) 7.485 2.347 ( -4.540 0.000 1.370) 4.742 2.558 ( -1.639 0.000 -9.851) 9.986 2.616 ( 0.163 0.000 -0.492) 0.518 2.722 ( -1.812 0.000 -7.394) 7.613 2.846 ( 8.750 0.000 -2.675) 9.150 3.081 ( -3.976 0.000 1.192) 4.151 3.137 ( 4.394 0.000 -13.220) 13.931 3.153 ( -0.807 0.000 5.025) 5.089 3.499 ( -3.541 0.000 3.134) 4.728 3.528 ( -2.790 0.000 3.829) 4.738 3.652 ( -1.848 0.000 14.131) 14.251 3.726 ( 2.930 0.000 -5.188) 5.958 4.023 ( 3.444 0.000 6.380) 7.250 4.149 ( -0.915 0.000 -4.422) 4.516 4.248 ( 1.424 0.000 1.686) 2.207 4.500 ( 0.530 0.000 0.950) 1.088 4.736 ( -0.699 0.000 0.244) 0.741 4.763 ( 6.544 0.000 3.619) 7.479 4.878 ( -0.620 0.000 2.292) 2.374 5.189 ( -0.877 0.000 2.423) 2.577 5.340 ( 5.362 0.000 -1.716) 5.630 5.523 ( -2.235 0.000 14.110) 14.286 5.777 ( 2.851 0.000 -7.299) 7.836 5.828 ( 3.950 0.000 -9.343) 10.144 6.259 ( -2.491 0.000 -2.327) 3.409 6.455 ( -3.291 0.000 -0.266) 3.302 6.663 ( 2.654 0.000 7.394) 7.856 7.023 ( 1.130 0.000 -0.485) 1.230 7.033 ( 4.316 0.000 -0.790) 4.387 7.538 ( -0.722 0.000 -6.145) 6.188 7.618 ( 2.879 0.000 -6.564) 7.167 7.663 ( 2.173 0.000 -4.086) 4.628 7.792 ( -0.212 0.000 -6.062) 6.066 7.996 ( -1.259 0.000 -0.301) 1.294 8.276 ( 4.411 0.000 -8.771) 9.817 8.465 ( -1.733 0.000 -8.044) 8.228 8.500 ( 5.449 0.000 -11.087) 12.353 8.921 ( 1.517 0.000 -1.700) 2.278 9.376 ( -1.559 0.000 3.872) 4.174 9.633 ( -1.069 0.000 10.482) 10.536 9.655 ( -2.886 0.000 -0.114) 2.888 9.806 ( -6.982 0.000 6.318) 9.416 9.941 ( -4.616 0.000 12.641) 13.457 10.214 ( 1.792 0.000 -1.590) 2.396 12.524 ( 7.906 0.000 -19.348) 20.901 12.701 ( -1.578 0.000 10.073) 10.196 14.404 ( -4.617 0.000 12.231) 13.073 14.611 ( -24.980 0.000 -12.270) 27.831 17.168 ( 0.075 0.000 -0.406) 0.413 17.268 ( 14.844 0.000 17.261) 22.766 18.548 ( -0.873 0.000 -2.353) 2.510 18.579 ( -66.222 0.000 -10.038) 66.978 22.256 ( 0.185 0.000 -8.468) 8.470 22.500 ( 1.129 0.000 1.246) 1.681 22.558 ( -3.974 0.000 1.508) 4.250 23.116 ( 13.282 0.000 -2.898) 13.595 23.297 ( 34.316 0.000 4.347) 34.590 23.361 ( 0.996 0.000 -2.258) 2.468 24.056 ( 4.496 0.000 1.659) 4.793 24.461 ( 1.242 0.000 3.047) 3.290 ======================= Grid point 120 (54/136) ======================= q-point: ( 0.12 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.791 ( 9.097 0.000 12.003) 15.061 1.141 ( 1.124 0.000 19.351) 19.384 1.867 ( -3.145 0.000 4.352) 5.370 1.929 ( -9.192 0.000 10.778) 14.165 2.118 ( -11.384 0.000 27.736) 29.981 2.174 ( -10.619 0.000 -0.781) 10.648 2.290 ( 8.251 0.000 -19.626) 21.289 2.563 ( 6.732 0.000 -7.156) 9.825 2.612 ( -1.240 0.000 2.755) 3.021 2.678 ( 1.326 0.000 -3.427) 3.674 2.992 ( -0.854 0.000 0.232) 0.885 3.020 ( 3.372 0.000 1.367) 3.638 3.150 ( 7.179 0.000 -11.103) 13.222 3.151 ( -2.957 0.000 4.190) 5.129 3.428 ( -5.926 0.000 4.510) 7.447 3.513 ( -2.114 0.000 5.111) 5.531 3.734 ( 3.615 0.000 -8.258) 9.015 3.780 ( 4.027 0.000 11.198) 11.900 4.115 ( 0.002 0.000 -3.080) 3.080 4.142 ( 3.892 0.000 4.140) 5.682 4.255 ( -0.804 0.000 -0.629) 1.021 4.509 ( 0.553 0.000 -1.527) 1.624 4.708 ( -2.505 0.000 0.835) 2.640 4.871 ( -1.955 0.000 3.471) 3.984 4.937 ( 10.295 0.000 -4.724) 11.327 5.203 ( 0.023 0.000 2.785) 2.785 5.453 ( 8.057 0.000 -1.669) 8.228 5.570 ( -5.398 0.000 17.425) 18.242 5.756 ( 2.375 0.000 -10.576) 10.839 5.793 ( -1.551 0.000 -7.542) 7.699 6.191 ( -2.342 0.000 -2.687) 3.565 6.363 ( -4.718 0.000 -3.061) 5.624 6.771 ( 2.046 0.000 8.059) 8.314 7.038 ( 0.956 0.000 -0.753) 1.217 7.096 ( 2.823 0.000 -1.695) 3.292 7.509 ( 2.490 0.000 -6.166) 6.650 7.644 ( 4.339 0.000 -5.640) 7.116 7.700 ( 3.776 0.000 -2.441) 4.496 7.722 ( -0.547 0.000 -10.275) 10.289 7.963 ( -2.247 0.000 1.003) 2.461 8.245 ( -0.681 0.000 -8.526) 8.553 8.406 ( 0.972 0.000 -5.985) 6.063 8.509 ( 3.866 0.000 -11.236) 11.882 8.949 ( 2.078 0.000 -0.406) 2.117 9.372 ( -1.675 0.000 3.697) 4.059 9.585 ( -4.369 0.000 1.197) 4.530 9.683 ( -4.311 0.000 10.699) 11.535 9.736 ( -2.566 0.000 6.686) 7.162 9.928 ( -5.904 0.000 12.073) 13.440 10.218 ( -0.430 0.000 -1.439) 1.502 12.533 ( 7.692 0.000 -19.362) 20.834 12.711 ( -5.981 0.000 9.567) 11.283 13.795 ( -51.453 0.000 17.398) 54.315 14.405 ( -4.527 0.000 12.208) 13.020 17.166 ( 0.020 0.000 -0.380) 0.381 17.365 ( -39.328 0.000 8.331) 40.201 17.762 ( 7.071 0.000 21.096) 22.250 18.369 ( -14.638 0.000 -1.715) 14.738 22.172 ( -1.825 0.000 -8.211) 8.412 22.559 ( 2.255 0.000 3.036) 3.782 22.657 ( 13.032 0.000 0.616) 13.046 23.210 ( 2.615 0.000 -3.724) 4.550 23.367 ( 1.334 0.000 -2.257) 2.622 23.436 ( -10.293 0.000 -8.506) 13.353 24.145 ( 7.644 0.000 -1.062) 7.718 25.116 ( 47.871 0.000 -11.951) 49.340 ======================= Grid point 121 (55/136) ======================= q-point: ( 0.25 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.105 ( 15.860 0.000 0.683) 15.874 1.302 ( 1.547 0.000 15.076) 15.155 1.797 ( -5.865 0.000 1.083) 5.964 1.849 ( -1.109 0.000 1.933) 2.228 2.034 ( -3.289 0.000 2.788) 4.312 2.147 ( -7.964 0.000 11.255) 13.787 2.218 ( -5.748 0.000 6.703) 8.830 2.578 ( -1.850 0.000 1.567) 2.424 2.659 ( 2.484 0.000 1.777) 3.054 2.735 ( 5.354 0.000 -0.126) 5.356 2.960 ( -2.375 0.000 9.565) 9.856 3.080 ( 3.597 0.000 -6.825) 7.715 3.108 ( -3.929 0.000 3.123) 5.019 3.259 ( 8.724 0.000 -8.045) 11.867 3.362 ( -3.651 0.000 4.235) 5.591 3.517 ( -1.169 0.000 3.950) 4.120 3.759 ( 5.666 0.000 -8.805) 10.471 3.938 ( 4.403 0.000 8.374) 9.461 4.084 ( -2.521 0.000 0.798) 2.645 4.214 ( 1.152 0.000 1.653) 2.015 4.242 ( 1.637 0.000 -3.701) 4.047 4.500 ( 0.382 0.000 -3.321) 3.343 4.657 ( -3.256 0.000 0.847) 3.364 4.846 ( -2.359 0.000 1.084) 2.596 5.056 ( 6.602 0.000 -8.248) 10.565 5.218 ( -0.539 0.000 2.480) 2.538 5.556 ( -8.508 0.000 15.809) 17.953 5.620 ( 9.811 0.000 -3.746) 10.501 5.669 ( -5.864 0.000 -4.060) 7.132 5.732 ( 2.631 0.000 -9.331) 9.695 6.132 ( -2.112 0.000 -1.465) 2.571 6.244 ( -3.403 0.000 -5.907) 6.817 6.862 ( 2.854 0.000 4.317) 5.175 7.033 ( -1.291 0.000 -1.479) 1.964 7.108 ( 0.481 0.000 -3.890) 3.920 7.541 ( 5.242 0.000 -6.234) 8.145 7.623 ( -1.151 0.000 -8.756) 8.831 7.694 ( 4.098 0.000 -3.673) 5.503 7.779 ( 5.227 0.000 -2.963) 6.008 7.929 ( -1.554 0.000 1.033) 1.866 8.169 ( -0.510 0.000 -7.293) 7.310 8.388 ( 0.849 0.000 -4.305) 4.388 8.486 ( 2.479 0.000 -11.517) 11.781 8.988 ( 1.408 0.000 1.046) 1.754 9.369 ( -1.001 0.000 2.544) 2.734 9.528 ( -2.753 0.000 3.788) 4.683 9.627 ( -6.941 0.000 10.174) 12.316 9.802 ( 1.151 0.000 8.405) 8.483 9.895 ( -6.258 0.000 11.452) 13.050 10.174 ( -2.930 0.000 -1.522) 3.302 12.536 ( 7.328 0.000 -19.495) 20.827 12.573 ( -15.991 0.000 13.749) 21.089 13.178 ( -28.054 0.000 28.054) 39.674 14.408 ( -4.481 0.000 12.115) 12.917 16.817 ( -21.203 0.000 2.822) 21.390 17.165 ( 0.138 0.000 -0.321) 0.350 18.008 ( -3.187 0.000 19.547) 19.805 18.030 ( -17.696 0.000 -0.587) 17.705 22.077 ( -1.557 0.000 -8.103) 8.251 22.703 ( 8.278 0.000 7.919) 11.456 22.948 ( 15.416 0.000 -0.531) 15.426 23.053 ( -10.669 0.000 -6.935) 12.725 23.290 ( 2.115 0.000 -7.123) 7.430 23.376 ( 1.219 0.000 -2.239) 2.550 24.354 ( 12.948 0.000 -1.068) 12.992 25.747 ( 27.399 0.000 -14.074) 30.802 ======================= Grid point 122 (56/136) ======================= q-point: ( 0.38 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( 10.745 0.000 -6.833) 12.734 1.395 ( -2.357 0.000 11.416) 11.657 1.642 ( -12.641 0.000 -9.261) 15.670 1.887 ( 3.800 0.000 3.675) 5.287 2.012 ( 3.636 0.000 -6.502) 7.450 2.066 ( 1.774 0.000 5.824) 6.088 2.268 ( -12.252 0.000 41.936) 43.690 2.554 ( -2.370 0.000 3.441) 4.179 2.716 ( 1.433 0.000 3.541) 3.819 2.829 ( 2.896 0.000 2.167) 3.616 3.020 ( 0.729 0.000 6.433) 6.474 3.063 ( -2.648 0.000 2.958) 3.970 3.109 ( 4.359 0.000 -3.577) 5.639 3.293 ( 2.293 0.000 -9.945) 10.206 3.365 ( 0.679 0.000 1.709) 1.839 3.518 ( -1.181 0.000 2.513) 2.777 3.821 ( 6.675 0.000 -8.427) 10.750 4.011 ( -4.398 0.000 5.402) 6.966 4.089 ( 4.218 0.000 2.397) 4.851 4.214 ( -1.684 0.000 0.238) 1.700 4.261 ( 2.406 0.000 -1.920) 3.078 4.465 ( -1.587 0.000 -4.854) 5.107 4.602 ( -2.538 0.000 0.353) 2.562 4.800 ( -1.649 0.000 -1.964) 2.565 5.079 ( 2.420 0.000 -8.634) 8.966 5.221 ( -0.519 0.000 1.268) 1.370 5.491 ( -9.234 0.000 14.508) 17.197 5.555 ( -3.256 0.000 -0.492) 3.293 5.678 ( -1.176 0.000 -8.470) 8.552 5.705 ( 1.324 0.000 -9.056) 9.152 6.099 ( -0.421 0.000 -0.071) 0.427 6.216 ( 6.034 0.000 -4.340) 7.432 6.926 ( -0.186 0.000 -1.963) 1.972 6.972 ( -0.616 0.000 -1.885) 1.983 7.063 ( -1.340 0.000 -5.359) 5.524 7.571 ( 1.359 0.000 -5.232) 5.406 7.606 ( 6.356 0.000 -7.916) 10.152 7.744 ( 2.834 0.000 -0.669) 2.912 7.823 ( -0.078 0.000 1.045) 1.048 7.953 ( 4.794 0.000 -2.849) 5.576 8.123 ( 0.751 0.000 -6.612) 6.654 8.386 ( 2.136 0.000 -2.951) 3.643 8.440 ( 1.511 0.000 -11.291) 11.391 9.012 ( -0.065 0.000 1.780) 1.781 9.366 ( -0.726 0.000 0.659) 0.981 9.546 ( 0.634 0.000 6.166) 6.198 9.582 ( -5.936 0.000 11.379) 12.834 9.859 ( -5.888 0.000 11.010) 12.486 9.879 ( 0.376 0.000 8.133) 8.142 10.093 ( -3.633 0.000 -1.814) 4.061 12.431 ( -9.910 0.000 22.352) 24.451 12.531 ( 7.011 0.000 -19.683) 20.895 12.989 ( -14.196 0.000 22.972) 27.005 14.409 ( -4.496 0.000 12.013) 12.827 16.548 ( -8.581 0.000 1.784) 8.765 17.168 ( 0.364 0.000 -0.265) 0.451 17.737 ( -11.195 0.000 0.196) 11.197 17.871 ( -19.382 0.000 5.167) 20.059 22.004 ( 0.700 0.000 -8.864) 8.891 22.777 ( -6.677 0.000 2.487) 7.125 23.075 ( 12.797 0.000 5.837) 14.065 23.198 ( 10.547 0.000 -1.497) 10.653 23.315 ( 5.690 0.000 -2.270) 6.126 23.375 ( -0.012 0.000 -2.104) 2.104 24.573 ( 9.312 0.000 -0.366) 9.319 26.011 ( 11.300 0.000 -13.696) 17.756 ======================= Grid point 123 (57/136) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.237 ( -9.675 0.000 -18.237) 20.644 1.373 ( -7.885 0.000 9.843) 12.611 1.465 ( 1.575 0.000 -5.698) 5.912 2.045 ( 7.027 0.000 8.221) 10.815 2.129 ( 2.962 0.000 12.809) 13.147 2.144 ( 1.753 0.000 4.524) 4.852 2.342 ( -9.403 0.000 35.196) 36.430 2.540 ( -1.953 0.000 4.106) 4.546 2.758 ( -0.273 0.000 4.113) 4.122 2.880 ( 1.818 0.000 0.432) 1.869 3.053 ( -0.934 0.000 3.276) 3.407 3.058 ( 0.333 0.000 0.100) 0.347 3.149 ( 2.353 0.000 -10.535) 10.794 3.257 ( 2.160 0.000 -6.397) 6.752 3.399 ( 1.313 0.000 3.828) 4.047 3.515 ( -1.103 0.000 3.462) 3.633 3.864 ( 3.352 0.000 -7.903) 8.585 3.942 ( -5.518 0.000 3.405) 6.484 4.151 ( -3.992 0.000 -2.360) 4.637 4.182 ( 3.515 0.000 0.697) 3.584 4.315 ( 2.989 0.000 1.144) 3.200 4.364 ( -3.957 0.000 -3.301) 5.153 4.581 ( 0.122 0.000 1.210) 1.216 4.757 ( -1.241 0.000 -4.892) 5.047 5.037 ( 1.069 0.000 -10.431) 10.486 5.214 ( -0.899 0.000 -0.053) 0.901 5.430 ( -9.079 0.000 18.232) 20.367 5.500 ( -9.860 0.000 -0.240) 9.863 5.554 ( 4.000 0.000 -5.850) 7.087 5.658 ( 2.519 0.000 -12.797) 13.043 6.115 ( 1.487 0.000 0.993) 1.788 6.358 ( 9.568 0.000 -4.476) 10.563 6.823 ( -4.012 0.000 -5.778) 7.034 6.991 ( -1.777 0.000 -5.369) 5.655 6.996 ( 1.740 0.000 -2.294) 2.880 7.590 ( 2.825 0.000 -2.484) 3.762 7.653 ( 4.839 0.000 -9.310) 10.493 7.793 ( 1.643 0.000 1.106) 1.980 7.831 ( 0.508 0.000 2.036) 2.098 8.027 ( 4.564 0.000 -4.393) 6.334 8.099 ( 1.709 0.000 -5.733) 5.982 8.388 ( 1.885 0.000 -10.737) 10.902 8.433 ( 4.805 0.000 -2.956) 5.641 9.012 ( -1.028 0.000 1.046) 1.467 9.346 ( -1.484 0.000 0.223) 1.501 9.562 ( -5.106 0.000 12.122) 13.154 9.625 ( 1.869 0.000 7.155) 7.395 9.830 ( -5.499 0.000 11.099) 12.387 9.932 ( -1.009 0.000 7.648) 7.715 10.034 ( -0.298 0.000 -2.346) 2.364 12.521 ( 6.926 0.000 -19.817) 20.992 12.536 ( 1.827 0.000 24.060) 24.130 12.934 ( -8.827 0.000 27.111) 28.512 14.410 ( -4.554 0.000 11.965) 12.802 16.518 ( 3.246 0.000 5.213) 6.141 17.172 ( 0.140 0.000 -0.245) 0.283 17.429 ( -22.638 0.000 -7.010) 23.698 17.635 ( 0.882 0.000 0.462) 0.995 21.980 ( 3.576 0.000 -8.931) 9.620 22.687 ( -4.439 0.000 3.027) 5.373 23.220 ( 4.007 0.000 -6.884) 7.965 23.316 ( -0.279 0.000 -2.548) 2.564 23.338 ( 0.644 0.000 -1.347) 1.493 23.590 ( 12.291 0.000 17.648) 21.506 24.689 ( 2.112 0.000 1.541) 2.614 25.998 ( -0.576 0.000 -18.405) 18.414 ======================= Grid point 124 (58/136) ======================= q-point: (-0.38 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.087 ( 7.566 0.000 -12.196) 14.352 1.249 ( -12.396 0.000 11.551) 16.944 1.371 ( -6.377 0.000 -4.617) 7.873 2.156 ( -3.895 0.000 8.712) 9.543 2.226 ( -13.888 0.000 35.232) 37.871 2.261 ( 8.213 0.000 2.713) 8.650 2.439 ( 1.632 0.000 14.837) 14.926 2.536 ( -1.200 0.000 3.179) 3.398 2.764 ( -2.147 0.000 4.078) 4.609 2.918 ( 3.639 0.000 -4.103) 5.485 2.941 ( -4.833 0.000 -15.312) 16.057 3.064 ( -0.801 0.000 3.529) 3.619 3.156 ( 4.280 0.000 -5.095) 6.654 3.259 ( 1.993 0.000 -7.221) 7.491 3.464 ( 0.585 0.000 6.783) 6.808 3.532 ( -0.778 0.000 6.258) 6.306 3.816 ( -2.224 0.000 -8.403) 8.692 3.856 ( -5.933 0.000 3.757) 7.023 4.050 ( -3.940 0.000 -1.856) 4.355 4.238 ( 1.244 0.000 0.400) 1.307 4.254 ( 0.177 0.000 -6.709) 6.711 4.442 ( 3.516 0.000 8.707) 9.390 4.622 ( 2.601 0.000 1.612) 3.060 4.635 ( -5.430 0.000 -9.734) 11.146 4.981 ( 0.483 0.000 -10.173) 10.184 5.185 ( -0.513 0.000 -2.252) 2.309 5.338 ( -6.189 0.000 1.270) 6.318 5.412 ( -7.552 0.000 20.255) 21.617 5.631 ( 5.637 0.000 -1.353) 5.797 5.635 ( 5.636 0.000 -13.906) 15.004 6.164 ( 2.493 0.000 1.821) 3.087 6.471 ( 5.756 0.000 -6.119) 8.401 6.717 ( -2.772 0.000 -5.078) 5.785 6.929 ( -0.604 0.000 -4.384) 4.426 6.997 ( 0.559 0.000 -2.963) 3.015 7.620 ( 2.107 0.000 -2.722) 3.442 7.661 ( 2.892 0.000 -8.385) 8.870 7.796 ( -1.708 0.000 -1.079) 2.021 7.882 ( 3.091 0.000 1.721) 3.538 8.036 ( -0.477 0.000 -4.673) 4.697 8.116 ( 3.962 0.000 -4.732) 6.172 8.374 ( 4.970 0.000 -10.502) 11.618 8.513 ( 5.840 0.000 -4.748) 7.526 8.986 ( -1.601 0.000 -0.892) 1.832 9.330 ( -0.447 0.000 1.733) 1.790 9.559 ( -4.471 0.000 12.174) 12.969 9.695 ( -0.296 0.000 6.188) 6.195 9.824 ( -3.384 0.000 12.083) 12.548 9.952 ( -2.539 0.000 7.167) 7.604 10.050 ( 3.516 0.000 -2.640) 4.397 12.511 ( 7.144 0.000 -19.801) 21.050 12.668 ( -2.877 0.000 8.811) 9.269 13.255 ( 16.002 0.000 48.733) 51.293 14.409 ( -4.632 0.000 11.989) 12.853 16.780 ( 17.000 0.000 16.185) 23.473 16.996 ( -13.966 0.000 -8.375) 16.285 17.170 ( -0.046 0.000 -0.265) 0.268 17.776 ( 12.863 0.000 0.224) 12.865 22.007 ( 5.803 0.000 -8.791) 10.534 22.642 ( -3.069 0.000 4.022) 5.059 23.166 ( -11.100 0.000 -1.435) 11.192 23.217 ( 1.666 0.000 -8.063) 8.233 23.366 ( 1.428 0.000 -2.184) 2.609 23.870 ( 2.852 0.000 13.220) 13.524 24.681 ( -5.418 0.000 4.806) 7.242 25.700 ( -13.329 0.000 -28.099) 31.100 ======================= Grid point 125 (59/136) ======================= q-point: (-0.25 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.092 ( -13.556 0.000 16.175) 21.104 1.093 ( -12.353 0.000 4.351) 13.097 1.405 ( 21.696 0.000 -10.442) 24.077 2.100 ( -6.758 0.000 5.958) 9.009 2.129 ( -22.429 0.000 39.513) 45.435 2.385 ( 2.500 0.000 0.121) 2.503 2.548 ( 1.356 0.000 1.077) 1.732 2.564 ( -0.251 0.000 7.595) 7.599 2.737 ( -3.467 0.000 3.459) 4.898 2.747 ( -1.582 0.000 -14.106) 14.195 2.946 ( 2.787 0.000 -8.772) 9.204 3.072 ( -0.389 0.000 3.613) 3.634 3.179 ( 3.780 0.000 -11.435) 12.043 3.228 ( 0.019 0.000 -6.489) 6.489 3.501 ( -2.203 0.000 7.730) 8.038 3.579 ( -0.495 0.000 9.530) 9.542 3.687 ( -3.697 0.000 -7.268) 8.154 3.767 ( -7.126 0.000 5.763) 9.165 3.983 ( -2.572 0.000 0.258) 2.585 4.209 ( -0.717 0.000 -0.828) 1.095 4.277 ( 0.572 0.000 -2.773) 2.831 4.459 ( -1.188 0.000 -7.859) 7.948 4.577 ( 0.624 0.000 10.292) 10.311 4.686 ( 2.739 0.000 0.707) 2.829 4.902 ( -1.582 0.000 -5.475) 5.699 5.191 ( 3.099 0.000 -3.408) 4.607 5.262 ( -3.595 0.000 2.240) 4.236 5.427 ( -4.683 0.000 15.893) 16.568 5.675 ( 6.814 0.000 -8.889) 11.200 5.729 ( 5.800 0.000 -3.431) 6.739 6.234 ( 2.790 0.000 2.750) 3.918 6.500 ( 2.062 0.000 -4.998) 5.406 6.639 ( -2.085 0.000 -3.399) 3.987 6.914 ( 1.929 0.000 -2.944) 3.520 6.988 ( 0.648 0.000 -1.825) 1.937 7.638 ( 2.482 0.000 -3.970) 4.682 7.647 ( 1.723 0.000 -7.272) 7.473 7.722 ( -3.709 0.000 -3.423) 5.047 7.934 ( -1.791 0.000 -0.963) 2.034 7.976 ( 1.014 0.000 -2.461) 2.662 8.169 ( 5.342 0.000 -6.058) 8.077 8.414 ( 6.772 0.000 -10.851) 12.791 8.569 ( 4.033 0.000 -7.357) 8.390 8.945 ( -1.246 0.000 -2.004) 2.360 9.351 ( 0.324 0.000 2.913) 2.931 9.567 ( -3.704 0.000 11.670) 12.244 9.708 ( -1.562 0.000 3.528) 3.858 9.870 ( -2.029 0.000 12.994) 13.151 9.937 ( -4.213 0.000 6.689) 7.905 10.113 ( 4.476 0.000 -2.394) 5.077 12.508 ( 7.531 0.000 -19.647) 21.041 12.650 ( -3.689 0.000 7.499) 8.358 14.107 ( 34.711 0.000 31.840) 47.103 14.407 ( -4.693 0.000 12.071) 12.952 16.802 ( -0.783 0.000 -2.120) 2.260 17.168 ( 0.127 0.000 -0.324) 0.348 17.547 ( 43.702 0.000 41.921) 60.558 18.095 ( 18.811 0.000 -0.562) 18.820 22.068 ( 6.967 0.000 -8.779) 11.207 22.626 ( -1.757 0.000 4.498) 4.829 22.890 ( -15.729 0.000 -0.503) 15.737 23.168 ( -0.888 0.000 -7.095) 7.150 23.367 ( 0.608 0.000 -2.273) 2.353 23.828 ( -13.364 0.000 -6.325) 14.785 24.489 ( -18.453 0.000 -4.025) 18.887 25.107 ( -24.145 0.000 -19.403) 30.976 ======================= Grid point 126 (60/136) ======================= q-point: (-0.12 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.851 ( -17.130 0.000 12.421) 21.160 0.991 ( -10.423 0.000 21.056) 23.494 1.796 ( 23.748 0.000 -11.309) 26.303 2.000 ( -20.209 0.000 40.623) 45.372 2.004 ( -7.156 0.000 5.509) 9.031 2.382 ( -0.230 0.000 -2.955) 2.964 2.481 ( -6.486 0.000 -3.723) 7.478 2.592 ( 1.739 0.000 0.176) 1.748 2.678 ( -4.355 0.000 0.380) 4.372 2.739 ( 4.504 0.000 -2.826) 5.318 2.858 ( -3.388 0.000 -11.584) 12.070 3.115 ( 1.224 0.000 3.791) 3.984 3.145 ( 0.648 0.000 -9.358) 9.381 3.166 ( 0.280 0.000 -8.100) 8.105 3.509 ( -1.925 0.000 6.076) 6.373 3.569 ( -4.036 0.000 2.358) 4.674 3.671 ( -8.088 0.000 10.198) 13.016 3.676 ( 3.449 0.000 1.146) 3.635 3.958 ( -0.670 0.000 3.079) 3.151 4.206 ( 0.507 0.000 1.663) 1.738 4.214 ( -2.491 0.000 -4.020) 4.730 4.470 ( 2.243 0.000 0.400) 2.279 4.649 ( 1.097 0.000 7.478) 7.558 4.729 ( 1.311 0.000 0.067) 1.313 4.871 ( 0.015 0.000 0.096) 0.097 5.205 ( -2.072 0.000 1.894) 2.807 5.260 ( 4.320 0.000 -2.553) 5.018 5.465 ( -2.200 0.000 12.704) 12.893 5.744 ( 5.251 0.000 -5.692) 7.744 5.797 ( 5.413 0.000 -7.452) 9.210 6.290 ( 0.424 0.000 1.492) 1.552 6.493 ( -0.287 0.000 -1.466) 1.493 6.600 ( -0.069 0.000 0.838) 0.841 6.957 ( 4.013 0.000 -1.520) 4.291 7.000 ( 1.375 0.000 -0.480) 1.456 7.619 ( -2.911 0.000 -4.512) 5.370 7.627 ( 1.296 0.000 -7.405) 7.518 7.656 ( 2.456 0.000 -4.713) 5.315 7.848 ( -2.707 0.000 -3.545) 4.461 8.005 ( 0.912 0.000 -0.593) 1.088 8.229 ( 6.102 0.000 -7.897) 9.980 8.464 ( 6.586 0.000 -11.164) 12.961 8.551 ( 0.229 0.000 -8.823) 8.826 8.918 ( 0.169 0.000 -2.118) 2.125 9.372 ( -0.680 0.000 3.478) 3.544 9.589 ( -2.513 0.000 10.957) 11.242 9.695 ( -1.541 0.000 0.835) 1.753 9.887 ( -5.913 0.000 6.312) 8.649 9.919 ( -2.974 0.000 13.061) 13.395 10.176 ( 3.466 0.000 -1.968) 3.986 12.514 ( 7.846 0.000 -19.460) 20.982 12.657 ( -1.741 0.000 8.903) 9.071 14.405 ( -4.690 0.000 12.171) 13.044 14.754 ( 18.254 0.000 -8.941) 20.326 16.922 ( 10.217 0.000 7.615) 12.743 17.169 ( 0.163 0.000 -0.383) 0.416 18.425 ( 14.145 0.000 -1.728) 14.250 18.928 ( 49.743 0.000 18.813) 53.182 22.156 ( 9.628 0.000 -5.336) 11.008 22.606 ( -11.921 0.000 0.656) 11.939 22.655 ( 2.625 0.000 6.169) 6.705 22.978 ( -33.938 0.000 -17.075) 37.991 23.164 ( -11.047 0.000 -6.147) 12.642 23.362 ( 0.623 0.000 -2.269) 2.353 24.111 ( -10.379 0.000 -1.047) 10.431 24.684 ( -18.620 0.000 6.690) 19.786 ======================= Grid point 127 (61/136) ======================= q-point: ( 0.00 0.17 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.767 ( -10.558 7.875 15.971) 20.702 1.136 ( -4.309 10.734 17.966) 21.367 1.831 ( -6.287 -8.053 2.140) 10.438 1.990 ( -6.700 -0.144 10.362) 12.340 2.127 ( -5.059 5.072 15.316) 16.908 2.202 ( 9.426 1.082 -7.606) 12.160 2.526 ( -1.810 5.521 -4.498) 7.348 2.560 ( 2.561 -0.021 -8.401) 8.782 2.683 ( 0.931 1.646 -2.774) 3.357 2.755 ( -0.984 5.181 -3.357) 6.251 2.873 ( -0.196 1.022 -3.984) 4.118 3.044 ( 6.231 -7.004 -14.341) 17.133 3.068 ( -2.931 -1.478 2.188) 3.944 3.357 ( -2.296 9.786 1.548) 10.170 3.428 ( -3.023 2.811 3.271) 5.267 3.641 ( 0.286 1.634 6.348) 6.561 3.698 ( -2.946 9.090 3.516) 10.182 3.753 ( 2.512 3.522 -1.824) 4.695 3.979 ( 1.877 -3.148 6.128) 7.141 4.135 ( -1.757 -1.343 -1.988) 2.974 4.231 ( 1.139 -1.305 1.866) 2.546 4.499 ( 0.197 -0.182 1.399) 1.425 4.642 ( 2.188 -4.661 1.183) 5.283 4.825 ( 1.291 2.795 4.245) 5.244 4.872 ( 0.479 0.251 1.888) 1.964 5.093 ( -1.612 -8.921 2.349) 9.365 5.269 ( 4.904 -6.177 -0.308) 7.893 5.523 ( -3.750 -1.354 13.118) 13.711 5.640 ( -0.439 -6.688 -7.825) 10.303 5.923 ( -4.228 -9.480 -0.264) 10.384 6.024 ( 11.426 -0.057 -14.669) 18.594 6.537 ( 0.965 1.879 -1.335) 2.499 6.721 ( 2.158 -0.873 3.011) 3.806 7.047 ( 0.495 2.325 0.678) 2.472 7.108 ( 1.724 7.597 -1.122) 7.871 7.521 ( 1.053 -2.154 -8.831) 9.151 7.541 ( 0.473 -2.328 -5.579) 6.063 7.734 ( 1.485 4.470 -4.750) 6.689 7.848 ( 0.493 3.183 -4.802) 5.782 7.956 ( 0.482 -2.207 -5.360) 5.817 8.198 ( 3.086 -6.203 -8.474) 10.946 8.338 ( 3.276 -0.299 -6.864) 7.612 8.667 ( 2.590 4.232 -4.806) 6.907 8.871 ( 2.144 -4.478 -2.737) 5.669 9.406 ( -1.463 2.238 3.584) 4.471 9.559 ( -2.250 -1.589 3.500) 4.454 9.771 ( -5.100 1.963 4.030) 6.790 9.885 ( -4.626 8.124 7.605) 12.051 10.074 ( -3.833 9.670 9.920) 14.374 10.238 ( 0.229 5.208 3.867) 6.490 12.275 ( -1.192 -9.878 2.885) 10.360 13.079 ( 2.203 15.093 4.916) 16.026 13.928 ( -11.699 -15.249 2.640) 19.400 15.159 ( -9.321 25.965 -10.405) 29.484 16.656 ( 3.841 -28.212 -1.043) 28.491 17.328 ( 4.475 -6.752 12.136) 14.591 18.571 ( -5.125 3.497 -3.440) 7.094 18.739 ( -42.426 8.376 -9.384) 44.251 22.293 ( -0.145 3.095 -8.236) 8.799 22.486 ( 0.656 -0.336 1.462) 1.638 22.601 ( -0.661 2.802 0.635) 2.948 23.071 ( 17.553 -3.441 0.761) 17.903 23.233 ( 20.939 -4.212 6.005) 22.186 23.326 ( 0.623 -3.006 -2.513) 3.967 24.072 ( 3.216 1.556 1.782) 3.992 24.415 ( -2.454 -3.771 3.469) 5.681 ======================= Grid point 128 (62/136) ======================= q-point: ( 0.12 0.17 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.813 ( 4.816 2.587 11.550) 12.778 1.208 ( -2.050 4.876 15.344) 16.231 1.688 ( -8.257 -9.520 -0.007) 12.602 1.949 ( -4.190 0.771 8.378) 9.399 2.117 ( -7.620 5.474 22.935) 24.780 2.294 ( 6.129 1.269 -16.820) 17.947 2.436 ( -4.190 10.488 -1.606) 11.408 2.581 ( 2.700 2.915 -2.598) 4.747 2.670 ( 1.725 3.675 -2.671) 4.860 2.720 ( -0.070 3.330 -2.997) 4.480 2.926 ( 5.620 -4.587 -1.824) 7.480 3.006 ( -3.802 -2.705 1.613) 4.937 3.085 ( 6.755 -3.959 -11.072) 13.561 3.332 ( -1.889 6.040 3.475) 7.220 3.394 ( -4.147 4.695 7.064) 9.441 3.623 ( -4.227 8.970 0.415) 9.924 3.705 ( 2.879 -1.668 -2.326) 4.060 3.832 ( 4.396 4.591 5.381) 8.328 4.071 ( 3.576 -3.420 1.469) 5.162 4.105 ( -1.030 -2.768 0.942) 3.100 4.259 ( 0.826 -0.086 0.727) 1.104 4.512 ( 0.982 0.204 -1.469) 1.778 4.684 ( 1.190 -2.953 -0.272) 3.195 4.860 ( -2.020 -0.261 5.259) 5.640 4.899 ( 2.805 -0.572 -0.282) 2.877 5.090 ( -0.749 -10.460 2.445) 10.768 5.374 ( 5.073 -5.612 0.305) 7.571 5.541 ( -3.569 -3.524 11.232) 12.301 5.575 ( -0.484 -6.552 -5.031) 8.275 5.824 ( -4.631 -11.440 -0.992) 12.382 6.114 ( 8.781 4.504 -16.237) 19.001 6.514 ( -2.598 6.194 -1.695) 6.928 6.761 ( -0.241 -4.813 3.012) 5.683 7.037 ( -0.347 1.318 -1.257) 1.854 7.157 ( 2.444 5.861 0.905) 6.415 7.479 ( 1.654 -1.812 -8.603) 8.946 7.560 ( 4.864 -4.508 -4.642) 8.095 7.747 ( 3.301 2.848 -4.096) 5.982 7.806 ( -0.490 5.072 -7.437) 9.016 7.924 ( 0.056 -0.873 -3.787) 3.887 8.187 ( 2.197 -7.800 -7.982) 11.375 8.318 ( -0.441 3.134 -6.483) 7.215 8.679 ( 2.309 5.683 -5.531) 8.259 8.906 ( 2.999 -3.877 -1.573) 5.147 9.398 ( -1.877 2.084 3.135) 4.206 9.534 ( -2.818 -1.258 2.825) 4.184 9.732 ( -2.603 -0.167 6.665) 7.157 9.841 ( -5.702 8.891 8.363) 13.472 10.060 ( -4.911 9.283 9.410) 14.101 10.246 ( -2.472 5.362 3.933) 7.094 12.268 ( -2.344 -10.192 4.301) 11.308 13.143 ( -0.923 13.237 7.873) 15.429 13.536 ( -28.675 -3.390 0.582) 28.880 14.841 ( -16.077 28.711 4.267) 33.181 16.659 ( -2.482 -30.218 -3.016) 30.469 17.282 ( -21.357 -12.771 11.163) 27.274 18.091 ( -8.231 19.683 10.972) 23.991 18.416 ( -14.366 3.695 0.031) 14.833 22.210 ( -1.118 3.295 -7.554) 8.317 22.566 ( 4.114 0.428 2.019) 4.602 22.693 ( 10.531 3.230 -0.418) 11.024 23.182 ( 1.913 -2.362 -3.795) 4.863 23.330 ( 1.830 -3.155 -1.989) 4.154 23.387 ( -8.090 -4.146 -6.085) 10.939 24.173 ( 8.884 2.626 -0.210) 9.266 24.944 ( 42.536 -13.541 -4.216) 44.838 ======================= Grid point 129 (63/136) ======================= q-point: ( 0.25 0.17 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.054 ( 12.111 -3.593 2.463) 12.871 1.238 ( -3.469 -9.127 9.135) 13.371 1.596 ( -1.627 0.042 4.021) 4.338 1.962 ( -1.379 -0.003 9.546) 9.646 2.165 ( -3.186 10.164 16.060) 19.271 2.178 ( -3.502 0.907 -19.248) 19.585 2.370 ( -4.715 10.578 7.376) 13.731 2.586 ( -0.922 1.754 1.494) 2.482 2.713 ( 0.554 2.920 1.520) 3.338 2.738 ( 4.309 2.097 0.347) 4.805 2.968 ( -1.357 -2.978 2.365) 4.038 3.006 ( 3.242 -2.928 0.092) 4.369 3.123 ( 4.957 -4.040 -10.928) 12.661 3.340 ( -1.453 0.662 5.890) 6.103 3.377 ( -1.328 11.058 3.717) 11.741 3.550 ( -3.683 3.959 1.971) 5.755 3.747 ( 4.938 -1.543 -6.462) 8.278 3.967 ( 4.481 2.838 6.165) 8.132 4.079 ( -2.118 -1.007 2.246) 3.247 4.149 ( 3.630 -2.799 -0.679) 4.633 4.275 ( 0.436 0.750 -0.481) 0.992 4.511 ( 0.869 1.093 -3.730) 3.983 4.674 ( -1.827 0.961 -0.156) 2.070 4.842 ( -2.600 0.033 2.278) 3.457 4.954 ( 3.585 -7.055 -3.637) 8.709 5.090 ( -1.877 -11.797 4.199) 12.662 5.393 ( -1.008 -8.148 -3.361) 8.871 5.512 ( -8.385 -6.330 8.588) 13.569 5.619 ( 4.015 -1.667 4.569) 6.307 5.788 ( 4.568 -7.649 -4.029) 9.778 6.108 ( 3.243 6.630 -16.979) 18.513 6.421 ( -5.025 7.810 -1.695) 9.440 6.763 ( -0.494 -9.113 -0.417) 9.135 7.033 ( 1.043 2.081 -1.676) 2.868 7.189 ( 0.220 2.333 -0.326) 2.366 7.463 ( 3.361 -2.407 -8.789) 9.712 7.641 ( 5.518 -2.971 -2.091) 6.607 7.729 ( -1.204 6.546 -7.255) 9.845 7.802 ( 4.938 1.627 -4.030) 6.578 7.909 ( 0.939 0.399 -2.236) 2.458 8.172 ( 1.554 -8.222 -6.204) 10.416 8.240 ( -1.908 2.780 -6.588) 7.401 8.667 ( 1.324 6.659 -7.434) 10.068 8.956 ( 2.529 -3.076 -0.413) 4.003 9.377 ( -1.914 1.048 1.330) 2.555 9.516 ( -1.817 0.906 6.108) 6.437 9.740 ( -3.808 4.224 9.186) 10.804 9.817 ( -2.016 3.385 8.166) 9.067 10.028 ( -5.048 8.969 8.694) 13.473 10.198 ( -5.392 5.040 3.982) 8.386 12.244 ( -4.601 -9.458 7.701) 13.036 12.990 ( -27.530 -6.689 17.527) 33.314 13.175 ( 0.730 27.523 -5.473) 28.071 14.663 ( -9.010 21.155 10.410) 25.241 16.502 ( -9.860 -25.153 -4.119) 27.329 16.999 ( -10.978 -14.808 6.217) 19.454 18.057 ( -14.056 6.264 3.006) 15.679 18.188 ( -8.018 8.717 12.193) 16.998 22.131 ( -1.220 4.913 -7.694) 9.210 22.722 ( 8.638 0.949 6.678) 10.959 22.924 ( 10.820 -1.716 -2.357) 11.206 23.052 ( -6.047 -0.210 -5.699) 8.312 23.254 ( 1.420 -2.953 -6.305) 7.106 23.354 ( 1.613 -1.872 -1.601) 2.944 24.413 ( 13.944 5.446 -0.366) 14.974 25.582 ( 27.133 -13.995 -9.252) 31.901 ======================= Grid point 130 (64/136) ======================= q-point: ( 0.38 0.17 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( 2.716 -10.578 8.259) 13.692 1.309 ( 6.036 -7.527 -2.375) 9.936 1.629 ( -0.779 4.485 5.425) 7.082 1.887 ( -7.402 2.842 -20.580) 22.054 2.022 ( 0.183 -1.838 8.593) 8.790 2.252 ( 1.473 13.924 11.434) 18.077 2.378 ( -6.338 6.365 21.911) 23.680 2.584 ( -0.770 2.533 2.713) 3.790 2.732 ( 1.547 -3.134 -2.922) 4.556 2.836 ( 2.723 4.338 7.245) 8.873 2.970 ( 0.288 -4.033 -0.215) 4.049 3.062 ( 0.830 -1.431 3.872) 4.210 3.120 ( 3.226 -3.674 -10.678) 11.744 3.338 ( -2.982 7.263 6.809) 10.393 3.395 ( 2.678 4.562 -4.136) 6.715 3.528 ( -1.005 2.110 4.822) 5.358 3.787 ( 3.003 -3.153 -5.024) 6.648 4.050 ( -2.266 0.627 2.490) 3.424 4.085 ( 3.425 0.420 2.870) 4.488 4.212 ( 2.687 1.538 0.414) 3.124 4.268 ( -0.051 0.042 -0.676) 0.679 4.484 ( -0.884 1.850 -5.033) 5.434 4.624 ( -3.005 2.156 -0.044) 3.699 4.792 ( -2.247 -0.335 -2.130) 3.115 4.968 ( 1.885 -8.113 -7.069) 10.924 5.086 ( -2.379 -12.794 6.624) 14.602 5.352 ( -2.484 -8.157 0.181) 8.529 5.411 ( -4.602 -7.137 3.322) 9.119 5.654 ( -4.540 0.788 7.380) 8.700 5.934 ( 10.216 -4.296 -3.286) 11.559 6.004 ( 0.274 9.736 -18.754) 21.132 6.336 ( -1.362 5.013 -1.304) 5.356 6.730 ( -1.108 -10.882 -4.441) 11.805 7.050 ( 1.737 5.970 -1.857) 6.489 7.164 ( -1.331 -2.629 -2.065) 3.599 7.473 ( 4.064 -0.697 -8.978) 9.880 7.675 ( 1.073 5.587 -3.805) 6.845 7.736 ( 5.032 -1.124 -1.627) 5.407 7.836 ( -0.211 -0.017 -0.612) 0.648 7.954 ( 6.110 1.053 -4.264) 7.525 8.129 ( -1.180 -2.113 -6.112) 6.574 8.200 ( 2.623 -5.137 -5.568) 8.017 8.625 ( 0.480 6.998 -8.009) 10.646 8.986 ( 0.750 -2.753 -0.292) 2.868 9.352 ( -1.444 0.233 0.910) 1.722 9.553 ( -0.141 2.029 8.360) 8.604 9.729 ( -3.970 8.971 10.371) 14.275 9.865 ( 0.086 -1.335 7.529) 7.647 9.999 ( -3.928 8.681 7.666) 12.229 10.107 ( -6.773 5.019 4.539) 9.574 12.224 ( -4.066 -8.065 11.730) 14.804 12.738 ( -11.027 -1.777 15.269) 18.919 13.143 ( -0.985 23.851 -3.326) 24.102 14.607 ( -5.614 17.144 11.452) 21.367 16.314 ( -5.168 -20.669 -2.352) 21.435 16.894 ( -5.323 -20.878 3.501) 21.828 17.792 ( -11.312 6.048 -0.024) 12.828 18.023 ( -16.438 8.185 3.654) 18.723 22.062 ( 0.620 5.322 -8.663) 10.186 22.772 ( -5.550 -1.563 -0.184) 5.769 23.075 ( 10.527 0.416 4.365) 11.404 23.169 ( 9.934 -1.606 0.709) 10.088 23.298 ( 7.343 -1.862 -1.446) 7.712 23.364 ( 0.550 -1.014 -1.068) 1.572 24.642 ( 9.081 6.356 -0.540) 11.098 25.870 ( 10.981 -12.354 -11.200) 19.966 ======================= Grid point 131 (65/136) ======================= q-point: (-0.50 0.17 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.242 ( -6.130 1.531 -2.553) 6.815 1.374 ( 3.253 -3.964 0.772) 5.185 1.545 ( -5.632 8.545 -3.406) 10.786 1.807 ( 5.262 -9.060 1.562) 10.593 2.084 ( 0.570 -2.795 5.902) 6.556 2.367 ( -3.834 11.734 21.266) 24.589 2.428 ( -2.106 5.367 15.803) 16.822 2.589 ( -1.539 1.984 3.569) 4.363 2.724 ( 1.518 -5.938 -6.826) 9.174 2.935 ( 1.750 5.938 6.159) 8.733 2.978 ( 1.440 -5.962 -2.018) 6.456 3.079 ( -1.520 -0.393 3.039) 3.420 3.095 ( 1.625 -1.223 -8.189) 8.438 3.339 ( 0.990 4.860 -2.018) 5.355 3.423 ( 1.179 2.387 2.061) 3.366 3.566 ( 0.426 6.672 5.308) 8.537 3.785 ( -0.238 -4.495 -2.574) 5.185 4.014 ( -2.369 1.003 1.131) 2.810 4.126 ( -1.389 -0.624 -0.635) 1.649 4.228 ( 1.414 4.151 -2.688) 5.143 4.319 ( 2.873 0.619 4.912) 5.725 4.390 ( -3.947 2.820 -5.744) 7.519 4.579 ( -1.429 0.253 1.354) 1.985 4.734 ( -1.263 -1.523 -6.460) 6.756 4.937 ( 0.745 -6.481 -6.478) 9.193 5.097 ( -1.101 -11.700 5.048) 12.790 5.269 ( -8.287 -8.757 9.198) 15.164 5.428 ( 5.112 -6.923 -4.254) 9.600 5.583 ( -8.003 4.066 8.760) 12.542 5.870 ( 0.842 8.018 -17.724) 19.472 6.057 ( 4.498 1.161 -3.604) 5.880 6.371 ( 5.603 -0.430 -2.717) 6.241 6.665 ( -0.918 -9.500 -6.697) 11.660 7.049 ( -0.529 6.790 -2.769) 7.352 7.134 ( 0.184 -1.300 -1.981) 2.377 7.486 ( 4.526 0.305 -9.371) 10.411 7.714 ( 4.551 3.475 -2.140) 6.112 7.789 ( -1.174 0.643 1.145) 1.762 7.832 ( 2.811 -2.377 -1.745) 4.074 8.040 ( 5.142 1.172 -5.077) 7.321 8.075 ( 0.517 -1.770 -5.379) 5.686 8.224 ( 3.924 -6.487 -6.367) 9.900 8.581 ( 1.102 5.570 -6.941) 8.967 8.978 ( -0.976 -3.490 -1.246) 3.832 9.336 ( -1.270 0.971 2.033) 2.587 9.611 ( -0.991 2.036 8.680) 8.971 9.751 ( -1.578 10.114 10.227) 14.470 9.913 ( -0.817 -1.716 7.195) 7.442 9.992 ( -2.442 9.381 7.111) 12.022 10.029 ( -4.176 4.568 4.836) 7.855 12.262 ( -0.798 -8.773 8.983) 12.582 12.772 ( -1.782 -6.148 27.823) 28.549 13.104 ( 2.399 28.257 -8.301) 29.548 14.608 ( -3.140 17.060 12.111) 21.156 16.300 ( 4.436 -19.958 0.084) 20.445 16.810 ( -5.539 -21.748 2.048) 22.535 17.643 ( -7.174 8.320 -3.729) 11.601 17.713 ( -8.134 7.239 -1.275) 10.964 22.034 ( 3.166 4.907 -8.904) 10.648 22.687 ( -3.336 -0.928 0.811) 3.556 23.155 ( 2.616 -3.862 -5.672) 7.344 23.320 ( -0.632 -0.383 -1.802) 1.948 23.361 ( 2.572 1.776 0.141) 3.128 23.581 ( 11.814 -0.993 16.732) 20.506 24.738 ( 0.946 4.701 0.557) 4.828 25.854 ( -2.366 -12.463 -15.927) 20.361 ======================= Grid point 132 (66/136) ======================= q-point: (-0.38 0.17 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( 2.680 8.037 -4.571) 9.626 1.345 ( -7.242 1.794 2.440) 7.849 1.436 ( -3.507 9.287 -0.788) 9.959 1.968 ( 3.827 -12.971 10.115) 16.888 2.128 ( 0.625 -4.182 3.972) 5.802 2.370 ( -14.061 7.852 28.357) 32.611 2.530 ( 3.078 1.123 2.903) 4.377 2.566 ( -1.623 0.343 2.084) 2.664 2.704 ( 2.168 -1.018 -7.689) 8.053 2.954 ( -1.749 5.441 -0.802) 5.772 3.002 ( 1.831 -7.198 -1.299) 7.540 3.076 ( 1.674 2.241 -5.701) 6.350 3.079 ( 0.170 0.998 1.805) 2.070 3.335 ( 1.581 2.944 -5.087) 6.087 3.460 ( -0.621 0.475 4.871) 4.934 3.604 ( -0.656 8.206 5.258) 9.768 3.744 ( -2.811 -2.334 0.084) 3.655 3.982 ( -2.333 4.182 1.396) 4.988 4.042 ( -3.836 1.544 -4.625) 6.204 4.239 ( 1.157 0.847 -1.618) 2.162 4.283 ( -1.996 3.260 -4.836) 6.165 4.435 ( 3.041 -0.481 9.001) 9.513 4.570 ( -1.845 -2.186 -3.610) 4.606 4.653 ( 0.209 0.262 -3.657) 3.672 4.907 ( -0.813 -5.149 -3.839) 6.474 5.104 ( -0.448 -8.753 1.262) 8.855 5.200 ( -4.939 -8.276 7.976) 12.510 5.503 ( -2.489 3.532 6.207) 7.563 5.521 ( 1.411 -6.683 3.777) 7.805 5.794 ( 4.811 6.930 -17.264) 19.216 6.083 ( 1.590 -0.090 -4.203) 4.495 6.455 ( 4.593 -2.277 -2.844) 5.862 6.608 ( 0.507 -7.920 -7.753) 11.095 7.007 ( -1.456 4.121 -1.654) 4.673 7.131 ( 1.096 5.622 -3.036) 6.483 7.514 ( 5.265 -0.586 -9.479) 10.859 7.747 ( -0.903 2.052 -1.791) 2.870 7.791 ( 1.846 1.679 -1.048) 2.706 7.872 ( 2.474 -1.872 -1.708) 3.541 8.046 ( 1.051 -1.031 -5.022) 5.234 8.087 ( 2.727 0.068 -4.650) 5.392 8.252 ( 4.683 -6.514 -8.253) 11.509 8.578 ( 3.436 2.346 -6.040) 7.334 8.936 ( -1.723 -4.639 -2.395) 5.498 9.340 ( -0.183 2.135 3.357) 3.983 9.630 ( -3.289 2.436 8.059) 9.039 9.806 ( -0.807 10.371 9.794) 14.287 9.939 ( -2.010 -1.077 7.086) 7.444 10.003 ( -2.993 13.735 10.462) 17.523 10.032 ( 2.090 0.311 0.946) 2.315 12.292 ( -0.754 -9.152 3.075) 9.684 12.942 ( -4.621 -2.789 19.637) 20.365 13.274 ( 19.864 19.637 8.463) 29.185 14.682 ( 2.278 21.885 13.109) 25.612 16.421 ( 4.804 -27.004 -1.993) 27.500 16.783 ( 3.783 -11.287 7.374) 14.003 17.478 ( -0.512 14.538 -0.599) 14.559 17.796 ( 11.583 1.515 0.673) 11.701 22.053 ( 5.371 4.141 -8.621) 10.969 22.646 ( -2.155 -0.531 1.922) 2.936 23.142 ( 0.117 -4.216 -6.730) 7.943 23.210 ( -8.645 2.620 -0.591) 9.052 23.385 ( 0.356 1.356 -1.754) 2.246 23.841 ( 1.613 -2.795 12.735) 13.138 24.697 ( -6.650 1.672 3.416) 7.661 25.535 ( -16.184 -13.551 -22.388) 30.770 ======================= Grid point 133 (67/136) ======================= q-point: (-0.25 0.17 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.138 ( -10.552 4.730 5.926) 12.994 1.205 ( -9.358 9.355 11.107) 17.275 1.516 ( 17.137 8.532 -8.890) 21.107 2.020 ( -3.640 -6.240 5.806) 9.268 2.170 ( -0.621 -10.355 2.718) 10.724 2.256 ( -17.719 7.714 28.365) 34.322 2.542 ( 3.609 -6.820 -7.050) 10.451 2.612 ( 0.713 2.808 1.649) 3.334 2.693 ( 0.524 4.655 -2.784) 5.449 2.889 ( -3.884 5.690 -0.816) 6.938 3.008 ( 0.214 -4.613 -2.300) 5.159 3.062 ( 1.705 -1.273 -7.721) 8.009 3.101 ( 1.772 0.565 -2.837) 3.392 3.352 ( 4.003 8.065 -4.302) 9.979 3.456 ( -2.394 -2.261 3.374) 4.715 3.618 ( -1.995 5.550 6.248) 8.591 3.686 ( -4.627 1.668 3.968) 6.319 3.895 ( -5.198 8.474 -2.668) 10.294 3.977 ( -1.854 0.217 0.381) 1.905 4.226 ( -1.478 1.847 -0.401) 2.399 4.253 ( -0.534 -1.427 -1.294) 1.999 4.472 ( -0.138 1.445 -6.617) 6.775 4.551 ( 0.620 -1.786 9.411) 9.599 4.702 ( 3.266 0.538 1.296) 3.555 4.844 ( -2.297 -4.689 -1.734) 5.502 5.118 ( 1.306 -7.492 -0.084) 7.606 5.177 ( -2.268 -6.158 3.863) 7.615 5.488 ( -4.924 4.021 13.355) 14.791 5.615 ( 4.780 -9.098 -0.308) 10.281 5.805 ( 8.905 5.064 -16.076) 19.062 6.061 ( -0.343 -4.454 -5.022) 6.721 6.518 ( 2.841 -0.810 -0.056) 2.955 6.572 ( 2.135 -6.807 -7.034) 10.019 6.985 ( 0.011 4.002 0.250) 4.010 7.125 ( 0.926 8.315 -3.998) 9.272 7.541 ( 4.638 -1.386 -9.853) 10.977 7.711 ( -2.341 1.323 -0.786) 2.802 7.765 ( -0.490 3.654 -5.301) 6.456 7.916 ( 2.173 -1.924 -1.933) 3.487 7.996 ( -1.103 1.692 -6.021) 6.350 8.128 ( 4.519 -2.490 -4.029) 6.546 8.283 ( 4.950 -6.889 -9.223) 12.531 8.613 ( 4.486 0.670 -6.346) 7.800 8.889 ( -0.913 -5.067 -2.762) 5.843 9.372 ( 0.386 2.383 3.755) 4.464 9.611 ( -4.092 1.856 6.831) 8.176 9.849 ( -1.487 10.540 7.174) 12.836 9.933 ( -3.913 0.017 7.202) 8.197 10.031 ( -1.971 11.856 9.750) 15.476 10.104 ( 3.561 2.127 2.299) 4.743 12.287 ( -1.207 -9.036 1.634) 9.262 12.960 ( -0.832 9.910 4.995) 11.128 13.768 ( 15.796 -7.240 13.445) 21.970 14.928 ( 14.712 28.346 7.835) 32.884 16.446 ( 3.269 -25.397 -2.885) 25.769 17.013 ( 7.528 -10.053 6.418) 14.104 17.841 ( 35.013 15.822 24.876) 45.772 18.114 ( 19.196 1.541 1.046) 19.286 22.114 ( 7.145 4.001 -8.044) 11.479 22.630 ( -1.095 -0.435 2.467) 2.733 22.925 ( -15.982 3.015 -1.927) 16.378 23.118 ( -1.132 -3.270 -4.858) 5.965 23.367 ( -0.501 -0.327 -2.173) 2.254 23.745 ( -17.785 -7.032 -6.070) 20.065 24.480 ( -18.108 -0.100 -3.247) 18.397 24.987 ( -22.135 -9.085 -8.939) 25.542 ======================= Grid point 134 (68/136) ======================= q-point: (-0.12 0.17 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.933 ( -15.231 7.316 11.417) 20.393 1.133 ( -8.586 11.828 16.990) 22.412 1.822 ( 15.065 0.680 -6.971) 16.614 1.980 ( 0.528 -0.367 -0.960) 1.156 2.092 ( -10.593 0.599 14.011) 17.576 2.192 ( -7.352 -1.807 16.248) 17.925 2.562 ( 3.604 -7.383 -7.924) 11.415 2.594 ( -1.965 4.566 -2.233) 5.450 2.681 ( 0.547 4.420 -2.653) 5.184 2.811 ( -2.684 4.103 -2.426) 5.470 2.959 ( -3.635 3.561 -2.839) 5.827 3.041 ( 4.732 -5.933 -13.750) 15.705 3.096 ( -0.668 -2.792 -0.558) 2.924 3.383 ( 0.964 10.753 -3.419) 11.325 3.449 ( -0.411 3.717 0.825) 3.830 3.628 ( -4.146 1.300 7.699) 8.840 3.654 ( 0.131 3.217 8.015) 8.637 3.789 ( -3.740 6.968 -1.754) 8.100 3.949 ( -1.948 0.436 3.054) 3.648 4.198 ( -2.597 -1.117 -2.794) 3.975 4.207 ( -0.639 0.170 1.806) 1.924 4.479 ( 1.339 0.823 0.729) 1.733 4.600 ( -0.018 -3.218 4.487) 5.522 4.767 ( 2.175 1.785 2.241) 3.597 4.837 ( 1.352 -2.309 1.285) 2.968 5.118 ( -2.471 -8.061 2.725) 8.860 5.195 ( 3.023 -5.515 -0.597) 6.318 5.501 ( -3.736 1.353 12.475) 13.092 5.672 ( 1.778 -7.063 -3.005) 7.879 5.893 ( 11.622 5.523 -15.494) 20.140 6.006 ( -2.372 -12.447 -1.978) 12.825 6.527 ( 0.935 -1.568 -2.586) 3.166 6.636 ( 4.867 -1.201 0.645) 5.054 7.010 ( 1.568 3.943 1.512) 4.505 7.111 ( 0.541 7.982 -3.553) 8.754 7.544 ( 3.231 -2.343 -9.898) 10.673 7.623 ( -4.049 0.623 -3.709) 5.527 7.744 ( 1.302 4.528 -4.342) 6.407 7.884 ( -1.221 2.331 -4.458) 5.176 7.973 ( 1.708 -2.270 -4.893) 5.658 8.182 ( 4.325 -3.527 -5.985) 8.184 8.311 ( 4.877 -5.244 -8.627) 11.212 8.648 ( 3.622 1.918 -5.925) 7.205 8.865 ( 0.602 -4.860 -2.855) 5.668 9.399 ( -0.465 2.290 3.590) 4.284 9.581 ( -3.432 0.217 5.288) 6.308 9.838 ( -3.808 5.999 3.306) 7.837 9.909 ( -4.095 4.668 8.133) 10.232 10.062 ( -2.519 10.347 9.973) 14.590 10.185 ( 2.355 4.111 3.390) 5.826 12.278 ( -1.104 -9.316 2.076) 9.608 13.003 ( 2.060 13.614 3.460) 14.197 13.991 ( 0.950 -15.054 6.481) 16.417 15.216 ( 11.333 23.024 -9.337) 27.308 16.545 ( 7.193 -24.422 -0.599) 25.467 17.156 ( 5.390 -5.671 5.011) 9.291 18.458 ( 14.683 3.076 -1.224) 15.052 18.939 ( 39.520 -1.252 12.570) 41.490 22.208 ( 8.377 4.808 -5.795) 11.264 22.605 ( -9.030 -0.165 0.235) 9.034 22.676 ( 0.739 1.678 5.256) 5.566 22.913 ( -28.963 -4.619 -10.599) 31.185 23.157 ( -8.710 -0.442 -4.972) 10.039 23.343 ( -0.298 -1.798 -2.434) 3.041 24.141 ( -10.700 2.791 -0.197) 11.060 24.637 ( -17.360 -4.117 7.078) 19.194 ======================= Grid point 135 (69/136) ======================= q-point: ( 0.00 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.990 ( -11.097 12.227 10.674) 19.662 1.392 ( -6.677 8.339 7.271) 12.922 1.638 ( -5.888 -5.080 6.525) 10.151 1.983 ( -4.291 -1.989 7.745) 9.075 2.195 ( 2.563 0.826 -4.242) 5.025 2.260 ( 11.313 2.016 -10.017) 15.244 2.550 ( 5.889 -4.101 -8.503) 11.127 2.580 ( 2.168 -1.006 -3.905) 4.579 2.733 ( -2.334 6.571 -0.756) 7.014 2.791 ( -2.248 -1.880 0.962) 3.085 2.934 ( 0.107 0.391 -7.885) 7.896 2.990 ( -3.698 9.973 -0.170) 10.638 3.029 ( 0.437 -2.228 -0.686) 2.372 3.412 ( 0.621 2.600 0.564) 2.732 3.558 ( -1.581 -0.124 2.248) 2.751 3.604 ( -2.200 -5.170 2.423) 6.118 3.843 ( -3.550 5.376 1.149) 6.544 3.918 ( 1.930 2.862 9.558) 10.162 4.021 ( 0.391 8.434 -4.339) 9.493 4.143 ( -3.702 5.441 1.982) 6.873 4.211 ( 0.385 0.329 0.300) 0.589 4.479 ( -0.567 -1.864 2.764) 3.381 4.561 ( 2.262 -3.110 0.606) 3.893 4.797 ( 0.309 -15.564 -0.681) 15.582 4.906 ( 2.183 2.139 3.711) 4.807 4.915 ( -0.456 4.444 6.625) 7.990 5.118 ( 3.863 -5.496 1.416) 6.865 5.424 ( -0.316 -7.701 2.615) 8.139 5.540 ( -3.914 -2.801 -0.282) 4.821 5.656 ( -6.230 -9.564 -0.829) 11.444 6.124 ( 9.847 5.274 -13.671) 17.654 6.464 ( 3.492 -8.363 -1.775) 9.235 6.728 ( 3.566 3.740 -4.106) 6.600 6.993 ( 4.778 -6.782 -5.903) 10.182 7.286 ( -0.048 8.108 -4.123) 9.096 7.516 ( -2.552 -1.748 -4.416) 5.392 7.609 ( -1.237 9.195 -2.946) 9.735 7.769 ( 0.306 -1.257 -1.784) 2.203 7.870 ( 2.486 -1.540 -7.530) 8.077 7.946 ( 1.869 3.052 -9.611) 10.256 8.188 ( 3.415 2.619 -8.532) 9.556 8.316 ( 4.722 -1.879 -3.367) 6.096 8.689 ( 2.851 -1.042 -0.626) 3.099 8.752 ( 2.999 -5.716 -2.840) 7.052 9.463 ( -1.143 3.024 2.258) 3.943 9.546 ( -2.004 -0.283 1.627) 2.597 9.799 ( -5.274 1.651 3.272) 6.423 9.949 ( -1.654 -2.801 -0.220) 3.261 10.297 ( -5.445 12.759 14.354) 19.963 10.475 ( -4.176 10.410 13.249) 17.359 12.183 ( -4.952 2.650 12.053) 13.297 12.914 ( -9.383 -22.917 23.961) 34.458 14.170 ( 3.173 29.760 -13.856) 32.980 15.418 ( -0.914 -10.196 -1.855) 10.404 16.290 ( 1.705 2.645 -14.174) 14.519 17.045 ( -0.283 -17.809 4.984) 18.495 18.668 ( -4.012 5.052 -1.819) 6.702 18.828 ( -21.298 -0.067 -5.902) 22.101 22.361 ( -3.547 2.874 -7.136) 8.471 22.475 ( 0.458 -1.577 -1.447) 2.188 22.690 ( 6.146 6.507 1.863) 9.142 23.004 ( 19.659 -3.731 7.489) 21.366 23.156 ( 3.892 -2.010 0.941) 4.481 23.250 ( 0.561 -3.678 -1.559) 4.034 24.125 ( 0.363 3.377 2.121) 4.004 24.319 ( -4.592 -4.931 3.156) 7.440 ======================= Grid point 136 (70/136) ======================= q-point: ( 0.12 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.912 ( -3.349 6.486 8.393) 11.123 1.236 ( -11.996 -4.549 1.839) 12.961 1.641 ( -1.005 6.646 11.072) 12.952 1.968 ( -3.158 -0.427 7.862) 8.483 2.208 ( 0.930 2.855 1.417) 3.320 2.325 ( 3.143 -0.602 -12.057) 12.475 2.568 ( 2.730 4.925 -6.868) 8.882 2.624 ( 4.907 -4.424 -8.632) 10.870 2.674 ( -1.237 0.953 -0.869) 1.787 2.811 ( 3.078 -3.026 -0.028) 4.317 2.891 ( 0.054 -3.830 -6.828) 7.829 2.939 ( -1.361 11.837 2.047) 12.089 3.047 ( 0.951 1.012 1.351) 1.937 3.416 ( -1.213 5.491 3.028) 6.387 3.525 ( -2.222 -0.340 2.714) 3.524 3.627 ( 1.817 -3.313 0.637) 3.832 3.794 ( -3.849 3.344 3.318) 6.083 3.946 ( -1.293 -2.959 1.774) 3.684 4.060 ( 2.424 10.112 0.773) 10.427 4.108 ( 0.182 5.093 3.027) 5.928 4.246 ( 1.609 -0.940 1.026) 2.127 4.506 ( 1.614 -1.224 1.086) 2.298 4.608 ( 2.570 -3.259 -1.053) 4.282 4.779 ( -1.650 -16.381 0.790) 16.483 4.911 ( -2.137 5.370 2.707) 6.382 4.957 ( -1.741 5.315 5.964) 8.176 5.238 ( 4.777 -6.589 2.383) 8.481 5.428 ( 0.541 -5.705 -3.158) 6.543 5.484 ( -3.983 -3.758 7.563) 9.337 5.548 ( -0.967 -11.414 -3.865) 12.089 6.209 ( 8.464 3.946 -13.540) 16.448 6.511 ( 2.294 -8.436 -1.365) 8.848 6.703 ( -2.061 4.441 -5.926) 7.687 6.994 ( -0.029 -6.435 -6.123) 8.883 7.275 ( 1.463 5.972 -3.690) 7.171 7.488 ( 2.253 -2.940 -2.737) 4.605 7.576 ( -0.074 8.825 -1.391) 8.935 7.765 ( 0.813 -1.221 -1.476) 2.081 7.875 ( 3.860 -0.645 -7.831) 8.754 7.913 ( 2.132 2.378 -9.706) 10.218 8.176 ( 1.229 4.220 -7.413) 8.618 8.336 ( 0.028 -1.188 -4.750) 4.896 8.729 ( 2.062 -0.026 -1.838) 2.763 8.801 ( 4.124 -5.113 -2.694) 7.100 9.457 ( -1.144 3.293 1.898) 3.969 9.533 ( -0.809 0.389 2.023) 2.213 9.739 ( -3.618 1.267 5.510) 6.712 9.906 ( -2.859 -3.037 0.806) 4.248 10.277 ( -7.253 12.356 13.792) 19.887 10.465 ( -6.820 9.390 13.119) 17.515 12.170 ( -5.783 2.157 12.714) 14.133 12.844 ( -15.740 -22.770 23.136) 36.076 14.088 ( 0.071 36.263 -16.518) 39.848 15.312 ( -9.073 4.281 0.459) 10.043 16.136 ( -6.442 -8.971 -11.184) 15.718 16.903 ( -17.580 -21.325 4.944) 28.076 18.411 ( -13.082 9.589 6.503) 17.475 18.495 ( -14.100 2.989 2.290) 14.594 22.300 ( 1.644 4.933 -5.637) 7.669 22.536 ( 5.913 -3.905 -1.570) 7.258 22.807 ( 5.975 7.571 -1.710) 9.795 23.127 ( -2.589 -3.080 -4.760) 6.232 23.243 ( 4.427 -4.165 0.190) 6.081 23.293 ( -3.026 -3.881 -1.726) 5.215 24.260 ( 12.956 5.565 1.715) 14.204 24.646 ( 30.846 -12.821 3.110) 33.549 ======================= Grid point 137 (71/136) ======================= q-point: ( 0.25 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.985 ( 5.125 -2.484 2.982) 6.429 1.039 ( -6.733 -6.785 1.857) 9.737 1.718 ( 0.029 8.577 10.346) 13.439 1.976 ( -0.946 0.514 5.529) 5.633 2.215 ( -2.070 2.702 -13.182) 13.614 2.277 ( 0.805 -0.410 6.196) 6.262 2.552 ( 0.335 7.003 -5.786) 9.090 2.615 ( 0.685 -5.728 -7.176) 9.207 2.689 ( 2.403 2.359 -0.392) 3.390 2.827 ( 0.919 -4.191 -5.697) 7.132 2.911 ( 2.964 -2.939 4.839) 6.391 2.958 ( 0.301 8.289 4.660) 9.514 3.068 ( 0.602 1.951 -0.670) 2.149 3.424 ( -0.803 6.711 4.691) 8.228 3.522 ( -0.464 -1.353 3.683) 3.951 3.647 ( -0.496 1.128 -1.958) 2.314 3.733 ( -3.695 2.418 4.115) 6.036 3.958 ( 0.173 -7.715 2.095) 7.996 4.092 ( 2.432 8.290 0.016) 8.640 4.187 ( 3.467 4.754 3.653) 6.926 4.269 ( 0.244 -0.893 0.124) 0.934 4.543 ( 2.248 1.015 -2.070) 3.220 4.641 ( 2.226 -4.427 -2.822) 5.703 4.754 ( -2.766 -14.148 4.222) 15.021 4.888 ( -2.216 5.237 2.577) 6.243 4.931 ( -3.812 3.571 2.619) 5.843 5.251 ( -2.555 -6.540 -0.389) 7.032 5.350 ( -7.776 -8.947 3.495) 12.359 5.570 ( 6.872 -2.422 3.443) 8.059 5.612 ( 9.066 -6.546 -3.370) 11.679 6.236 ( 4.761 4.763 -14.193) 15.710 6.525 ( -0.211 -5.509 -0.995) 5.602 6.586 ( -4.292 2.110 -6.825) 8.334 6.936 ( 0.430 -9.887 -8.717) 13.188 7.265 ( 0.200 6.846 -3.666) 7.768 7.522 ( 1.913 -0.656 -0.612) 2.113 7.608 ( 3.913 4.036 -0.747) 5.671 7.773 ( 0.398 -1.478 -0.645) 1.661 7.890 ( 4.003 4.692 -10.026) 11.771 7.914 ( 4.835 -0.205 -6.623) 8.202 8.128 ( -1.133 3.198 -4.959) 6.008 8.254 ( -3.672 -1.223 -5.973) 7.117 8.741 ( 1.748 1.182 -4.993) 5.421 8.862 ( 3.921 -5.158 -3.154) 7.206 9.437 ( -1.729 4.585 0.472) 4.923 9.550 ( -0.017 1.421 5.036) 5.233 9.751 ( -0.632 -0.542 8.136) 8.178 9.856 ( -3.149 -2.795 2.054) 4.685 10.226 ( -7.867 11.588 12.928) 19.061 10.408 ( -8.824 8.834 13.405) 18.319 12.147 ( -6.427 1.284 13.641) 15.134 12.673 ( -17.048 -17.351 20.410) 31.753 13.958 ( -0.505 39.589 -15.408) 42.485 15.134 ( -10.067 14.258 5.428) 18.279 15.926 ( -6.925 -20.759 -9.124) 23.709 16.586 ( -16.096 -22.648 5.845) 28.393 18.206 ( -14.998 6.581 3.166) 16.681 18.319 ( -9.601 2.922 9.548) 13.852 22.278 ( 0.027 8.543 -6.377) 10.661 22.672 ( 6.286 -6.546 0.352) 9.082 22.925 ( 6.507 2.307 -2.530) 7.353 23.035 ( 2.826 -1.561 -4.293) 5.372 23.204 ( -1.374 -0.670 -3.500) 3.819 23.301 ( 1.700 -3.041 -0.302) 3.497 24.587 ( 16.795 10.715 0.883) 19.941 25.225 ( 24.932 -17.727 -2.064) 30.662 ======================= Grid point 138 (72/136) ======================= q-point: ( 0.38 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.029 ( 3.833 -4.933 7.943) 10.105 1.149 ( 8.382 -7.175 -0.815) 11.063 1.771 ( -1.854 7.701 8.195) 11.397 1.984 ( -2.302 3.854 -12.946) 13.702 2.036 ( -3.369 4.247 -0.500) 5.444 2.353 ( 0.462 -4.524 7.090) 8.423 2.534 ( 0.288 2.168 0.734) 2.307 2.550 ( -1.179 -4.874 -7.569) 9.079 2.747 ( 2.340 8.085 3.028) 8.945 2.819 ( 1.935 -5.014 -4.988) 7.333 2.979 ( 0.559 -2.440 3.614) 4.396 3.040 ( 2.110 8.386 10.580) 13.665 3.063 ( 0.502 0.117 -2.375) 2.430 3.454 ( 0.098 6.609 5.118) 8.360 3.546 ( -0.799 -0.093 -2.793) 2.907 3.590 ( -2.290 2.900 6.248) 7.259 3.732 ( -0.403 -0.245 2.731) 2.771 3.962 ( -1.325 -8.082 2.139) 8.465 4.144 ( 2.587 5.849 -1.621) 6.598 4.262 ( 0.292 0.088 0.877) 0.928 4.287 ( 3.388 3.237 2.785) 5.451 4.550 ( 0.408 4.133 -3.930) 5.718 4.656 ( 2.029 -4.074 -4.107) 6.130 4.726 ( -4.341 -10.769 5.791) 12.975 4.844 ( -3.815 3.322 0.364) 5.072 4.876 ( -2.086 0.999 0.870) 2.471 5.178 ( -7.379 -8.801 5.753) 12.845 5.259 ( -0.192 -7.614 -3.798) 8.511 5.669 ( 1.590 1.075 3.475) 3.970 5.816 ( 10.466 -5.082 -2.109) 11.824 6.203 ( 4.144 7.038 -15.523) 17.541 6.438 ( -4.285 5.908 -4.843) 8.759 6.515 ( -0.878 -9.038 -2.677) 9.467 6.892 ( 2.563 -14.362 -11.308) 18.458 7.247 ( 0.857 9.143 -2.633) 9.553 7.554 ( 1.695 0.742 -0.001) 1.850 7.682 ( 3.842 -0.071 -0.960) 3.961 7.777 ( 1.404 0.432 -1.648) 2.207 7.880 ( 0.543 5.867 -5.671) 8.178 7.983 ( 6.934 0.856 -6.751) 9.716 8.077 ( -0.686 -0.307 -3.859) 3.931 8.149 ( -1.590 -2.263 -5.868) 6.487 8.720 ( 0.724 2.651 -7.256) 7.759 8.893 ( 1.844 -5.495 -4.233) 7.178 9.411 ( -1.412 5.219 1.277) 5.555 9.597 ( 0.193 1.062 6.445) 6.535 9.813 ( 0.080 -2.348 7.855) 8.199 9.826 ( -1.432 -1.478 3.629) 4.172 10.173 ( -7.020 11.280 12.566) 18.287 10.338 ( -8.371 9.316 14.186) 18.924 12.133 ( -5.474 0.419 14.645) 15.640 12.538 ( -11.218 -13.000 19.458) 25.951 13.866 ( 2.131 38.975 -12.896) 41.108 15.027 ( -5.993 15.375 7.812) 18.258 15.769 ( -2.154 -23.670 -6.783) 24.717 16.396 ( -8.593 -24.699 6.110) 26.855 17.947 ( -12.302 7.395 0.390) 14.359 18.125 ( -14.822 1.087 2.111) 15.011 22.222 ( 0.243 9.247 -8.235) 12.385 22.662 ( -2.161 -8.574 -5.574) 10.452 23.121 ( 6.891 3.723 4.401) 8.984 23.161 ( 7.698 1.071 1.646) 7.944 23.243 ( 10.185 -2.903 1.273) 10.667 23.323 ( 1.157 -3.027 0.445) 3.271 24.843 ( 8.845 12.299 -1.234) 15.199 25.534 ( 10.104 -17.683 -6.455) 21.364 ======================= Grid point 139 (73/136) ======================= q-point: (-0.50 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.242 ( 7.679 -2.295 12.287) 14.669 1.273 ( 4.937 -3.968 -0.217) 6.337 1.752 ( -4.767 10.788 -7.017) 13.724 1.772 ( -2.573 5.550 -4.729) 7.732 2.060 ( 0.462 -0.629 2.924) 3.026 2.366 ( -1.650 -11.186 -2.430) 11.565 2.471 ( -0.809 -5.643 -2.798) 6.350 2.585 ( 0.338 0.743 7.307) 7.352 2.805 ( 1.183 7.007 -0.360) 7.115 2.830 ( 2.237 2.939 0.059) 3.694 3.007 ( -1.184 -2.055 5.450) 5.943 3.056 ( 1.078 1.617 -1.690) 2.575 3.167 ( 3.014 4.687 8.486) 10.152 3.446 ( -5.348 5.944 -2.619) 8.414 3.486 ( -0.739 3.125 3.240) 4.562 3.660 ( 2.664 -2.207 4.816) 5.930 3.741 ( -1.327 0.532 4.586) 4.804 3.956 ( -0.045 -5.592 1.419) 5.770 4.145 ( -0.374 3.684 -2.816) 4.653 4.292 ( 2.442 0.841 0.686) 2.672 4.379 ( 2.924 3.034 3.876) 5.726 4.487 ( -3.479 6.122 -4.497) 8.355 4.635 ( -4.530 4.688 2.643) 7.034 4.684 ( 0.889 -8.010 -6.027) 10.063 4.776 ( -3.432 -9.423 2.503) 10.336 4.867 ( -0.271 1.882 1.217) 2.257 5.075 ( -7.485 -9.438 7.753) 14.325 5.269 ( 3.626 -8.447 -4.658) 10.306 5.685 ( -2.153 5.663 2.890) 6.712 5.902 ( 0.526 -1.689 -3.312) 3.755 6.208 ( 7.936 7.103 -16.842) 19.927 6.363 ( 0.628 2.133 -4.095) 4.659 6.474 ( -1.138 -7.780 -2.634) 8.292 6.865 ( 3.261 -15.513 -11.510) 19.590 7.268 ( 3.196 10.396 -2.639) 11.191 7.589 ( 2.283 1.912 -0.912) 3.115 7.740 ( 3.118 -2.341 -1.936) 4.353 7.797 ( 0.555 -0.300 -0.404) 0.749 7.846 ( 0.969 7.818 -3.393) 8.577 8.039 ( 0.283 -0.876 -5.497) 5.573 8.065 ( 6.080 -0.005 -6.235) 8.709 8.124 ( 2.439 -3.491 -4.849) 6.454 8.665 ( -0.582 3.000 -7.527) 8.123 8.869 ( -0.692 -6.104 -4.891) 7.853 9.406 ( -0.494 5.384 2.367) 5.902 9.637 ( -0.940 -0.710 5.676) 5.797 9.836 ( 1.004 -1.879 2.835) 3.546 9.882 ( 0.031 -1.323 7.792) 7.903 10.149 ( -5.163 12.302 13.639) 19.079 10.306 ( -5.802 10.366 14.611) 18.830 12.152 ( -3.738 -0.625 13.998) 14.502 12.534 ( -5.384 -13.493 23.031) 27.230 13.862 ( 7.312 39.227 -12.515) 41.819 15.019 ( -0.853 14.680 8.854) 17.165 15.762 ( 5.476 -23.408 -5.405) 24.640 16.337 ( -1.628 -22.733 6.493) 23.699 17.774 ( -4.352 4.961 -1.563) 6.782 17.843 ( -11.290 3.266 -3.266) 12.198 22.181 ( 2.132 8.506 -8.830) 12.444 22.595 ( -0.497 -7.909 -5.108) 9.429 23.130 ( -0.141 1.997 -2.217) 2.987 23.286 ( 0.004 -2.790 -1.201) 3.037 23.411 ( 4.839 2.875 4.917) 7.474 23.543 ( 10.628 -2.489 14.374) 18.049 24.897 ( -1.796 10.175 -2.090) 10.541 25.523 ( -4.623 -17.043 -10.750) 20.673 ======================= Grid point 140 (74/136) ======================= q-point: (-0.38 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.316 ( -0.907 3.393 3.564) 5.004 1.433 ( 3.196 6.213 4.910) 8.540 1.652 ( 2.105 10.482 -8.777) 13.833 1.747 ( -0.383 -3.550 4.870) 6.039 2.070 ( -1.385 -3.225 1.788) 3.939 2.290 ( 0.690 -14.012 -11.485) 18.131 2.471 ( -1.273 -1.373 5.430) 5.744 2.634 ( -0.599 -1.675 6.492) 6.731 2.797 ( -0.112 2.654 -3.787) 4.625 2.880 ( 1.830 7.555 1.081) 7.849 3.006 ( -4.054 -0.539 8.015) 8.998 3.090 ( 3.124 1.464 -1.820) 3.901 3.264 ( -0.572 9.351 5.636) 10.934 3.325 ( -2.220 0.189 -3.388) 4.055 3.458 ( -3.322 -1.246 0.895) 3.659 3.726 ( -0.367 -0.201 4.602) 4.621 3.756 ( -0.522 1.679 5.444) 5.721 3.984 ( 1.976 -2.446 -0.438) 3.175 4.116 ( -0.708 4.945 -1.221) 5.142 4.307 ( -1.675 3.948 -4.593) 6.284 4.410 ( -0.426 6.179 -3.795) 7.265 4.442 ( -0.172 1.431 7.876) 8.007 4.572 ( -3.197 3.032 2.279) 4.960 4.635 ( -0.592 -2.656 -3.157) 4.168 4.784 ( 1.498 -15.369 2.057) 15.578 4.833 ( -4.584 -2.309 1.415) 5.324 5.040 ( -1.444 -5.580 6.322) 8.555 5.316 ( 3.752 -9.462 -2.493) 10.480 5.647 ( -4.074 7.364 4.765) 9.671 5.855 ( -0.901 0.314 -5.253) 5.339 6.205 ( 4.003 6.726 -16.242) 18.030 6.390 ( 4.651 -3.394 -5.988) 8.307 6.445 ( 0.584 -4.581 -2.151) 5.094 6.852 ( 3.693 -13.963 -10.037) 17.588 7.319 ( 4.110 11.114 -4.072) 12.529 7.625 ( 2.620 4.816 -2.662) 6.094 7.746 ( 0.172 -1.566 -2.904) 3.303 7.802 ( 0.189 -2.163 -0.588) 2.249 7.883 ( 3.449 5.359 -2.923) 7.011 8.010 ( 1.396 -0.783 -5.277) 5.515 8.118 ( 3.742 0.077 -5.660) 6.786 8.145 ( 3.804 -3.040 -6.848) 8.403 8.605 ( 0.083 1.177 -6.108) 6.221 8.806 ( -1.739 -6.889 -4.800) 8.574 9.423 ( 0.241 5.394 2.850) 6.105 9.644 ( -2.123 -1.463 4.572) 5.249 9.889 ( 1.539 -1.430 3.091) 3.738 9.928 ( -0.009 -1.383 5.043) 5.229 10.173 ( -3.379 13.373 14.843) 20.263 10.324 ( -3.421 11.347 14.315) 18.585 12.178 ( -3.646 -0.488 11.965) 12.518 12.645 ( -2.911 -17.294 26.504) 31.781 13.963 ( 12.065 36.913 -12.819) 40.895 15.131 ( 5.835 10.418 7.505) 14.103 15.861 ( 8.866 -17.030 -5.959) 20.103 16.468 ( 9.747 -18.089 7.469) 21.863 17.713 ( 3.254 7.488 0.614) 8.187 17.824 ( 9.040 0.776 1.123) 9.142 22.178 ( 4.155 7.415 -8.200) 11.811 22.564 ( 0.581 -7.549 -4.085) 8.603 23.103 ( -1.010 1.519 -2.594) 3.172 23.240 ( -4.284 -1.081 -0.694) 4.473 23.452 ( -3.620 5.621 2.075) 7.000 23.749 ( -1.105 -5.715 10.597) 12.090 24.768 ( -9.966 5.379 0.052) 11.325 25.212 ( -17.563 -14.865 -12.299) 26.090 ======================= Grid point 141 (75/136) ======================= q-point: (-0.25 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.271 ( -7.444 7.749 6.593) 12.607 1.466 ( -3.267 12.883 5.748) 14.480 1.700 ( 6.636 5.556 -2.982) 9.154 1.815 ( 6.247 -6.585 -2.824) 9.506 2.043 ( -2.262 -4.733 1.580) 5.479 2.241 ( 2.186 -10.527 -10.316) 14.900 2.482 ( -2.511 0.702 7.216) 7.672 2.663 ( 0.520 -3.821 0.665) 3.913 2.743 ( -2.083 4.619 -2.808) 5.793 2.927 ( 2.538 3.058 -0.438) 3.998 2.963 ( -6.485 1.541 8.766) 11.013 3.108 ( 0.330 2.644 -4.928) 5.602 3.177 ( -3.829 6.950 -3.257) 8.577 3.388 ( 1.189 0.918 2.069) 2.557 3.413 ( 1.084 -3.565 3.612) 5.189 3.724 ( -2.393 -2.299 2.910) 4.414 3.774 ( -1.787 5.775 5.188) 7.966 4.007 ( 0.754 -0.795 -0.847) 1.385 4.073 ( -3.020 10.581 -3.000) 11.406 4.241 ( -1.526 1.691 -1.162) 2.557 4.334 ( -4.710 6.717 -1.152) 8.284 4.503 ( 1.674 -1.643 -0.791) 2.475 4.527 ( -2.715 1.743 4.401) 5.457 4.677 ( 1.909 -3.565 6.357) 7.534 4.750 ( -0.989 -2.956 -1.609) 3.508 4.837 ( 1.341 -15.399 2.332) 15.633 5.071 ( -0.224 -2.148 4.188) 4.712 5.372 ( 2.655 -9.976 0.051) 10.324 5.615 ( -3.482 5.694 6.701) 9.458 5.811 ( 0.006 -1.889 -4.420) 4.806 6.133 ( 1.849 5.733 -17.263) 18.284 6.403 ( 2.147 -7.932 -6.029) 10.192 6.510 ( 6.622 1.547 -1.582) 6.982 6.868 ( 5.185 -11.653 -8.616) 15.392 7.349 ( 2.222 11.755 -5.127) 13.015 7.639 ( 1.520 6.874 -4.879) 8.566 7.744 ( 1.053 -1.407 -0.696) 1.890 7.767 ( -2.681 -1.328 -3.093) 4.303 7.892 ( 1.404 0.626 -5.354) 5.570 8.023 ( 2.789 1.033 -6.915) 7.527 8.137 ( 2.888 2.118 -3.593) 5.073 8.171 ( 4.784 -3.209 -8.284) 10.090 8.593 ( 2.570 -1.408 -4.106) 5.044 8.748 ( -0.586 -7.372 -3.946) 8.382 9.450 ( 0.163 4.756 2.713) 5.478 9.623 ( -3.020 -0.948 3.551) 4.757 9.912 ( -2.269 -0.482 4.417) 4.989 9.961 ( 1.067 -1.866 0.691) 2.258 10.226 ( -2.668 13.347 14.862) 20.153 10.377 ( -2.105 11.752 13.957) 18.367 12.187 ( -4.085 0.887 11.173) 11.929 12.777 ( -3.499 -19.637 25.142) 32.093 14.097 ( 10.324 29.892 -12.183) 33.890 15.298 ( 6.773 -4.453 0.779) 8.143 16.044 ( 14.859 -1.207 -7.549) 16.710 16.735 ( 11.152 -15.938 3.208) 19.715 18.079 ( 29.699 6.569 13.276) 33.188 18.149 ( 21.199 1.368 4.878) 21.796 22.228 ( 6.809 6.474 -6.413) 11.376 22.557 ( 1.570 -6.625 -2.907) 7.403 23.006 ( -11.628 4.323 -2.963) 12.754 23.095 ( -7.121 1.070 -0.570) 7.223 23.356 ( -4.133 -0.061 -1.797) 4.507 23.569 ( -20.992 -8.502 -4.690) 23.129 24.513 ( -16.340 3.389 -0.416) 16.693 24.790 ( -17.682 -8.693 0.925) 19.725 ======================= Grid point 142 (76/136) ======================= q-point: (-0.12 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.143 ( -11.379 11.734 9.291) 18.802 1.433 ( -5.111 14.403 9.081) 17.777 1.718 ( -4.608 -9.403 3.918) 11.181 2.007 ( 5.286 -1.319 -3.727) 6.601 2.023 ( 10.618 1.422 -6.572) 12.568 2.216 ( 0.592 -4.118 -3.560) 5.476 2.495 ( 1.546 -1.444 0.536) 2.182 2.618 ( -1.434 -4.651 -6.134) 7.830 2.737 ( 0.392 5.392 2.071) 5.789 2.869 ( -6.326 4.481 3.930) 8.691 2.989 ( 1.743 0.429 1.773) 2.523 3.027 ( -2.522 1.512 -8.615) 9.103 3.090 ( -2.997 4.950 -3.801) 6.924 3.391 ( 0.327 0.121 1.386) 1.429 3.520 ( 3.167 -3.169 3.542) 5.711 3.671 ( -4.113 -3.503 0.411) 5.418 3.799 ( 0.637 7.782 7.787) 11.027 3.944 ( -6.202 7.458 1.232) 9.778 4.038 ( 1.734 5.791 -4.437) 7.498 4.193 ( -3.641 1.028 1.706) 4.150 4.252 ( -2.937 5.995 -1.328) 6.807 4.493 ( -2.762 -0.444 2.799) 3.957 4.523 ( 0.719 -3.606 1.095) 3.837 4.754 ( 2.252 -6.379 4.430) 8.086 4.813 ( 5.532 -0.509 0.300) 5.563 4.871 ( -0.021 -9.933 4.373) 10.853 5.083 ( -0.599 -2.020 2.388) 3.185 5.409 ( 0.589 -9.131 1.533) 9.278 5.597 ( -3.429 0.935 4.857) 6.018 5.766 ( -2.998 -6.490 -2.542) 7.587 6.070 ( 5.936 6.666 -16.385) 18.658 6.416 ( 3.021 -7.883 -3.450) 9.120 6.638 ( 7.400 2.598 -2.430) 8.211 6.925 ( 6.531 -9.042 -7.437) 13.406 7.328 ( -0.276 10.787 -4.980) 11.884 7.608 ( -1.556 2.204 -5.069) 5.742 7.670 ( -3.320 5.770 -3.645) 7.590 7.765 ( 1.321 -1.799 -1.164) 2.518 7.882 ( 1.888 -1.862 -6.405) 6.932 7.988 ( 0.976 3.601 -9.558) 10.261 8.174 ( 3.949 1.325 -7.097) 8.229 8.230 ( 6.147 -2.428 -3.986) 7.718 8.634 ( 3.679 -2.020 -2.192) 4.735 8.730 ( 1.336 -6.841 -2.992) 7.585 9.464 ( -0.609 3.731 2.326) 4.439 9.584 ( -3.166 -0.437 2.419) 4.008 9.873 ( -4.533 0.703 3.437) 5.732 9.970 ( -0.247 -2.275 -0.448) 2.332 10.277 ( -3.510 12.960 14.588) 19.826 10.437 ( -2.349 11.315 13.578) 17.830 12.187 ( -4.434 2.199 11.450) 12.474 12.874 ( -5.133 -20.890 23.803) 32.083 14.170 ( 6.433 26.805 -11.941) 30.041 15.395 ( 4.016 -13.426 -1.935) 14.147 16.250 ( 12.293 4.765 -12.810) 18.382 16.929 ( 7.619 -14.607 2.122) 16.611 18.551 ( 16.103 5.471 0.531) 17.015 18.844 ( 26.227 -6.813 6.542) 27.876 22.346 ( 8.465 7.394 -4.708) 12.186 22.585 ( -0.306 -2.271 -0.329) 2.315 22.713 ( -6.297 1.743 1.948) 6.818 22.826 ( -22.795 -3.326 -4.836) 23.538 23.160 ( -5.728 1.150 -3.137) 6.632 23.287 ( -1.843 -3.246 -2.193) 4.329 24.231 ( -11.664 5.555 1.920) 13.061 24.520 ( -15.210 -6.559 6.362) 17.744 ======================= Grid point 143 (77/136) ======================= q-point: ( 0.00 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.264 ( -11.259 -12.550 5.074) 17.607 1.264 ( -11.259 12.550 5.074) 17.607 1.813 ( -2.274 -12.651 9.328) 15.881 1.813 ( -2.274 12.651 9.328) 15.881 2.247 ( 7.683 -3.273 -10.621) 13.511 2.247 ( 7.683 3.273 -10.621) 13.511 2.506 ( 6.373 -1.541 -8.214) 10.510 2.506 ( 6.373 1.541 -8.214) 10.510 2.814 ( -4.141 -1.342 -1.961) 4.774 2.814 ( -4.141 1.342 -1.961) 4.774 2.957 ( -0.244 -3.884 -3.868) 5.487 2.957 ( -0.244 3.884 -3.868) 5.487 3.317 ( -2.595 -16.040 4.836) 16.953 3.317 ( -2.595 16.040 4.836) 16.953 3.508 ( 0.019 -3.700 3.427) 5.044 3.508 ( 0.019 3.700 3.427) 5.044 3.930 ( -4.333 -1.911 3.688) 6.003 3.930 ( -4.333 1.911 3.688) 6.003 4.157 ( 1.497 -4.376 0.154) 4.628 4.157 ( 1.497 4.376 0.154) 4.628 4.396 ( -2.986 -11.023 0.125) 11.421 4.396 ( -2.986 11.023 0.125) 11.421 4.517 ( 2.260 -2.091 0.475) 3.115 4.517 ( 2.260 2.091 0.475) 3.115 4.947 ( 4.525 -1.840 5.929) 7.682 4.947 ( 4.525 1.840 5.929) 7.682 5.205 ( -0.103 -11.437 2.117) 11.632 5.205 ( -0.103 11.437 2.117) 11.632 5.531 ( -6.039 -2.464 -1.945) 6.806 5.531 ( -6.039 2.464 -1.945) 6.806 6.270 ( 5.673 -8.445 -7.407) 12.584 6.270 ( 5.673 8.445 -7.407) 12.584 6.844 ( 5.897 -6.488 -7.142) 11.309 6.844 ( 5.897 6.488 -7.142) 11.309 7.438 ( -2.193 -5.637 -5.046) 7.877 7.438 ( -2.193 5.637 -5.046) 7.877 7.734 ( -0.874 -2.084 -0.015) 2.260 7.734 ( -0.874 2.084 -0.015) 2.260 7.926 ( 1.851 -5.241 -8.941) 10.528 7.926 ( 1.851 5.241 -8.941) 10.528 8.258 ( 5.143 -3.769 -7.072) 9.522 8.258 ( 5.143 3.769 -7.072) 9.522 8.675 ( 2.983 -0.909 0.024) 3.119 8.675 ( 2.983 0.909 0.024) 3.119 9.523 ( -1.343 -2.137 1.258) 2.820 9.523 ( -1.343 2.137 1.258) 2.820 9.860 ( -3.121 -4.095 0.713) 5.198 9.860 ( -3.121 4.095 0.713) 5.198 10.525 ( -6.008 -5.899 15.927) 18.016 10.525 ( -6.008 5.899 15.927) 18.016 12.426 ( -7.487 -19.267 18.302) 27.609 12.426 ( -7.487 19.267 18.302) 27.609 14.873 ( 3.958 -32.820 -7.407) 33.877 14.873 ( 3.958 32.820 -7.407) 33.877 16.620 ( -1.035 -20.581 -6.045) 21.476 16.620 ( -1.035 20.581 -6.045) 21.476 18.772 ( -8.903 -4.286 -2.446) 10.179 18.772 ( -8.903 4.286 -2.446) 10.179 22.421 ( -3.362 -2.891 -4.814) 6.545 22.421 ( -3.362 2.891 -4.814) 6.545 22.864 ( 14.063 -8.524 4.926) 17.167 22.864 ( 14.063 8.524 4.926) 17.167 23.176 ( 0.505 -2.962 -0.247) 3.015 23.176 ( 0.505 2.962 -0.247) 3.015 24.213 ( -2.819 -4.724 2.581) 6.076 24.213 ( -2.819 4.724 2.581) 6.076 ======================= Grid point 145 (78/136) ======================= q-point: ( 0.12 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.077 ( -10.256 -8.434 3.360) 13.697 1.077 ( -10.256 8.434 3.360) 13.697 1.854 ( -0.965 -9.971 9.727) 13.963 1.854 ( -0.965 9.971 9.727) 13.963 2.277 ( 2.599 -3.413 -6.760) 8.006 2.277 ( 2.599 3.413 -6.760) 8.006 2.556 ( 4.699 -0.849 -11.183) 12.160 2.556 ( 4.699 0.849 -11.183) 12.160 2.759 ( 0.841 -5.116 -1.966) 5.545 2.759 ( 0.841 5.116 -1.966) 5.545 2.931 ( 0.291 -5.525 -3.135) 6.359 2.931 ( 0.291 5.525 -3.135) 6.359 3.307 ( -2.300 -15.074 5.587) 16.240 3.307 ( -2.300 15.074 5.587) 16.240 3.551 ( 1.704 -5.940 3.140) 6.932 3.551 ( 1.704 5.940 3.140) 6.932 3.861 ( -4.852 -3.731 3.184) 6.899 3.861 ( -4.852 3.731 3.184) 6.899 4.206 ( 1.974 -3.439 1.473) 4.230 4.206 ( 1.974 3.439 1.473) 4.230 4.358 ( -1.379 -14.094 1.631) 14.255 4.358 ( -1.379 14.094 1.631) 14.255 4.564 ( 2.827 -1.064 -1.068) 3.204 4.564 ( 2.827 1.064 -1.068) 3.204 5.038 ( 0.350 -3.695 4.516) 5.846 5.038 ( 0.350 3.695 4.516) 5.846 5.219 ( -1.902 -9.974 3.450) 10.724 5.219 ( -1.902 9.974 3.450) 10.724 5.439 ( 0.538 -0.511 -2.645) 2.747 5.439 ( 0.538 0.511 -2.645) 2.747 6.324 ( 5.258 -7.348 -7.534) 11.764 6.324 ( 5.258 7.348 -7.534) 11.764 6.839 ( -0.610 -7.203 -7.916) 10.720 6.839 ( -0.610 7.203 -7.916) 10.720 7.400 ( 1.437 -5.184 -3.447) 6.389 7.400 ( 1.437 5.184 -3.447) 6.389 7.718 ( -0.757 -3.469 0.659) 3.612 7.718 ( -0.757 3.469 0.659) 3.612 7.906 ( 3.434 -3.085 -9.347) 10.425 7.906 ( 3.434 3.085 -9.347) 10.425 8.276 ( 1.368 -4.334 -6.687) 8.085 8.276 ( 1.368 4.334 -6.687) 8.085 8.728 ( 2.986 -1.177 -1.261) 3.449 8.728 ( 2.986 1.177 -1.261) 3.449 9.520 ( -0.098 -1.970 1.686) 2.594 9.520 ( -0.098 1.970 1.686) 2.594 9.805 ( -3.316 -4.802 1.880) 6.131 9.805 ( -3.316 4.802 1.880) 6.131 10.502 ( -8.386 -6.114 15.836) 18.933 10.502 ( -8.386 6.114 15.836) 18.933 12.390 ( -9.715 -17.560 17.496) 26.624 12.390 ( -9.715 17.560 17.496) 26.624 14.866 ( 1.263 -34.250 -9.046) 35.447 14.866 ( 1.263 34.250 -9.046) 35.447 16.411 ( -15.574 -23.136 -3.974) 28.171 16.411 ( -15.574 23.136 -3.974) 28.171 18.520 ( -13.788 -1.256 4.195) 14.467 18.520 ( -13.788 1.256 4.195) 14.467 22.420 ( 4.928 -6.061 -3.764) 8.671 22.420 ( 4.928 6.061 -3.764) 8.671 22.992 ( 0.157 -8.724 -3.959) 9.581 22.992 ( 0.157 8.724 -3.959) 9.581 23.227 ( 1.647 -2.084 0.729) 2.754 23.227 ( 1.647 2.084 0.729) 2.754 24.414 ( 20.217 -8.881 3.587) 22.371 24.414 ( 20.217 8.881 3.587) 22.371 ======================= Grid point 147 (79/136) ======================= q-point: ( 0.25 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.962 ( -2.521 -0.808 1.868) 3.240 0.962 ( -2.521 0.808 1.868) 3.240 1.907 ( -0.341 -7.498 7.333) 10.493 1.907 ( -0.341 7.498 7.333) 10.493 2.263 ( 0.349 -1.532 -4.378) 4.652 2.263 ( 0.349 1.532 -4.378) 4.652 2.532 ( 1.840 -3.257 -12.085) 12.650 2.532 ( 1.840 3.257 -12.085) 12.650 2.783 ( 1.353 -5.307 1.490) 5.676 2.783 ( 1.353 5.307 1.490) 5.676 2.943 ( 2.650 -5.781 -1.413) 6.515 2.943 ( 2.650 5.781 -1.413) 6.515 3.310 ( -1.689 -13.961 5.605) 15.138 3.310 ( -1.689 13.961 5.605) 15.138 3.605 ( 1.241 -7.634 3.035) 8.308 3.605 ( 1.241 7.634 3.035) 8.308 3.798 ( -4.423 -5.614 4.165) 8.272 3.798 ( -4.424 5.614 4.165) 8.272 4.240 ( 0.945 -2.394 0.539) 2.629 4.240 ( 0.945 2.394 0.539) 2.629 4.368 ( 0.623 -13.412 2.305) 13.622 4.368 ( 0.623 13.412 2.305) 13.622 4.608 ( 3.005 -2.236 -2.358) 4.426 4.608 ( 3.004 2.236 -2.358) 4.426 5.036 ( -3.442 -1.229 4.199) 5.567 5.036 ( -3.442 1.229 4.199) 5.567 5.149 ( -5.544 -4.460 0.855) 7.167 5.149 ( -5.544 4.460 0.855) 7.167 5.541 ( 9.225 -0.375 -0.637) 9.255 5.541 ( 9.225 0.375 -0.637) 9.255 6.353 ( 3.253 -6.891 -7.422) 10.637 6.353 ( 3.253 6.891 -7.422) 10.637 6.733 ( -2.825 -8.452 -9.604) 13.102 6.733 ( -2.825 8.452 -9.604) 13.102 7.417 ( 1.895 -6.622 -2.169) 7.222 7.417 ( 1.895 6.622 -2.169) 7.222 7.721 ( 0.438 -3.688 1.012) 3.849 7.721 ( 0.438 3.688 1.012) 3.849 7.928 ( 5.546 -0.800 -8.720) 10.365 7.928 ( 5.546 0.800 -8.720) 10.365 8.208 ( -3.299 -3.095 -5.766) 7.329 8.208 ( -3.299 3.095 -5.766) 7.329 8.770 ( 3.171 -2.647 -3.924) 5.698 8.770 ( 3.171 2.647 -3.924) 5.698 9.537 ( 0.273 -3.275 1.616) 3.662 9.537 ( 0.273 3.275 1.616) 3.662 9.771 ( -2.336 -3.173 4.724) 6.151 9.771 ( -2.336 3.173 4.724) 6.151 10.441 ( -9.536 -5.889 15.750) 19.331 10.441 ( -9.536 5.889 15.750) 19.331 12.319 ( -10.115 -13.927 16.628) 23.932 12.319 ( -10.115 13.927 16.628) 23.932 14.791 ( -1.071 -35.827 -10.515) 37.353 14.791 ( -1.071 35.827 -10.515) 37.353 16.070 ( -16.074 -23.623 1.594) 28.618 16.070 ( -16.074 23.623 1.594) 28.618 18.314 ( -12.789 -3.047 5.932) 14.423 18.314 ( -12.789 3.047 5.932) 14.423 22.482 ( 2.406 -9.972 -4.138) 11.062 22.482 ( 2.406 9.972 -4.138) 11.062 22.987 ( 5.850 -2.810 -3.680) 7.461 22.987 ( 5.850 2.810 -3.680) 7.461 23.233 ( -0.104 -2.859 -0.379) 2.886 23.233 ( -0.104 2.859 -0.379) 2.886 24.866 ( 20.880 -15.189 1.023) 25.840 24.866 ( 20.880 15.189 1.023) 25.840 ======================= Grid point 149 (80/136) ======================= q-point: ( 0.38 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.024 ( 6.398 -3.713 3.411) 8.146 1.024 ( 6.398 3.713 3.411) 8.146 1.940 ( -0.561 -6.925 3.607) 7.828 1.940 ( -0.561 6.925 3.607) 7.828 2.206 ( -2.788 -9.401 -6.787) 11.926 2.206 ( -2.788 9.401 -6.787) 11.926 2.474 ( 1.158 -5.170 -8.288) 9.836 2.474 ( 1.158 5.170 -8.288) 9.837 2.840 ( 2.012 -3.671 4.921) 6.460 2.840 ( 2.012 3.671 4.921) 6.460 2.989 ( 2.211 -4.781 -0.368) 5.280 2.989 ( 2.211 4.781 -0.368) 5.280 3.328 ( -0.681 -13.971 5.479) 15.023 3.328 ( -0.681 13.971 5.479) 15.023 3.643 ( 0.151 -8.252 3.591) 9.001 3.643 ( 0.151 8.252 3.591) 9.001 3.752 ( -3.665 -9.159 5.330) 11.213 3.752 ( -3.665 9.159 5.330) 11.213 4.257 ( 0.718 -1.536 -0.448) 1.754 4.257 ( 0.718 1.536 -0.448) 1.754 4.403 ( 1.467 -10.221 1.305) 10.408 4.403 ( 1.467 10.221 1.305) 10.408 4.638 ( 1.493 -3.275 -2.409) 4.331 4.638 ( 1.493 3.275 -2.409) 4.331 4.970 ( -6.737 -6.957 4.977) 10.889 4.970 ( -6.737 6.957 4.977) 10.889 5.065 ( -2.047 -9.011 -1.949) 9.443 5.065 ( -2.047 9.011 -1.949) 9.443 5.719 ( 8.296 -3.688 -0.507) 9.093 5.719 ( 8.296 3.688 -0.507) 9.093 6.343 ( 1.111 -6.946 -6.277) 9.428 6.343 ( 1.111 6.946 -6.277) 9.428 6.617 ( -0.470 -10.740 -11.771) 15.942 6.617 ( -0.470 10.740 -11.771) 15.942 7.439 ( 1.910 -8.248 -1.204) 8.552 7.439 ( 1.910 8.248 -1.204) 8.552 7.746 ( 1.301 -2.926 0.439) 3.232 7.746 ( 1.301 2.926 0.439) 3.232 7.979 ( 5.522 -2.005 -7.687) 9.674 7.979 ( 5.522 2.005 -7.687) 9.674 8.098 ( -3.144 -2.012 -4.347) 5.729 8.098 ( -3.144 2.012 -4.347) 5.729 8.783 ( 1.765 -4.020 -6.171) 7.574 8.783 ( 1.765 4.020 -6.171) 7.574 9.545 ( -0.535 -5.916 1.455) 6.116 9.545 ( -0.535 5.916 1.455) 6.116 9.788 ( -0.514 -1.148 6.842) 6.956 9.788 ( -0.514 1.148 6.842) 6.956 10.381 ( -8.325 -5.429 16.068) 18.893 10.381 ( -8.325 5.429 16.068) 18.893 12.262 ( -7.946 -10.990 16.567) 21.410 12.262 ( -7.946 10.990 16.567) 21.410 14.706 ( 0.859 -36.562 -9.766) 37.853 14.706 ( 0.859 36.562 -9.765) 37.853 15.861 ( -8.081 -23.595 5.260) 25.489 15.861 ( -8.081 23.595 5.260) 25.489 18.082 ( -13.548 -4.655 1.021) 14.362 18.082 ( -13.548 4.655 1.021) 14.362 22.443 ( -0.516 -10.948 -7.612) 13.345 22.443 ( -0.516 10.948 -7.612) 13.345 23.182 ( 10.071 -2.207 2.563) 10.624 23.182 ( 10.071 2.207 2.563) 10.624 23.238 ( 2.561 -4.503 2.082) 5.583 23.238 ( 2.561 4.503 2.082) 5.583 25.157 ( 9.196 -16.642 -2.956) 19.242 25.157 ( 9.196 16.642 -2.956) 19.242 ======================= Grid point 151 (81/136) ======================= q-point: (-0.50 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.216 ( 8.365 -0.923 6.588) 10.688 1.216 ( 8.365 0.923 6.588) 10.688 1.925 ( -1.820 -5.787 -2.339) 6.502 1.925 ( -1.820 5.787 -2.339) 6.502 2.077 ( -3.151 -12.042 -8.447) 15.043 2.077 ( -3.151 12.042 -8.447) 15.043 2.469 ( 1.850 -5.716 -1.899) 6.301 2.469 ( 1.850 5.716 -1.899) 6.301 2.909 ( 0.293 -5.884 4.402) 7.354 2.909 ( 0.293 5.884 4.402) 7.354 3.027 ( 2.358 -5.220 1.046) 5.822 3.027 ( 2.358 5.220 1.046) 5.823 3.350 ( -1.017 -11.165 3.746) 11.821 3.350 ( -1.017 11.165 3.746) 11.821 3.632 ( -4.292 -7.905 3.809) 9.768 3.632 ( -4.292 7.905 3.809) 9.768 3.776 ( 1.931 -9.587 6.395) 11.685 3.776 ( 1.931 9.587 6.395) 11.685 4.260 ( 0.469 -4.749 -1.506) 5.004 4.260 ( 0.469 4.749 -1.506) 5.004 4.446 ( 2.062 -6.391 1.397) 6.859 4.446 ( 2.062 6.391 1.397) 6.859 4.612 ( -2.734 -4.620 -1.771) 5.653 4.612 ( -2.734 4.620 -1.771) 5.653 4.865 ( -6.928 -9.157 3.277) 11.941 4.865 ( -6.928 9.157 3.277) 11.941 5.049 ( 1.676 -11.453 -1.331) 11.652 5.049 ( 1.676 11.453 -1.331) 11.652 5.817 ( 1.935 -5.931 -0.725) 6.280 5.817 ( 1.935 5.931 -0.725) 6.280 6.315 ( 0.862 -5.231 -5.910) 7.939 6.315 ( 0.862 5.231 -5.910) 7.939 6.556 ( 3.583 -12.433 -13.059) 18.383 6.556 ( 3.583 12.433 -13.059) 18.383 7.481 ( 3.374 -8.895 -1.139) 9.581 7.481 ( 3.374 8.895 -1.139) 9.581 7.767 ( 0.751 -2.375 -0.326) 2.512 7.767 ( 0.751 2.375 -0.326) 2.512 8.006 ( 1.988 -4.836 -6.031) 7.982 8.006 ( 1.988 4.836 -6.031) 7.982 8.059 ( 2.757 -1.526 -4.353) 5.374 8.059 ( 2.757 1.526 -4.353) 5.374 8.745 ( -0.637 -4.906 -6.985) 8.559 8.745 ( -0.637 4.906 -6.985) 8.559 9.546 ( -0.456 -6.762 1.874) 7.031 9.546 ( -0.456 6.762 1.874) 7.031 9.839 ( 0.427 -1.943 6.468) 6.767 9.839 ( 0.427 1.943 6.468) 6.767 10.364 ( -5.753 -5.105 16.671) 18.360 10.364 ( -5.753 5.105 16.671) 18.360 12.261 ( -5.188 -10.334 17.475) 20.954 12.261 ( -5.188 10.334 17.475) 20.954 14.698 ( 5.253 -36.158 -9.039) 37.639 14.698 ( 5.253 36.158 -9.039) 37.639 15.839 ( 1.704 -22.179 6.625) 23.211 15.839 ( 1.704 22.180 6.625) 23.211 17.852 ( -7.938 -2.003 -2.433) 8.541 17.852 ( -7.938 2.003 -2.433) 8.541 22.387 ( 1.013 -10.375 -8.171) 13.245 22.387 ( 1.013 10.375 -8.171) 13.245 23.207 ( -0.628 -4.233 -1.044) 4.405 23.207 ( -0.628 4.233 -1.044) 4.405 23.479 ( 8.276 -3.285 10.321) 13.631 23.479 ( 8.276 3.285 10.321) 13.631 25.170 ( -4.264 -15.068 -5.877) 16.726 25.170 ( -4.264 15.068 -5.877) 16.726 ======================= Grid point 153 (82/136) ======================= q-point: (-0.38 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.398 ( 4.054 -5.011 7.732) 10.066 1.398 ( 4.054 5.011 7.732) 10.066 1.857 ( 0.061 -2.611 -7.928) 8.347 1.857 ( 0.061 2.611 -7.928) 8.347 1.993 ( -0.602 -7.791 -4.996) 9.275 1.993 ( -0.602 7.791 -4.996) 9.275 2.506 ( 2.100 -5.799 0.445) 6.183 2.506 ( 2.100 5.799 0.445) 6.183 2.901 ( -2.694 -5.372 2.006) 6.336 2.901 ( -2.694 5.372 2.006) 6.336 3.095 ( 2.281 -3.683 1.831) 4.703 3.095 ( 2.281 3.683 1.831) 4.703 3.336 ( -1.872 -4.329 0.993) 4.820 3.336 ( -1.872 4.329 0.993) 4.820 3.572 ( -4.982 -11.196 6.101) 13.689 3.572 ( -4.982 11.196 6.101) 13.689 3.868 ( 2.433 -7.094 4.047) 8.522 3.868 ( 2.433 7.094 4.047) 8.522 4.268 ( 1.783 -7.923 -1.369) 8.236 4.268 ( 1.783 7.923 -1.369) 8.236 4.471 ( -2.636 -1.638 0.005) 3.103 4.471 ( -2.636 1.638 0.005) 3.103 4.552 ( -0.747 -2.872 2.907) 4.154 4.552 ( -0.747 2.872 2.907) 4.154 4.756 ( -5.364 -7.147 -0.156) 8.937 4.756 ( -5.364 7.147 -0.156) 8.937 5.098 ( 3.042 -9.976 0.827) 10.462 5.098 ( 3.042 9.976 0.827) 10.462 5.799 ( -2.847 -5.752 0.549) 6.442 5.799 ( -2.847 5.752 0.549) 6.442 6.289 ( 1.498 -3.656 -8.139) 9.048 6.289 ( 1.498 3.656 -8.139) 9.048 6.560 ( 6.367 -11.762 -12.007) 17.974 6.560 ( 6.367 11.762 -12.007) 17.974 7.546 ( 4.230 -9.236 -2.298) 10.415 7.546 ( 4.230 9.236 -2.298) 10.415 7.766 ( -0.519 -2.242 -0.639) 2.389 7.766 ( -0.519 2.242 -0.639) 2.389 7.993 ( 1.766 -2.678 -6.895) 7.605 7.993 ( 1.766 2.678 -6.895) 7.605 8.104 ( 4.490 -1.508 -4.141) 6.292 8.104 ( 4.490 1.508 -4.141) 6.292 8.669 ( -1.632 -5.119 -6.200) 8.204 8.669 ( -1.632 5.119 -6.200) 8.204 9.555 ( -0.245 -6.130 2.076) 6.477 9.555 ( -0.245 6.130 2.076) 6.477 9.891 ( 0.429 -1.470 4.832) 5.069 9.891 ( 0.429 1.470 4.832) 5.069 10.396 ( -3.829 -4.944 16.731) 17.862 10.396 ( -3.829 4.944 16.731) 17.862 12.308 ( -3.906 -12.348 18.410) 22.509 12.308 ( -3.906 12.348 18.410) 22.509 14.749 ( 6.313 -34.333 -9.414) 36.156 14.749 ( 6.313 34.333 -9.414) 36.156 16.032 ( 13.202 -21.036 5.074) 25.348 16.032 ( 13.202 21.036 5.074) 25.348 17.813 ( 6.328 -2.214 1.056) 6.786 17.813 ( 6.328 2.214 1.056) 6.786 22.365 ( 2.577 -9.725 -7.293) 12.426 22.365 ( 2.577 9.725 -7.293) 12.426 23.176 ( -2.024 -4.118 -0.912) 4.678 23.176 ( -2.024 4.118 -0.912) 4.678 23.603 ( -3.692 -7.568 6.712) 10.768 23.603 ( -3.692 7.568 6.712) 10.768 24.937 ( -14.328 -10.447 -4.761) 18.360 24.937 ( -14.328 10.447 -4.761) 18.360 ======================= Grid point 155 (83/136) ======================= q-point: (-0.25 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.467 ( -2.345 -9.938 6.668) 12.195 1.467 ( -2.345 9.938 6.668) 12.195 1.824 ( -1.135 -10.817 0.023) 10.876 1.824 ( -1.135 10.817 0.023) 10.876 1.997 ( 8.057 -9.744 -11.497) 17.089 1.997 ( 8.057 9.744 -11.497) 17.089 2.531 ( -0.171 -5.453 -0.623) 5.491 2.531 ( -0.171 5.453 -0.623) 5.491 2.868 ( -1.669 -5.781 2.385) 6.472 2.868 ( -1.669 5.781 2.385) 6.472 3.102 ( -1.603 -5.177 -2.192) 5.846 3.102 ( -1.603 5.177 -2.192) 5.846 3.320 ( -0.680 -4.717 2.320) 5.301 3.320 ( -0.680 4.717 2.320) 5.301 3.531 ( -4.269 -12.216 6.577) 14.516 3.531 ( -4.269 12.216 6.577) 14.516 3.919 ( 0.852 -6.441 2.328) 6.901 3.919 ( 0.852 6.441 2.328) 6.901 4.271 ( -1.793 -4.149 -2.971) 5.409 4.271 ( -1.793 4.149 -2.971) 5.409 4.417 ( -0.431 -3.824 1.880) 4.283 4.417 ( -0.431 3.824 1.880) 4.283 4.562 ( -3.891 -1.983 2.698) 5.133 4.562 ( -3.891 1.983 2.698) 5.133 4.704 ( 1.875 -1.595 1.165) 2.723 4.704 ( 1.875 1.595 1.165) 2.723 5.160 ( 1.872 -9.201 1.929) 9.586 5.160 ( 1.872 9.201 1.929) 9.586 5.738 ( -4.086 -5.092 1.470) 6.692 5.738 ( -4.086 5.092 1.470) 6.692 6.250 ( 1.670 -6.043 -9.786) 11.622 6.250 ( 1.670 6.043 -9.786) 11.622 6.628 ( 8.804 -9.237 -9.862) 16.127 6.628 ( 8.804 9.237 -9.862) 16.127 7.587 ( 1.664 -9.818 -4.397) 10.885 7.587 ( 1.664 9.818 -4.397) 10.885 7.746 ( -0.676 -3.319 -0.262) 3.397 7.746 ( -0.676 3.319 -0.262) 3.397 7.974 ( 1.802 -5.316 -7.283) 9.195 7.974 ( 1.802 5.316 -7.283) 9.195 8.158 ( 4.746 -1.092 -5.838) 7.603 8.158 ( 4.746 1.092 -5.838) 7.603 8.613 ( 0.070 -4.125 -3.807) 5.613 8.613 ( 0.070 4.125 -3.807) 5.613 9.559 ( -0.914 -4.766 1.812) 5.180 9.559 ( -0.914 4.766 1.812) 5.180 9.918 ( -0.638 -1.329 2.854) 3.213 9.918 ( -0.638 1.329 2.854) 3.213 10.452 ( -3.198 -5.063 16.280) 17.347 10.452 ( -3.198 5.063 16.280) 17.347 12.368 ( -4.175 -15.620 18.691) 24.714 12.368 ( -4.175 15.620 18.691) 24.714 14.794 ( 5.434 -32.416 -8.817) 34.030 14.794 ( 5.434 32.416 -8.817) 34.030 16.345 ( 15.591 -19.553 -1.924) 25.082 16.345 ( 15.591 19.553 -1.924) 25.082 18.155 ( 24.521 -1.180 7.785) 25.754 18.155 ( 24.521 1.180 7.785) 25.754 22.387 ( 4.816 -8.194 -5.098) 10.786 22.387 ( 4.816 8.194 -5.098) 10.786 23.090 ( -8.148 -2.594 -1.314) 8.651 23.090 ( -8.148 2.594 -1.314) 8.651 23.410 ( -15.045 -5.585 -2.806) 16.291 23.410 ( -15.045 5.585 -2.806) 16.291 24.623 ( -15.664 -6.674 2.105) 17.156 24.623 ( -15.664 6.674 2.105) 17.156 ======================= Grid point 157 (84/136) ======================= q-point: (-0.12 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.412 ( -7.837 -12.590 5.922) 15.969 1.412 ( -7.837 12.590 5.922) 15.969 1.807 ( -2.947 -13.946 6.578) 15.698 1.807 ( -2.947 13.946 6.578) 15.698 2.124 ( 13.597 -4.700 -14.565) 20.472 2.124 ( 13.597 4.700 -14.565) 20.472 2.496 ( -0.633 -3.726 -3.583) 5.208 2.496 ( -0.633 3.726 -3.583) 5.208 2.869 ( -1.144 -5.992 2.482) 6.586 2.869 ( -1.144 5.992 2.482) 6.586 3.023 ( -2.878 -4.589 -5.294) 7.575 3.023 ( -2.878 4.589 -5.294) 7.575 3.327 ( -1.418 -10.860 3.759) 11.579 3.327 ( -1.418 10.860 3.759) 11.579 3.504 ( -2.627 -5.777 4.782) 7.946 3.504 ( -2.627 5.777 4.782) 7.946 3.947 ( -0.469 -4.823 3.833) 6.178 3.947 ( -0.469 4.823 3.833) 6.178 4.184 ( -3.242 -4.712 -2.547) 6.261 4.184 ( -3.242 4.712 -2.547) 6.261 4.452 ( 0.754 -9.858 -1.407) 9.986 4.452 ( 0.754 9.858 -1.407) 9.986 4.483 ( -3.050 -4.584 2.722) 6.142 4.483 ( -3.050 4.584 2.722) 6.142 4.808 ( 5.013 -0.837 5.192) 7.266 4.808 ( 5.013 0.837 5.192) 7.266 5.193 ( 0.174 -10.079 1.937) 10.265 5.193 ( 0.174 10.079 1.937) 10.265 5.654 ( -5.429 -4.161 -0.037) 6.841 5.654 ( -5.429 4.161 -0.037) 6.841 6.232 ( 3.816 -8.537 -8.553) 12.673 6.232 ( 3.816 8.537 -8.553) 12.673 6.743 ( 9.385 -6.994 -8.102) 14.235 6.743 ( 9.385 6.994 -8.102) 14.235 7.534 ( -2.722 -7.681 -5.561) 9.865 7.534 ( -2.722 7.681 -5.561) 9.865 7.743 ( 0.043 -1.805 -0.137) 1.810 7.743 ( 0.043 1.805 -0.137) 1.810 7.954 ( 1.703 -6.596 -7.808) 10.362 7.954 ( 1.703 6.596 -7.808) 10.362 8.205 ( 5.319 -1.924 -7.201) 9.157 8.205 ( 5.319 1.924 -7.201) 9.157 8.622 ( 2.422 -2.175 -1.027) 3.414 8.622 ( 2.422 2.175 -1.027) 3.414 9.545 ( -1.651 -3.205 1.332) 3.843 9.545 ( -1.651 3.205 1.332) 3.843 9.906 ( -2.138 -2.578 1.241) 3.571 9.906 ( -2.138 2.578 1.241) 3.571 10.503 ( -3.971 -5.455 15.984) 17.350 10.503 ( -3.971 5.455 15.984) 17.350 12.414 ( -5.387 -18.312 18.633) 26.674 12.414 ( -5.387 18.312 18.633) 26.674 14.837 ( 5.117 -31.979 -7.538) 33.252 14.837 ( 5.117 31.979 -7.538) 33.252 16.565 ( 10.017 -18.280 -5.962) 21.681 16.565 ( 10.017 18.280 -5.962) 21.681 18.688 ( 19.256 -7.121 3.026) 20.752 18.688 ( 19.256 7.121 3.026) 20.752 22.495 ( 7.905 -5.982 -1.678) 10.054 22.495 ( 7.905 5.982 -1.678) 10.054 22.761 ( -16.978 -2.801 -2.416) 17.376 22.761 ( -16.978 2.801 -2.416) 17.376 23.212 ( -3.428 -3.417 -1.937) 5.214 23.212 ( -3.428 3.417 -1.937) 5.214 24.370 ( -13.237 -7.076 4.372) 15.633 24.370 ( -13.237 7.076 4.372) 15.633 ======================= Grid point 175 (85/136) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.049 ( -10.410 0.000 19.132) 21.781 1.392 ( -3.341 0.000 16.391) 16.728 1.780 ( 15.013 0.000 -17.602) 23.135 1.895 ( -1.930 0.000 -5.819) 6.131 2.142 ( -6.008 0.000 -3.400) 6.903 2.297 ( 9.737 0.000 -4.374) 10.674 2.371 ( -12.153 0.000 -6.649) 13.853 2.627 ( 0.721 0.000 -0.022) 0.722 2.677 ( -1.422 0.000 0.317) 1.457 2.690 ( -7.664 0.000 18.854) 20.352 2.795 ( 5.961 0.000 -1.335) 6.109 2.893 ( 2.785 0.000 -8.860) 9.288 3.210 ( -4.796 0.000 14.143) 14.934 3.272 ( -1.258 0.000 5.174) 5.325 3.540 ( 1.783 0.000 -2.959) 3.455 3.567 ( -3.833 0.000 3.550) 5.224 3.767 ( -6.829 0.000 10.519) 12.541 3.896 ( 0.513 0.000 3.833) 3.867 4.073 ( 0.128 0.000 1.152) 1.159 4.104 ( 3.501 0.000 0.350) 3.519 4.241 ( 1.025 0.000 -2.641) 2.833 4.511 ( -0.105 0.000 1.467) 1.470 4.708 ( 1.090 0.000 -2.185) 2.442 4.772 ( 2.422 0.000 -6.959) 7.368 4.905 ( 0.156 0.000 6.882) 6.884 5.253 ( 0.804 0.000 -0.125) 0.814 5.340 ( 2.744 0.000 3.080) 4.125 5.547 ( 5.319 0.000 -5.955) 7.985 5.578 ( 4.851 0.000 -13.910) 14.732 5.873 ( -4.502 0.000 11.414) 12.270 6.185 ( -2.032 0.000 -4.994) 5.392 6.547 ( -6.950 0.000 8.329) 10.848 6.881 ( 2.246 0.000 14.391) 14.565 6.957 ( 6.406 0.000 -6.641) 9.227 7.009 ( 0.586 0.000 -0.782) 0.977 7.434 ( -1.623 0.000 -4.243) 4.543 7.480 ( 3.508 0.000 -6.138) 7.070 7.579 ( 4.131 0.000 -9.097) 9.991 7.618 ( -2.700 0.000 -6.674) 7.199 8.008 ( -0.873 0.000 1.146) 1.441 8.138 ( 2.525 0.000 -4.803) 5.426 8.317 ( 3.596 0.000 -6.713) 7.615 8.372 ( -2.090 0.000 -2.186) 3.025 8.876 ( 2.234 0.000 -2.454) 3.319 9.446 ( -1.195 0.000 2.885) 3.123 9.664 ( -2.267 0.000 0.734) 2.383 9.815 ( -0.298 0.000 6.774) 6.780 9.910 ( -5.134 0.000 4.430) 6.781 10.104 ( -1.486 0.000 3.264) 3.586 10.205 ( 0.518 0.000 1.615) 1.696 12.205 ( 5.083 0.000 -12.218) 13.233 12.885 ( -1.034 0.000 7.732) 7.801 14.397 ( -10.425 0.000 -8.645) 13.543 14.590 ( -2.435 0.000 6.483) 6.925 17.161 ( 0.049 0.000 -0.275) 0.279 17.628 ( 22.725 0.000 18.878) 29.543 18.340 ( -44.168 0.000 -14.207) 46.397 18.506 ( -0.600 0.000 -1.675) 1.779 22.103 ( -0.143 0.000 -6.264) 6.265 22.522 ( 0.780 0.000 0.868) 1.167 22.606 ( -3.133 0.000 2.901) 4.270 23.045 ( 7.922 0.000 -3.863) 8.814 23.321 ( 0.709 0.000 -1.599) 1.749 23.374 ( 13.725 0.000 3.136) 14.079 24.090 ( 3.907 0.000 1.600) 4.222 24.508 ( -2.568 0.000 1.597) 3.024 ======================= Grid point 176 (86/136) ======================= q-point: ( 0.12 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.041 ( -2.410 0.000 13.172) 13.390 1.472 ( -0.377 0.000 13.851) 13.856 1.849 ( 4.658 0.000 -17.106) 17.729 1.852 ( 0.836 0.000 -2.727) 2.852 1.987 ( -6.351 0.000 -1.609) 6.551 2.119 ( -8.144 0.000 -4.474) 9.292 2.493 ( 10.037 0.000 -0.168) 10.038 2.610 ( 0.088 0.000 -0.972) 0.976 2.707 ( 2.221 0.000 2.346) 3.230 2.725 ( -3.250 0.000 18.594) 18.876 2.888 ( 3.659 0.000 -6.258) 7.249 2.953 ( 10.840 0.000 -7.196) 13.011 3.219 ( -6.799 0.000 19.217) 20.384 3.257 ( -3.863 0.000 4.710) 6.091 3.514 ( -4.292 0.000 3.753) 5.701 3.554 ( 2.228 0.000 -3.574) 4.212 3.725 ( -5.523 0.000 10.639) 11.987 3.930 ( 3.449 0.000 -4.731) 5.855 4.117 ( 0.559 0.000 8.260) 8.278 4.171 ( 3.654 0.000 -1.695) 4.028 4.212 ( -1.439 0.000 -4.345) 4.577 4.505 ( -1.970 0.000 2.746) 3.380 4.695 ( -0.976 0.000 -1.714) 1.972 4.763 ( 3.116 0.000 -10.567) 11.017 4.949 ( 0.410 0.000 3.417) 3.442 5.250 ( -1.025 0.000 -1.039) 1.460 5.435 ( 6.004 0.000 -0.240) 6.008 5.550 ( 0.907 0.000 -9.397) 9.440 5.578 ( 4.680 0.000 -11.527) 12.441 5.886 ( -3.757 0.000 13.810) 14.312 6.133 ( -0.461 0.000 -3.048) 3.082 6.421 ( -11.486 0.000 7.764) 13.864 6.934 ( -3.341 0.000 5.768) 6.666 7.000 ( 3.227 0.000 -7.651) 8.304 7.042 ( 0.421 0.000 2.835) 2.866 7.404 ( 1.571 0.000 -4.234) 4.516 7.484 ( 0.071 0.000 -12.954) 12.954 7.539 ( 6.113 0.000 -3.968) 7.288 7.658 ( 5.028 0.000 -1.502) 5.248 7.991 ( -1.910 0.000 1.641) 2.518 8.113 ( -0.985 0.000 -4.870) 4.969 8.316 ( 1.865 0.000 -7.620) 7.845 8.350 ( 0.300 0.000 0.113) 0.321 8.912 ( 3.471 0.000 -3.147) 4.685 9.434 ( -2.106 0.000 2.625) 3.366 9.632 ( -2.234 0.000 3.062) 3.790 9.835 ( -3.450 0.000 3.998) 5.281 9.887 ( -0.379 0.000 8.310) 8.319 10.085 ( -3.024 0.000 3.414) 4.560 10.204 ( -1.548 0.000 0.690) 1.695 12.211 ( 4.887 0.000 -12.560) 13.477 12.871 ( -5.825 0.000 5.997) 8.360 14.016 ( -25.579 0.000 8.702) 27.019 14.590 ( -2.401 0.000 6.451) 6.883 17.160 ( 0.016 0.000 -0.220) 0.221 17.407 ( -36.932 0.000 -2.991) 37.053 18.204 ( 12.321 0.000 23.036) 26.124 18.347 ( -13.879 0.000 -0.446) 13.886 22.043 ( -2.176 0.000 -4.321) 4.838 22.636 ( 4.417 0.000 4.711) 6.458 22.661 ( 12.175 0.000 -0.265) 12.178 23.097 ( 2.333 0.000 -7.357) 7.718 23.286 ( -14.145 0.000 -7.113) 15.833 23.326 ( 1.078 0.000 -1.674) 1.991 24.126 ( 6.943 0.000 -0.801) 6.989 24.987 ( 35.593 0.000 -3.406) 35.755 ======================= Grid point 177 (87/136) ======================= q-point: ( 0.25 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.124 ( 4.434 0.000 1.541) 4.694 1.555 ( -0.558 0.000 9.685) 9.701 1.706 ( -6.663 0.000 -16.911) 18.176 1.882 ( 1.569 0.000 4.290) 4.568 1.930 ( 0.738 0.000 4.661) 4.719 2.028 ( 1.866 0.000 -3.204) 3.708 2.553 ( 0.077 0.000 -1.482) 1.484 2.721 ( 6.281 0.000 2.749) 6.856 2.777 ( 3.465 0.000 1.687) 3.854 2.819 ( -0.701 0.000 16.120) 16.135 2.922 ( 4.644 0.000 -5.715) 7.364 3.083 ( 7.262 0.000 -8.004) 10.807 3.203 ( -4.701 0.000 4.138) 6.263 3.225 ( -8.780 0.000 22.424) 24.082 3.469 ( -3.076 0.000 4.709) 5.625 3.590 ( 4.247 0.000 -2.163) 4.765 3.706 ( -4.459 0.000 10.209) 11.141 3.970 ( 5.595 0.000 -8.224) 9.947 4.129 ( -3.277 0.000 -2.870) 4.356 4.209 ( 2.648 0.000 6.004) 6.562 4.211 ( 1.671 0.000 -2.083) 2.671 4.481 ( -2.677 0.000 3.036) 4.048 4.650 ( -2.250 0.000 -1.429) 2.666 4.729 ( 1.467 0.000 -11.614) 11.706 4.962 ( 0.077 0.000 -1.255) 1.258 5.205 ( -0.481 0.000 -5.504) 5.525 5.474 ( -0.092 0.000 -11.493) 11.494 5.483 ( 0.444 0.000 -6.843) 6.857 5.654 ( 7.677 0.000 -0.123) 7.678 5.904 ( -5.440 0.000 13.893) 14.920 6.112 ( -0.784 0.000 0.049) 0.785 6.254 ( -10.067 0.000 6.721) 12.105 6.905 ( -1.351 0.000 -1.511) 2.027 6.976 ( 0.879 0.000 -8.787) 8.831 6.997 ( -4.126 0.000 -2.642) 4.899 7.420 ( 3.317 0.000 -5.260) 6.218 7.444 ( 2.999 0.000 -6.488) 7.147 7.642 ( 6.102 0.000 -1.170) 6.213 7.758 ( 5.403 0.000 0.379) 5.416 7.958 ( -2.685 0.000 1.651) 3.152 8.058 ( -0.889 0.000 -4.186) 4.279 8.286 ( 1.261 0.000 -8.120) 8.217 8.365 ( 0.245 0.000 1.951) 1.967 8.956 ( 3.630 0.000 -4.109) 5.483 9.406 ( -2.410 0.000 2.194) 3.259 9.634 ( -0.714 0.000 5.560) 5.605 9.798 ( -3.962 0.000 6.520) 7.629 9.955 ( 1.091 0.000 6.686) 6.775 10.041 ( -3.706 0.000 2.981) 4.756 10.156 ( -3.709 0.000 0.356) 3.726 12.210 ( 4.594 0.000 -12.855) 13.651 12.772 ( -7.794 0.000 7.118) 10.555 13.652 ( -21.995 0.000 20.539) 30.093 14.591 ( -2.391 0.000 6.404) 6.836 16.846 ( -20.534 0.000 0.140) 20.534 17.160 ( 0.135 0.000 -0.168) 0.215 18.029 ( -17.255 0.000 0.496) 17.262 18.332 ( -14.776 0.000 12.482) 19.342 21.947 ( -3.799 0.000 -4.850) 6.161 22.889 ( 15.028 0.000 9.688) 17.880 22.930 ( 14.744 0.000 -1.182) 14.791 22.943 ( -9.462 0.000 -3.096) 9.956 23.139 ( 4.881 0.000 -7.350) 8.823 23.336 ( 1.054 0.000 -1.713) 2.011 24.338 ( 13.216 0.000 -0.595) 13.229 25.524 ( 23.368 0.000 -9.771) 25.329 ======================= Grid point 178 (88/136) ======================= q-point: ( 0.38 0.00 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.188 ( 1.598 0.000 -8.707) 8.853 1.410 ( -9.147 0.000 -9.754) 13.372 1.583 ( -2.773 0.000 6.710) 7.260 1.982 ( 4.547 0.000 6.101) 7.609 2.080 ( 8.467 0.000 9.200) 12.503 2.108 ( 6.091 0.000 0.961) 6.166 2.547 ( 0.528 0.000 -1.469) 1.561 2.804 ( 1.266 0.000 2.208) 2.545 2.846 ( 2.011 0.000 -0.501) 2.073 2.910 ( 0.407 0.000 8.178) 8.188 2.974 ( 2.323 0.000 -2.073) 3.114 3.089 ( -0.892 0.000 -5.116) 5.193 3.150 ( -3.218 0.000 2.979) 4.385 3.207 ( -8.025 0.000 17.298) 19.069 3.481 ( -0.255 0.000 7.909) 7.913 3.686 ( 5.911 0.000 -0.971) 5.990 3.699 ( -4.477 0.000 11.645) 12.476 4.014 ( 4.516 0.000 -8.281) 9.432 4.052 ( -1.392 0.000 -3.974) 4.210 4.194 ( -1.973 0.000 -1.979) 2.795 4.297 ( 1.575 0.000 2.950) 3.344 4.448 ( -2.985 0.000 5.317) 6.098 4.605 ( -1.325 0.000 -0.193) 1.339 4.654 ( 0.694 0.000 -12.333) 12.353 4.931 ( -1.273 0.000 -5.214) 5.367 5.179 ( 2.349 0.000 -5.198) 5.704 5.395 ( 1.667 0.000 -13.414) 13.517 5.407 ( -2.233 0.000 -7.285) 7.619 5.759 ( -1.174 0.000 7.048) 7.146 5.874 ( -8.455 0.000 14.992) 17.212 6.109 ( 0.116 0.000 1.891) 1.894 6.189 ( 0.977 0.000 2.236) 2.441 6.806 ( -3.722 0.000 -10.191) 10.849 6.918 ( -0.044 0.000 -8.512) 8.512 6.941 ( 0.032 0.000 -1.843) 1.843 7.447 ( 3.953 0.000 -6.876) 7.931 7.484 ( 4.072 0.000 -2.488) 4.772 7.743 ( 4.361 0.000 0.257) 4.368 7.852 ( 2.426 0.000 1.828) 3.037 7.927 ( -0.147 0.000 -0.214) 0.260 8.024 ( 0.272 0.000 -3.186) 3.198 8.251 ( 1.013 0.000 -7.317) 7.387 8.391 ( 0.712 0.000 3.055) 3.137 8.981 ( 2.135 0.000 -4.865) 5.313 9.380 ( -1.769 0.000 1.978) 2.654 9.683 ( 1.012 0.000 6.207) 6.289 9.779 ( -3.558 0.000 7.904) 8.668 9.993 ( -2.800 0.000 1.817) 3.338 10.016 ( 0.522 0.000 5.467) 5.492 10.076 ( -4.689 0.000 1.175) 4.833 12.201 ( 4.369 0.000 -12.942) 13.660 12.738 ( -1.709 0.000 10.415) 10.554 13.464 ( -13.851 0.000 22.540) 26.455 14.592 ( -2.404 0.000 6.374) 6.812 16.600 ( -6.198 0.000 3.707) 7.222 17.163 ( 0.341 0.000 -0.149) 0.372 17.746 ( -11.170 0.000 0.696) 11.192 17.879 ( -30.588 0.000 -4.881) 30.975 21.860 ( -0.835 0.000 -5.362) 5.427 22.809 ( -4.646 0.000 1.806) 4.985 23.061 ( 3.319 0.000 -6.366) 7.179 23.167 ( 9.996 0.000 -1.541) 10.114 23.337 ( 0.107 0.000 -1.594) 1.597 23.479 ( 21.103 0.000 16.794) 26.970 24.576 ( 10.682 0.000 0.958) 10.725 25.736 ( 7.848 0.000 -14.477) 16.467 ======================= Grid point 179 (89/136) ======================= q-point: (-0.50 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.997 ( -8.165 0.000 -4.405) 9.278 1.333 ( 1.951 0.000 -7.642) 7.887 1.549 ( -5.854 0.000 7.259) 9.325 2.101 ( 4.843 0.000 -1.277) 5.009 2.250 ( 4.639 0.000 6.896) 8.311 2.351 ( 10.446 0.000 11.994) 15.905 2.550 ( 0.554 0.000 -0.816) 0.987 2.820 ( 0.092 0.000 -0.746) 0.752 2.844 ( -0.504 0.000 -2.107) 2.167 2.868 ( -6.486 0.000 -12.648) 14.214 2.950 ( -0.441 0.000 2.659) 2.696 3.085 ( -5.350 0.000 16.800) 17.631 3.131 ( -0.852 0.000 2.439) 2.583 3.166 ( -2.808 0.000 1.760) 3.314 3.561 ( 1.015 0.000 9.700) 9.753 3.691 ( -2.018 0.000 3.333) 3.896 3.776 ( -0.119 0.000 8.185) 8.186 3.976 ( -3.367 0.000 0.583) 3.417 4.066 ( 6.119 0.000 -9.319) 11.148 4.121 ( -3.826 0.000 -0.347) 3.842 4.260 ( -3.082 0.000 -3.437) 4.616 4.504 ( 1.204 0.000 8.824) 8.906 4.581 ( -0.074 0.000 -9.637) 9.637 4.602 ( 0.531 0.000 0.804) 0.963 4.850 ( -0.431 0.000 -8.460) 8.471 5.198 ( -0.155 0.000 -0.801) 0.816 5.318 ( 0.242 0.000 -7.663) 7.667 5.348 ( 4.289 0.000 -14.997) 15.598 5.741 ( -6.108 0.000 11.287) 12.833 5.820 ( -8.598 0.000 17.097) 19.137 6.148 ( 1.853 0.000 3.416) 3.886 6.281 ( 7.007 0.000 -3.125) 7.673 6.670 ( -1.961 0.000 -10.466) 10.648 6.857 ( -0.180 0.000 -7.132) 7.134 6.935 ( 1.088 0.000 -3.206) 3.385 7.469 ( 3.982 0.000 -8.021) 8.955 7.542 ( 2.860 0.000 -1.983) 3.481 7.798 ( 0.976 0.000 -0.614) 1.153 7.871 ( 0.058 0.000 1.873) 1.874 7.959 ( 2.711 0.000 -2.551) 3.723 8.022 ( 1.439 0.000 -1.973) 2.442 8.221 ( 0.963 0.000 -5.896) 5.974 8.437 ( 1.697 0.000 2.549) 3.062 8.964 ( 0.044 0.000 -5.256) 5.256 9.369 ( -0.978 0.000 2.411) 2.601 9.749 ( 1.247 0.000 4.476) 4.646 9.773 ( -3.368 0.000 8.488) 9.131 9.972 ( -0.250 0.000 1.173) 1.200 10.011 ( -2.955 0.000 2.607) 3.941 10.052 ( -0.565 0.000 4.390) 4.426 12.191 ( 4.361 0.000 -12.753) 13.478 12.814 ( -0.166 0.000 8.397) 8.399 13.488 ( 1.360 0.000 21.984) 22.026 14.592 ( -2.431 0.000 6.372) 6.820 16.682 ( 9.705 0.000 11.408) 14.978 17.167 ( 0.096 0.000 -0.164) 0.190 17.252 ( -24.417 0.000 -10.949) 26.760 17.643 ( 0.633 0.000 0.328) 0.713 21.836 ( 2.262 0.000 -5.329) 5.789 22.759 ( -3.399 0.000 4.396) 5.556 23.065 ( 2.994 0.000 -8.039) 8.579 23.271 ( 0.187 0.000 -1.810) 1.819 23.314 ( 0.068 0.000 -0.955) 0.958 23.923 ( 9.799 0.000 14.053) 17.132 24.752 ( 4.706 0.000 5.225) 7.032 25.626 ( -6.256 0.000 -18.079) 19.131 ======================= Grid point 180 (90/136) ======================= q-point: (-0.38 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.978 ( 7.577 0.000 1.102) 7.657 1.291 ( -1.811 0.000 -3.353) 3.811 1.474 ( -8.211 0.000 10.464) 13.301 2.136 ( 1.106 0.000 -4.943) 5.065 2.335 ( 0.530 0.000 0.181) 0.560 2.546 ( -0.370 0.000 -0.878) 0.953 2.570 ( -2.087 0.000 -3.583) 4.147 2.652 ( 0.354 0.000 -0.441) 0.566 2.817 ( -0.929 0.000 -1.461) 1.731 2.822 ( 1.519 0.000 -1.491) 2.129 2.926 ( -6.348 0.000 8.588) 10.680 3.057 ( -7.543 0.000 11.062) 13.388 3.143 ( -0.042 0.000 2.679) 2.680 3.158 ( 1.060 0.000 -0.799) 1.327 3.631 ( -0.493 0.000 6.704) 6.722 3.652 ( -2.686 0.000 -2.042) 3.374 3.814 ( -3.629 0.000 13.674) 14.147 3.919 ( -3.827 0.000 3.300) 5.054 4.063 ( -3.150 0.000 2.639) 4.109 4.147 ( 6.724 0.000 -4.610) 8.152 4.193 ( 0.004 0.000 -4.162) 4.162 4.424 ( -4.878 0.000 -6.570) 8.183 4.624 ( 1.775 0.000 -1.236) 2.163 4.651 ( 3.596 0.000 7.418) 8.243 4.819 ( 2.228 0.000 -6.660) 7.023 5.136 ( -2.726 0.000 -2.818) 3.921 5.319 ( 1.486 0.000 -1.528) 2.131 5.343 ( 6.012 0.000 -13.378) 14.667 5.709 ( -4.095 0.000 6.525) 7.704 5.807 ( -5.591 0.000 16.935) 17.834 6.226 ( 2.624 0.000 5.265) 5.882 6.384 ( 6.012 0.000 -3.043) 6.738 6.586 ( 0.467 0.000 -8.113) 8.126 6.814 ( 0.915 0.000 -5.887) 5.958 6.939 ( 1.578 0.000 -2.387) 2.862 7.482 ( 3.485 0.000 -8.275) 8.979 7.552 ( 0.773 0.000 -3.913) 3.989 7.767 ( -3.085 0.000 -1.593) 3.472 7.913 ( 2.813 0.000 1.281) 3.091 7.954 ( -1.084 0.000 -3.525) 3.688 8.041 ( 2.107 0.000 -2.845) 3.540 8.212 ( 2.597 0.000 -5.610) 6.183 8.482 ( 1.451 0.000 0.373) 1.498 8.918 ( -0.741 0.000 -4.600) 4.659 9.381 ( 0.223 0.000 2.934) 2.942 9.771 ( -3.280 0.000 8.509) 9.119 9.774 ( -1.165 0.000 1.752) 2.104 10.000 ( 2.027 0.000 1.065) 2.290 10.017 ( 1.032 0.000 4.191) 4.316 10.058 ( -1.816 0.000 3.498) 3.941 12.185 ( 4.584 0.000 -12.386) 13.207 12.813 ( -4.081 0.000 5.544) 6.884 13.834 ( 19.034 0.000 10.915) 21.941 14.591 ( -2.465 0.000 6.395) 6.854 16.825 ( -7.303 0.000 -7.098) 10.184 17.165 ( -0.124 0.000 -0.209) 0.243 17.232 ( 29.868 0.000 24.991) 38.944 17.774 ( 12.367 0.000 -0.411) 12.374 21.863 ( 4.511 0.000 -5.465) 7.086 22.734 ( -2.920 0.000 5.409) 6.147 23.059 ( 2.183 0.000 -7.457) 7.770 23.145 ( -10.402 0.000 -0.618) 10.420 23.330 ( 0.907 0.000 -1.359) 1.634 23.997 ( -7.838 0.000 -1.283) 7.942 24.745 ( -11.104 0.000 -2.268) 11.334 25.317 ( -12.014 0.000 -5.395) 13.170 ======================= Grid point 181 (91/136) ======================= q-point: (-0.25 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.176 ( 1.400 0.000 3.557) 3.822 1.284 ( 10.358 0.000 -1.568) 10.476 1.401 ( -8.430 0.000 14.450) 16.729 2.084 ( -2.252 0.000 -4.643) 5.161 2.276 ( -1.162 0.000 -10.724) 10.787 2.365 ( -4.017 0.000 -13.851) 14.422 2.551 ( 1.555 0.000 -0.433) 1.614 2.753 ( -0.267 0.000 7.747) 7.751 2.779 ( -2.656 0.000 0.269) 2.670 2.820 ( -1.837 0.000 -3.458) 3.915 2.842 ( -11.763 0.000 17.135) 20.784 2.983 ( -2.601 0.000 -3.297) 4.199 3.172 ( 0.653 0.000 4.499) 4.546 3.175 ( -1.414 0.000 6.021) 6.184 3.577 ( -2.308 0.000 -3.186) 3.934 3.639 ( -2.662 0.000 4.767) 5.460 3.839 ( -4.818 0.000 14.454) 15.236 3.878 ( -3.809 0.000 5.786) 6.927 4.031 ( -2.181 0.000 3.304) 3.958 4.130 ( 1.803 0.000 -11.638) 11.776 4.242 ( -1.371 0.000 3.172) 3.456 4.379 ( 4.994 0.000 -0.638) 5.034 4.654 ( 3.040 0.000 -3.248) 4.449 4.757 ( 4.404 0.000 -0.865) 4.488 4.806 ( -2.376 0.000 3.775) 4.460 5.117 ( 4.104 0.000 -4.359) 5.988 5.320 ( -2.134 0.000 3.475) 4.078 5.384 ( 6.587 0.000 -8.994) 11.148 5.666 ( -1.941 0.000 -2.507) 3.170 5.840 ( -3.169 0.000 13.807) 14.166 6.301 ( 0.910 0.000 2.528) 2.686 6.478 ( 4.348 0.000 1.452) 4.584 6.580 ( 2.830 0.000 -0.096) 2.832 6.815 ( 3.696 0.000 -5.653) 6.754 6.961 ( 1.893 0.000 -0.752) 2.037 7.482 ( 2.671 0.000 -8.016) 8.449 7.539 ( 1.998 0.000 -5.780) 6.116 7.667 ( -5.468 0.000 -2.222) 5.902 7.872 ( -4.056 0.000 -4.122) 5.783 7.976 ( 2.295 0.000 0.879) 2.457 8.063 ( 3.051 0.000 -4.200) 5.191 8.236 ( 4.379 0.000 -6.429) 7.779 8.488 ( -0.206 0.000 -2.186) 2.196 8.879 ( -0.205 0.000 -3.248) 3.254 9.413 ( 0.572 0.000 2.850) 2.907 9.744 ( -2.206 0.000 0.291) 2.226 9.772 ( -2.905 0.000 8.224) 8.721 10.033 ( -3.219 0.000 2.901) 4.333 10.053 ( 1.747 0.000 2.410) 2.977 10.089 ( 2.939 0.000 3.277) 4.402 12.187 ( 4.883 0.000 -12.076) 13.026 12.788 ( -1.978 0.000 5.754) 6.085 14.256 ( 20.972 0.000 -7.447) 22.254 14.590 ( -2.485 0.000 6.437) 6.900 16.800 ( 7.287 0.000 1.178) 7.382 17.162 ( 0.044 0.000 -0.270) 0.274 18.075 ( 18.044 0.000 -1.358) 18.095 18.223 ( 47.719 0.000 23.385) 53.141 21.933 ( 6.815 0.000 -4.596) 8.220 22.728 ( -1.721 0.000 5.972) 6.215 22.890 ( -14.969 0.000 0.458) 14.976 23.042 ( 0.744 0.000 -5.005) 5.060 23.329 ( 0.256 0.000 -1.465) 1.488 23.541 ( -31.060 0.000 -18.929) 36.374 24.367 ( -17.521 0.000 -3.853) 17.940 25.119 ( -14.367 0.000 10.207) 17.623 ======================= Grid point 182 (92/136) ======================= q-point: (-0.12 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.128 ( -10.114 0.000 15.883) 18.830 1.368 ( -6.721 0.000 16.833) 18.125 1.558 ( 18.770 0.000 -12.700) 22.663 1.994 ( -3.467 0.000 -4.942) 6.037 2.211 ( 4.287 0.000 -10.987) 11.794 2.243 ( -0.757 0.000 -9.197) 9.228 2.583 ( 1.292 0.000 -1.434) 1.930 2.659 ( -9.470 0.000 -4.183) 10.352 2.730 ( -3.043 0.000 -0.746) 3.133 2.742 ( -11.715 0.000 19.293) 22.571 2.757 ( -2.084 0.000 3.604) 4.163 2.922 ( 0.733 0.000 -8.066) 8.099 3.193 ( -2.887 0.000 10.432) 10.824 3.231 ( 1.079 0.000 5.566) 5.669 3.536 ( 0.452 0.000 -2.900) 2.935 3.610 ( -3.580 0.000 4.212) 5.528 3.823 ( -6.855 0.000 11.893) 13.727 3.866 ( -2.433 0.000 8.079) 8.438 4.043 ( 1.211 0.000 2.677) 2.938 4.088 ( 1.397 0.000 -7.963) 8.084 4.232 ( 0.082 0.000 0.278) 0.289 4.478 ( 3.080 0.000 1.031) 3.248 4.689 ( 2.758 0.000 -3.047) 4.110 4.776 ( 1.267 0.000 -4.238) 4.423 4.842 ( 0.571 0.000 7.782) 7.803 5.203 ( 6.454 0.000 -3.933) 7.558 5.301 ( -2.947 0.000 6.553) 7.185 5.462 ( 6.891 0.000 -5.648) 8.910 5.608 ( 1.175 0.000 -10.116) 10.184 5.871 ( -3.351 0.000 11.083) 11.579 6.271 ( -2.584 0.000 -4.088) 4.836 6.557 ( 0.050 0.000 6.454) 6.455 6.705 ( 5.005 0.000 10.733) 11.842 6.872 ( 6.562 0.000 -6.339) 9.123 6.994 ( 1.479 0.000 -0.016) 1.479 7.471 ( 2.265 0.000 -7.552) 7.884 7.539 ( -5.158 0.000 -3.210) 6.076 7.549 ( 3.624 0.000 -6.411) 7.365 7.750 ( -4.452 0.000 -6.349) 7.755 8.007 ( 0.396 0.000 0.691) 0.796 8.102 ( 4.098 0.000 -4.540) 6.116 8.281 ( 4.890 0.000 -6.526) 8.155 8.442 ( -2.249 0.000 -3.332) 4.020 8.864 ( 0.847 0.000 -2.425) 2.569 9.438 ( -0.184 0.000 2.815) 2.821 9.704 ( -2.012 0.000 -0.100) 2.015 9.783 ( -1.894 0.000 7.747) 7.975 9.979 ( -4.498 0.000 2.981) 5.396 10.093 ( 0.245 0.000 2.986) 2.996 10.162 ( 2.208 0.000 2.471) 3.313 12.195 ( 5.082 0.000 -12.013) 13.044 12.826 ( 0.434 0.000 7.478) 7.490 14.484 ( 10.315 0.000 -15.404) 18.539 14.590 ( -2.473 0.000 6.476) 6.932 17.100 ( 18.741 0.000 9.900) 21.195 17.162 ( 0.106 0.000 -0.297) 0.316 18.386 ( 13.532 0.000 -2.039) 13.685 18.941 ( 6.944 0.000 -10.912) 12.934 22.074 ( 9.246 0.000 -3.869) 10.022 22.625 ( -11.392 0.000 1.172) 11.452 22.776 ( -13.486 0.000 1.126) 13.533 22.816 ( 0.263 0.000 2.681) 2.694 23.105 ( 3.754 0.000 -0.623) 3.806 23.323 ( 0.316 0.000 -1.528) 1.561 24.106 ( -8.245 0.000 0.176) 8.246 24.829 ( -21.873 0.000 6.667) 22.867 ======================= Grid point 183 (93/136) ======================= q-point: ( 0.00 0.17 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.102 ( -11.008 4.683 17.820) 21.463 1.434 ( -2.894 3.391 11.382) 12.223 1.807 ( 7.175 1.392 -10.203) 12.551 1.860 ( 0.954 -2.624 -7.557) 8.056 2.060 ( 2.279 -0.875 -1.662) 2.953 2.301 ( -4.089 -4.319 -4.817) 7.653 2.443 ( -1.061 6.060 -2.045) 6.484 2.583 ( 0.897 -5.175 -0.248) 5.258 2.642 ( 0.135 0.671 -1.302) 1.471 2.778 ( 3.884 -4.549 -8.217) 10.163 2.809 ( -1.423 0.944 -3.160) 3.591 2.855 ( -2.688 6.030 8.710) 10.929 3.204 ( -4.930 -0.126 15.719) 16.475 3.391 ( -1.000 4.409 1.399) 4.732 3.517 ( 1.486 3.603 2.890) 4.852 3.603 ( -1.424 0.303 -1.964) 2.445 3.789 ( -5.207 4.289 8.089) 10.533 3.908 ( -0.104 1.231 1.237) 1.748 4.058 ( 0.246 -1.199 2.773) 3.031 4.107 ( 0.148 1.203 2.674) 2.936 4.248 ( 1.477 0.104 -0.459) 1.551 4.510 ( -0.529 -0.153 1.095) 1.225 4.644 ( 0.588 -4.505 -1.124) 4.680 4.793 ( 3.762 0.327 -8.304) 9.122 4.910 ( 1.101 2.190 5.609) 6.121 5.167 ( -0.787 -6.813 0.201) 6.861 5.286 ( 3.093 -5.301 3.748) 7.191 5.459 ( -1.010 -3.967 -8.295) 9.250 5.736 ( 3.849 4.267 0.396) 5.760 5.752 ( 3.724 -7.231 -3.050) 8.687 5.991 ( -6.296 -11.743 2.622) 13.579 6.572 ( -1.677 2.186 4.732) 5.476 6.750 ( 4.146 -8.770 -0.144) 9.702 7.058 ( -0.788 2.263 0.001) 2.396 7.133 ( 2.378 2.134 3.929) 5.064 7.335 ( 2.032 0.733 -7.540) 7.843 7.459 ( -0.419 0.113 -3.008) 3.039 7.652 ( 0.022 3.660 -3.241) 4.889 7.697 ( 1.592 6.983 -11.553) 13.593 7.866 ( 0.739 -7.859 -3.267) 8.543 8.059 ( 1.573 -7.007 -4.479) 8.464 8.258 ( 1.369 3.987 -1.953) 4.646 8.613 ( 0.815 8.023 -0.825) 8.106 8.822 ( 2.335 -4.484 -2.364) 5.581 9.469 ( -1.284 1.485 2.620) 3.274 9.614 ( -2.140 -2.443 1.921) 3.774 9.843 ( -2.611 0.588 3.028) 4.041 9.964 ( -1.304 1.187 0.905) 1.982 10.224 ( -2.583 11.948 6.293) 13.749 10.347 ( -0.910 13.654 5.229) 14.649 12.243 ( 2.004 2.605 -4.521) 5.590 13.134 ( 2.222 21.997 2.977) 22.308 13.970 ( -9.244 -23.554 0.433) 25.307 15.036 ( -3.454 25.203 -2.907) 25.604 16.640 ( 1.974 -35.064 -0.659) 35.126 17.568 ( 8.615 -12.877 11.183) 19.107 18.472 ( -17.657 9.873 -6.457) 21.235 18.605 ( -10.985 7.159 -3.888) 13.676 22.144 ( -0.660 3.427 -6.148) 7.070 22.528 ( 1.966 -0.730 2.659) 3.386 22.604 ( -2.239 1.276 -0.433) 2.613 23.052 ( 6.849 1.129 -1.620) 7.127 23.278 ( 0.971 -3.951 -1.603) 4.373 23.339 ( 11.870 -2.940 3.797) 12.804 24.107 ( 2.822 1.613 1.553) 3.603 24.466 ( -3.441 -3.629 1.717) 5.288 ======================= Grid point 184 (94/136) ======================= q-point: ( 0.12 0.17 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.058 ( -4.696 1.676 13.053) 13.973 1.444 ( -4.881 -5.768 8.203) 11.153 1.719 ( -5.267 0.776 4.634) 7.058 1.896 ( 5.654 1.953 -18.759) 19.689 2.043 ( -0.601 2.695 -2.143) 3.496 2.281 ( -0.728 7.670 2.112) 7.989 2.423 ( 2.923 -2.999 -0.575) 4.227 2.597 ( 2.181 -3.459 -3.443) 5.346 2.651 ( 0.797 -0.470 1.324) 1.615 2.791 ( 3.122 -5.894 -7.273) 9.868 2.860 ( 4.663 2.498 3.741) 6.479 2.912 ( 4.438 0.543 1.523) 4.724 3.210 ( -7.179 0.162 17.534) 18.948 3.382 ( -0.887 4.355 2.681) 5.191 3.552 ( -3.877 4.799 4.240) 7.486 3.573 ( 2.711 2.905 -1.470) 4.237 3.743 ( -5.510 3.267 8.774) 10.864 3.922 ( 3.618 -0.281 -5.957) 6.975 4.088 ( 1.439 -3.215 -1.049) 3.675 4.147 ( -0.156 1.560 8.033) 8.184 4.262 ( 0.649 1.605 -1.130) 2.067 4.495 ( -1.771 -0.913 1.356) 2.410 4.652 ( 1.232 -3.373 -2.719) 4.504 4.789 ( 2.526 1.336 -8.881) 9.329 4.945 ( -0.977 1.596 3.636) 4.089 5.146 ( -1.461 -7.597 -1.167) 7.824 5.364 ( -0.682 -5.790 -2.333) 6.279 5.423 ( 6.918 -5.764 -2.223) 9.275 5.780 ( 1.948 7.692 -10.286) 12.991 5.786 ( -0.398 -10.455 5.956) 12.040 5.905 ( -3.917 -10.133 3.868) 11.532 6.528 ( -5.170 5.085 2.507) 7.672 6.778 ( -1.017 -10.045 -1.205) 10.168 7.026 ( -1.599 1.089 -0.507) 2.000 7.178 ( 0.286 -4.659 -0.554) 4.700 7.325 ( 1.378 7.094 -3.120) 7.871 7.503 ( 5.571 -1.470 -1.841) 6.049 7.588 ( 0.934 6.359 -10.419) 12.242 7.709 ( 3.568 4.297 -2.954) 6.318 7.859 ( 0.847 -6.845 -2.755) 7.427 8.065 ( 2.198 -7.192 -3.709) 8.385 8.231 ( -2.322 4.812 -2.617) 5.949 8.605 ( -0.613 8.450 -1.815) 8.665 8.861 ( 3.619 -4.277 -3.197) 6.451 9.450 ( -2.552 1.056 2.422) 3.673 9.605 ( -0.730 -1.052 3.695) 3.911 9.846 ( -0.049 -0.228 4.708) 4.713 9.941 ( -2.080 1.335 1.982) 3.168 10.201 ( -4.339 11.522 5.975) 13.685 10.345 ( -3.003 13.482 4.494) 14.525 12.248 ( 1.938 2.459 -4.596) 5.561 13.135 ( -3.641 24.341 -1.412) 24.652 13.721 ( -18.836 -21.391 11.316) 30.667 14.917 ( -7.582 23.432 3.393) 24.861 16.604 ( -4.704 -35.158 -2.472) 35.557 17.405 ( -23.019 -12.001 1.499) 26.003 18.324 ( -2.862 10.350 9.717) 14.482 18.453 ( -6.891 7.086 6.382) 11.766 22.092 ( -1.485 4.317 -3.949) 6.036 22.615 ( 5.979 -2.440 2.347) 6.871 22.685 ( 10.170 2.497 0.129) 10.473 23.079 ( -0.645 -1.597 -6.260) 6.492 23.265 ( -10.920 -1.904 -6.251) 12.726 23.298 ( 0.970 -2.078 -1.381) 2.677 24.169 ( 8.542 3.873 -0.232) 9.382 24.897 ( 33.074 -7.754 -1.348) 33.998 ======================= Grid point 185 (95/136) ======================= q-point: ( 0.25 0.17 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.105 ( 2.769 -1.509 3.112) 4.431 1.405 ( -2.831 -15.432 8.998) 18.086 1.711 ( -1.561 6.778 2.800) 7.498 1.779 ( -3.452 3.039 -14.126) 14.856 2.040 ( 1.765 0.986 -2.098) 2.913 2.302 ( 1.450 16.663 5.902) 17.737 2.514 ( 3.828 -6.415 2.182) 7.782 2.627 ( 2.655 -3.391 -0.623) 4.352 2.682 ( 1.028 -5.456 0.517) 5.576 2.811 ( 4.554 -7.919 -8.081) 12.197 2.970 ( 2.996 5.352 5.616) 8.316 3.021 ( 5.309 -2.055 -0.993) 5.779 3.187 ( -7.192 0.102 15.566) 17.147 3.397 ( -2.413 7.973 7.419) 11.155 3.483 ( -3.909 2.740 1.153) 4.911 3.642 ( 3.360 5.356 3.030) 7.011 3.716 ( -4.271 1.342 9.656) 10.643 3.968 ( 6.514 -0.069 -8.474) 10.688 4.079 ( -0.387 -3.393 -3.320) 4.763 4.210 ( 0.829 2.534 4.948) 5.621 4.270 ( 0.649 1.887 1.394) 2.434 4.467 ( -1.817 -0.981 0.723) 2.188 4.641 ( -0.149 -1.416 -3.193) 3.496 4.757 ( 0.127 2.551 -8.191) 8.580 4.926 ( -2.275 -1.675 0.052) 2.825 5.096 ( -0.008 -5.873 -6.043) 8.427 5.311 ( -2.079 -9.343 -0.915) 9.616 5.603 ( 9.006 -3.132 0.717) 9.562 5.701 ( -2.339 4.538 -5.024) 7.163 5.795 ( -0.016 -12.659 -3.101) 13.033 5.880 ( -3.597 -3.040 7.476) 8.836 6.431 ( -6.197 6.434 2.204) 9.201 6.707 ( -3.001 -8.820 -5.410) 10.773 7.010 ( 0.419 0.578 -0.874) 1.128 7.146 ( -1.091 -10.295 -4.084) 11.129 7.322 ( 0.816 11.844 -4.971) 12.871 7.542 ( 3.385 5.224 -7.473) 9.726 7.633 ( 5.707 -0.008 0.453) 5.725 7.777 ( 4.328 1.162 0.044) 4.481 7.859 ( 1.230 -4.900 -2.659) 5.709 8.085 ( 1.803 -6.299 -2.349) 6.960 8.146 ( -3.506 2.948 -3.142) 5.555 8.569 ( -1.297 7.634 -2.328) 8.085 8.905 ( 3.581 -4.510 -4.586) 7.362 9.416 ( -2.640 1.068 2.860) 4.036 9.639 ( 0.577 0.781 5.560) 5.644 9.879 ( -1.298 3.187 4.179) 5.413 9.935 ( 0.151 -1.988 4.065) 4.527 10.150 ( -4.965 10.631 5.270) 12.862 10.299 ( -4.990 13.527 4.406) 15.077 12.250 ( 1.828 2.503 -4.646) 5.585 12.989 ( -8.153 19.051 -0.366) 20.726 13.496 ( -15.768 -11.040 19.228) 27.207 14.823 ( -5.616 19.043 6.068) 20.761 16.433 ( -9.328 -30.438 -2.713) 31.950 17.084 ( -10.976 -11.845 2.559) 16.350 18.082 ( -16.971 5.989 0.656) 18.008 18.421 ( -14.308 5.166 9.481) 17.925 22.006 ( -3.542 5.385 -4.745) 8.004 22.828 ( 2.154 -6.862 -2.552) 7.631 22.906 ( 14.047 1.239 6.815) 15.662 22.990 ( 5.585 1.653 -0.104) 5.826 23.125 ( 2.650 -0.865 -6.314) 6.902 23.323 ( 1.684 -1.087 -1.320) 2.400 24.403 ( 13.679 6.040 -0.564) 14.964 25.421 ( 22.580 -9.150 -7.825) 25.589 ======================= Grid point 186 (96/136) ======================= q-point: ( 0.38 0.17 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.181 ( 4.339 -1.090 -5.316) 6.948 1.428 ( -7.149 -0.673 0.209) 7.184 1.577 ( 1.576 -6.563 0.257) 6.755 1.770 ( 1.249 3.440 5.484) 6.593 2.070 ( 2.326 -1.132 -1.321) 2.904 2.420 ( 4.611 12.822 6.924) 15.284 2.575 ( 2.452 -0.151 -2.002) 3.169 2.675 ( -0.271 -9.610 -1.629) 9.750 2.690 ( 0.580 -5.244 5.600) 7.694 2.835 ( 3.699 -9.330 -7.949) 12.803 3.034 ( 0.662 2.497 -0.122) 2.586 3.088 ( 1.471 1.274 3.778) 4.249 3.185 ( -2.481 1.053 8.704) 9.112 3.345 ( -7.619 11.403 7.686) 15.721 3.482 ( 0.201 1.283 6.759) 6.883 3.717 ( -0.638 1.012 4.140) 4.310 3.733 ( 0.403 3.987 9.475) 10.287 4.028 ( 4.181 -1.339 -8.103) 9.216 4.051 ( 1.472 1.006 -2.314) 2.920 4.202 ( -2.131 1.846 -2.649) 3.868 4.331 ( 1.769 3.067 4.003) 5.344 4.432 ( -2.318 -1.110 2.095) 3.316 4.608 ( -0.303 -0.406 -3.862) 3.895 4.669 ( -2.830 2.193 -6.213) 7.171 4.869 ( -1.733 -3.169 -3.846) 5.276 5.095 ( 3.971 -4.664 -5.027) 7.924 5.274 ( -1.007 -8.163 -1.128) 8.302 5.619 ( -2.087 4.437 -2.837) 5.665 5.628 ( -5.751 -7.188 -2.188) 9.461 5.837 ( -0.762 -3.838 3.844) 5.485 5.903 ( 5.605 -4.953 3.092) 8.094 6.340 ( -4.084 4.328 1.717) 6.193 6.606 ( -1.937 -7.006 -8.270) 11.011 7.017 ( 0.819 5.469 -1.587) 5.753 7.096 ( -0.774 -14.064 -3.662) 14.554 7.294 ( 2.151 12.165 -8.894) 15.222 7.581 ( 4.590 4.608 -3.473) 7.373 7.740 ( 4.477 -1.231 1.024) 4.755 7.828 ( -0.171 -3.156 -0.547) 3.208 7.894 ( 4.619 -0.172 -1.661) 4.912 8.047 ( -2.758 0.441 -1.775) 3.310 8.120 ( 2.072 -5.328 -2.949) 6.432 8.532 ( -0.923 6.149 -1.511) 6.398 8.925 ( 2.116 -4.992 -5.459) 7.694 9.395 ( -1.824 1.634 3.233) 4.056 9.699 ( 0.924 1.303 5.916) 6.128 9.868 ( -1.651 2.600 2.766) 4.140 9.987 ( 0.889 -1.086 5.179) 5.366 10.095 ( -4.228 10.012 4.891) 11.918 10.230 ( -5.303 14.196 4.988) 15.953 12.251 ( 1.889 2.912 -5.035) 6.116 12.919 ( -0.014 15.250 5.868) 16.340 13.363 ( -12.527 -5.985 18.069) 22.787 14.784 ( -3.324 16.412 6.593) 17.996 16.287 ( -3.240 -26.295 -0.240) 26.495 16.954 ( -6.057 -17.335 2.553) 18.539 17.786 ( -12.548 5.670 -0.768) 13.791 18.026 ( -24.264 7.535 -3.636) 25.666 21.919 ( -1.026 5.388 -5.442) 7.727 22.746 ( -2.828 -6.392 -1.490) 7.146 23.054 ( 1.117 0.921 -3.864) 4.127 23.189 ( 10.099 1.326 -0.741) 10.213 23.337 ( 1.744 -0.061 -0.225) 1.760 23.466 ( 20.467 -1.267 15.623) 25.780 24.634 ( 9.781 5.437 0.074) 11.191 25.635 ( 7.408 -8.981 -12.774) 17.283 ======================= Grid point 187 (97/136) ======================= q-point: (-0.50 0.17 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.099 ( -5.763 8.913 -4.997) 11.731 1.326 ( 1.547 -0.171 -6.028) 6.225 1.640 ( -3.768 4.250 9.016) 10.656 1.932 ( 9.330 -11.574 8.689) 17.219 2.101 ( 1.970 -2.497 -2.061) 3.790 2.477 ( -1.624 -9.971 -6.713) 12.129 2.604 ( 2.645 4.478 -0.916) 5.281 2.662 ( -0.618 2.326 5.319) 5.838 2.741 ( -0.445 -3.720 5.851) 6.948 2.839 ( 2.741 -9.550 -7.224) 12.284 3.022 ( -0.747 3.489 -1.069) 3.725 3.128 ( 0.208 0.106 1.492) 1.510 3.190 ( -3.527 5.389 7.349) 9.772 3.263 ( -4.720 9.232 4.608) 11.347 3.542 ( -0.859 0.841 8.248) 8.335 3.742 ( -0.431 2.638 5.446) 6.067 3.791 ( -1.390 2.138 9.083) 9.434 4.021 ( 0.466 1.232 -1.564) 2.044 4.074 ( -1.331 -2.256 -1.535) 3.036 4.133 ( 1.042 5.587 -5.984) 8.253 4.290 ( -3.595 3.495 -3.162) 5.928 4.492 ( 1.991 -0.955 7.256) 7.584 4.553 ( -0.199 -1.591 -9.030) 9.171 4.609 ( -1.203 1.399 2.050) 2.758 4.825 ( 1.117 -1.162 -5.745) 5.967 5.133 ( 0.583 -5.605 -0.605) 5.667 5.265 ( 2.043 -3.287 -3.417) 5.162 5.470 ( -1.971 -0.913 -12.448) 12.636 5.607 ( -2.786 -5.408 9.156) 10.993 5.801 ( -5.832 -2.004 7.939) 10.052 6.030 ( 3.729 -3.304 1.119) 5.106 6.316 ( 2.063 -0.964 -2.629) 3.478 6.524 ( -0.341 -4.170 -7.414) 8.514 7.007 ( -0.637 6.482 -1.307) 6.644 7.070 ( 0.634 -8.825 -3.481) 9.508 7.288 ( 4.362 7.897 -9.913) 13.403 7.649 ( 4.078 4.265 -3.338) 6.780 7.800 ( -0.954 -1.102 -0.317) 1.491 7.811 ( 2.014 -3.784 -0.579) 4.325 7.962 ( 3.288 0.453 -2.750) 4.310 8.008 ( 0.043 -1.196 -1.014) 1.569 8.132 ( 1.359 -4.747 -3.113) 5.837 8.517 ( 0.060 3.867 -0.114) 3.869 8.905 ( 0.063 -5.179 -5.340) 7.440 9.393 ( -0.872 2.221 3.349) 4.112 9.748 ( -0.403 0.462 4.892) 4.930 9.868 ( 0.371 1.602 1.109) 1.983 10.034 ( -0.044 0.285 5.112) 5.120 10.068 ( -2.426 10.415 5.356) 11.960 10.182 ( -3.368 15.007 5.549) 16.351 12.249 ( 1.870 3.454 -5.549) 6.799 13.027 ( 3.310 20.836 2.268) 21.218 13.328 ( -1.347 -13.508 20.036) 24.202 14.791 ( -0.832 16.695 6.356) 17.883 16.316 ( 4.459 -29.136 1.370) 29.507 16.862 ( -4.316 -16.371 3.036) 17.201 17.547 ( -10.036 12.409 -5.141) 16.767 17.703 ( -2.514 4.521 -0.117) 5.174 21.890 ( 1.961 4.811 -5.422) 7.509 22.704 ( -1.730 -5.973 1.011) 6.300 23.044 ( 1.289 -0.115 -4.922) 5.089 23.279 ( 0.360 0.046 -1.892) 1.927 23.366 ( 0.899 4.684 0.337) 4.782 23.900 ( 9.678 -2.307 13.711) 16.940 24.775 ( 3.202 2.382 3.501) 5.309 25.531 ( -6.592 -8.314 -15.713) 18.960 ======================= Grid point 188 (98/136) ======================= q-point: (-0.38 0.17 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.070 ( 6.234 8.620 -1.435) 10.735 1.307 ( -0.938 1.618 -2.034) 2.764 1.592 ( -7.279 7.927 9.727) 14.506 2.084 ( -0.493 -10.799 -1.437) 10.905 2.124 ( 2.247 -5.597 -3.560) 7.003 2.384 ( 0.985 -15.281 -5.081) 16.134 2.617 ( -0.158 6.089 -1.759) 6.340 2.700 ( -0.242 -0.517 3.377) 3.425 2.746 ( -3.794 0.566 5.618) 6.803 2.835 ( 2.254 -8.677 -7.570) 11.734 3.000 ( -0.300 5.596 -1.180) 5.727 3.101 ( -4.340 4.217 2.410) 6.513 3.176 ( -5.614 4.865 14.103) 15.939 3.246 ( 1.817 5.966 -2.150) 6.597 3.544 ( -3.263 -1.990 4.072) 5.585 3.758 ( -2.127 4.304 3.865) 6.163 3.822 ( -2.908 1.543 10.765) 11.257 3.970 ( -3.929 2.696 -1.520) 5.001 4.045 ( -1.755 -0.084 4.420) 4.757 4.165 ( 3.657 1.477 -5.458) 6.734 4.234 ( 0.989 4.527 -0.508) 4.661 4.423 ( -3.474 0.292 -5.465) 6.482 4.622 ( 3.058 -0.251 -2.139) 3.740 4.636 ( 2.622 -0.399 7.944) 8.375 4.811 ( 0.848 -0.695 -5.602) 5.709 5.096 ( -1.906 -3.658 -2.044) 4.604 5.273 ( -0.623 -4.108 0.514) 4.187 5.429 ( 6.395 1.018 -10.811) 12.602 5.636 ( -0.691 -4.856 6.388) 8.054 5.747 ( -5.507 -4.494 7.688) 10.470 6.071 ( -0.721 -4.695 4.589) 6.605 6.366 ( 6.162 -5.447 -6.689) 10.601 6.490 ( 1.170 -0.992 -3.627) 3.938 6.990 ( -0.464 3.045 0.477) 3.117 7.061 ( 1.068 0.603 -3.669) 3.868 7.311 ( 5.242 3.520 -10.018) 11.842 7.660 ( 0.930 4.418 -5.526) 7.136 7.774 ( -2.506 0.761 -0.892) 2.766 7.839 ( 2.503 -5.359 -1.626) 6.134 7.964 ( -0.579 0.647 -3.822) 3.920 8.029 ( 2.331 -1.332 -0.868) 2.822 8.133 ( 1.693 -4.473 -3.931) 6.191 8.530 ( 1.057 2.067 0.263) 2.336 8.860 ( -0.768 -5.111 -4.297) 6.721 9.411 ( 0.181 2.453 3.276) 4.097 9.748 ( -2.690 -0.386 3.687) 4.580 9.896 ( 1.555 2.479 -0.038) 2.927 10.044 ( -1.786 -0.592 2.655) 3.254 10.091 ( 0.084 11.679 6.598) 13.414 10.188 ( -0.522 15.001 6.506) 16.360 12.243 ( 1.752 3.570 -5.426) 6.727 13.007 ( -3.161 17.303 0.473) 17.596 13.624 ( 14.931 -14.447 11.241) 23.623 14.849 ( 3.001 19.814 4.069) 20.449 16.366 ( 1.042 -31.862 -3.273) 32.046 16.942 ( 7.328 -13.309 6.002) 16.336 17.565 ( 14.965 14.462 9.565) 22.904 17.817 ( 12.349 3.171 1.696) 12.862 21.913 ( 4.503 4.520 -5.185) 8.221 22.686 ( -1.470 -5.504 2.088) 6.067 23.028 ( 0.133 -0.633 -4.271) 4.320 23.193 ( -8.318 3.069 -0.997) 8.922 23.355 ( -0.995 2.507 -1.244) 2.970 23.963 ( -9.095 -3.377 -1.421) 9.805 24.739 ( -10.993 0.039 -1.873) 11.152 25.244 ( -11.502 -6.309 -2.926) 13.441 ======================= Grid point 189 (99/136) ======================= q-point: (-0.25 0.17 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.247 ( 0.502 6.534 4.447) 7.920 1.286 ( 8.128 1.966 -1.652) 8.524 1.533 ( -5.209 8.337 9.519) 13.684 1.996 ( -1.089 -10.734 -11.121) 15.494 2.083 ( -1.229 -4.242 -4.951) 6.635 2.421 ( 1.171 -9.907 1.806) 10.138 2.575 ( -1.812 5.884 -3.893) 7.284 2.676 ( -4.327 3.629 0.305) 5.656 2.702 ( -2.333 -6.117 1.704) 6.765 2.814 ( 1.866 -8.001 -8.850) 12.076 2.985 ( -2.193 4.281 0.142) 4.812 3.009 ( -8.257 8.878 7.324) 14.165 3.172 ( -4.532 0.404 11.753) 12.603 3.296 ( 4.084 8.826 -0.252) 9.729 3.502 ( -3.024 -2.945 2.520) 4.916 3.714 ( -3.423 3.550 0.137) 4.933 3.829 ( -4.128 0.778 9.515) 10.401 3.915 ( -2.845 2.308 4.929) 6.142 4.038 ( -2.141 1.112 4.682) 5.267 4.143 ( 1.172 1.671 -8.260) 8.508 4.266 ( -2.976 2.009 2.582) 4.423 4.402 ( 4.799 2.080 0.013) 5.230 4.668 ( 3.350 1.026 -3.276) 4.796 4.733 ( 0.616 -2.938 7.289) 7.883 4.763 ( 0.512 -1.630 -6.133) 6.367 5.094 ( 3.567 -2.219 -2.440) 4.858 5.257 ( -2.817 -6.130 4.050) 7.868 5.505 ( 7.615 6.625 -7.826) 12.772 5.639 ( -1.361 -1.876 -1.996) 3.059 5.713 ( -2.800 -10.743 6.625) 12.928 6.090 ( -1.991 -9.331 7.276) 11.999 6.442 ( 5.614 -6.356 -4.424) 9.565 6.527 ( 4.431 0.832 -0.118) 4.510 7.003 ( 0.881 1.449 2.217) 2.792 7.057 ( 1.099 4.408 -2.916) 5.398 7.335 ( 4.607 1.239 -9.768) 10.871 7.638 ( 1.493 4.820 -6.756) 8.432 7.686 ( -4.842 2.005 -1.660) 5.498 7.867 ( 1.181 -5.995 -2.785) 6.715 7.895 ( -2.392 0.835 -4.851) 5.473 8.067 ( 2.004 -2.285 -2.059) 3.671 8.152 ( 3.576 -2.880 -3.705) 5.900 8.558 ( 1.752 2.689 -0.152) 3.213 8.822 ( -0.189 -4.936 -3.079) 5.820 9.442 ( 0.437 2.174 2.852) 3.613 9.707 ( -3.703 -0.916 2.673) 4.658 9.910 ( -0.339 4.410 0.432) 4.444 10.016 ( -2.264 -1.229 0.954) 2.747 10.151 ( 1.046 11.133 6.081) 12.729 10.245 ( 0.792 14.419 6.956) 16.028 12.238 ( 1.723 3.266 -4.922) 6.153 12.982 ( 0.608 16.840 1.185) 16.893 13.932 ( 10.981 -18.311 0.550) 21.358 14.958 ( 6.824 22.998 -1.882) 24.063 16.406 ( 5.885 -29.528 -1.231) 30.134 17.087 ( 5.704 -9.595 2.023) 11.344 18.095 ( 20.625 3.197 0.518) 20.878 18.328 ( 38.769 5.426 17.195) 42.756 21.989 ( 7.018 5.036 -4.259) 9.631 22.681 ( -0.714 -4.971 2.838) 5.769 22.905 ( -13.209 1.866 0.454) 13.347 23.045 ( -2.100 0.822 -2.527) 3.387 23.327 ( -0.787 -0.348 -1.686) 1.893 23.493 ( -30.172 -4.042 -16.568) 34.658 24.404 ( -16.307 3.521 -2.062) 16.810 25.059 ( -14.038 -5.397 9.841) 17.974 ======================= Grid point 190 (100/136) ======================= q-point: (-0.12 0.17 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.191 ( -9.890 5.570 14.962) 18.780 1.417 ( -2.260 4.172 8.981) 10.158 1.621 ( 14.615 4.990 -9.632) 18.201 1.933 ( -0.494 -7.749 -4.712) 9.083 2.032 ( 1.562 -2.282 -6.914) 7.446 2.439 ( -0.457 -6.014 1.384) 6.188 2.477 ( -5.790 3.969 -4.884) 8.552 2.590 ( -1.408 -2.414 -3.134) 4.199 2.667 ( -1.861 -1.149 0.013) 2.187 2.787 ( 2.394 -7.255 -9.057) 11.849 2.893 ( -7.795 6.861 8.744) 13.576 2.912 ( -5.673 6.689 -1.355) 8.875 3.180 ( -3.911 -0.701 13.065) 13.656 3.373 ( 2.319 9.148 1.552) 9.564 3.481 ( -0.190 -1.644 1.545) 2.264 3.650 ( -2.336 1.204 -1.483) 3.018 3.815 ( -4.034 2.197 8.733) 9.868 3.908 ( -2.921 2.449 6.965) 7.940 4.039 ( -0.747 0.324 3.574) 3.665 4.111 ( 0.093 2.320 -3.609) 4.291 4.231 ( -0.533 -0.010 0.482) 0.719 4.488 ( 2.388 0.858 0.964) 2.714 4.658 ( -1.414 -3.229 -0.572) 3.572 4.764 ( 4.462 -1.022 -6.149) 7.666 4.827 ( 2.977 0.515 4.984) 5.828 5.161 ( 3.940 -3.237 -3.081) 5.957 5.233 ( -2.947 -6.818 7.409) 10.491 5.537 ( -0.888 1.439 -6.347) 6.568 5.637 ( 8.007 5.421 -8.771) 13.055 5.723 ( -1.495 -12.715 6.337) 14.285 6.075 ( -4.467 -11.700 4.415) 13.279 6.523 ( 2.706 -1.760 4.054) 5.182 6.641 ( 6.890 -3.531 -1.012) 7.808 7.049 ( 1.271 -2.150 2.441) 3.492 7.066 ( 1.769 7.692 -0.355) 7.901 7.343 ( 3.409 0.250 -8.994) 9.621 7.549 ( -5.020 1.041 -3.692) 6.318 7.650 ( 2.129 6.331 -4.764) 8.204 7.788 ( -2.669 2.874 -7.032) 8.052 7.875 ( 1.163 -7.474 -3.929) 8.524 8.068 ( 1.024 -5.602 -4.401) 7.197 8.214 ( 4.132 1.227 -1.779) 4.663 8.591 ( 1.779 5.499 -0.447) 5.796 8.809 ( 0.876 -4.690 -2.362) 5.324 9.464 ( -0.243 1.762 2.587) 3.139 9.654 ( -3.307 -1.891 1.924) 4.267 9.886 ( -2.894 3.342 1.634) 4.713 9.983 ( -1.326 -0.484 0.194) 1.425 10.206 ( -0.320 11.540 6.131) 13.071 10.308 ( 0.480 13.933 6.250) 15.278 12.238 ( 1.882 2.881 -4.562) 5.715 13.045 ( 3.659 18.873 3.094) 19.472 14.047 ( 1.832 -21.421 -2.261) 21.618 15.053 ( 5.036 24.182 -6.002) 25.419 16.546 ( 7.202 -32.797 0.536) 33.582 17.264 ( 10.968 -5.506 5.864) 13.601 18.428 ( 13.410 4.176 -1.631) 14.140 18.945 ( 7.953 -1.019 -8.354) 11.579 22.121 ( 8.273 4.540 -3.668) 10.125 22.617 ( -10.070 -0.830 0.560) 10.120 22.770 ( -16.368 -0.772 -1.299) 16.437 22.817 ( 4.659 -0.125 5.091) 6.902 23.103 ( 2.864 0.095 -0.530) 2.914 23.301 ( -0.665 -1.848 -1.636) 2.556 24.149 ( -9.197 3.970 0.698) 10.041 24.776 ( -21.007 -4.805 6.116) 22.400 ======================= Grid point 191 (101/136) ======================= q-point: ( 0.00 0.33 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.233 ( -11.930 7.110 13.529) 19.389 1.480 ( -6.709 -1.020 2.328) 7.175 1.804 ( -2.858 2.765 7.747) 8.708 1.906 ( 12.849 3.965 -15.218) 20.308 2.087 ( 5.332 1.622 -1.251) 5.712 2.184 ( -2.113 -5.787 1.317) 6.300 2.371 ( 3.583 -9.046 -7.927) 12.550 2.507 ( 0.876 -7.305 -5.429) 9.143 2.646 ( 0.169 5.086 -5.872) 7.771 2.763 ( 0.381 3.401 -1.793) 3.864 2.839 ( -3.887 0.982 -3.008) 5.012 2.966 ( -0.858 0.766 -1.026) 1.541 3.257 ( -5.935 6.714 18.008) 20.114 3.413 ( 0.356 1.713 0.163) 1.757 3.578 ( -1.882 -1.677 -1.928) 3.174 3.605 ( 3.394 -0.350 0.587) 3.463 3.918 ( -2.490 4.646 3.030) 6.080 3.992 ( -1.999 1.817 -0.147) 2.706 4.066 ( 0.140 7.098 3.094) 7.745 4.174 ( -2.823 5.029 5.877) 8.234 4.241 ( 1.037 -0.546 1.739) 2.097 4.496 ( -0.899 -1.155 -0.080) 1.466 4.555 ( 1.126 -3.457 -1.121) 3.804 4.714 ( 3.602 -10.964 -7.006) 13.500 4.994 ( 3.073 2.868 4.366) 6.060 5.047 ( -3.483 1.607 4.916) 6.236 5.152 ( 4.696 -4.681 3.349) 7.428 5.402 ( -3.970 -0.376 -8.065) 8.998 5.481 ( 1.619 -11.247 1.592) 11.474 5.738 ( -6.471 -12.491 3.417) 14.477 5.931 ( 6.301 9.286 -5.440) 12.471 6.478 ( 1.648 -14.363 3.439) 14.861 6.656 ( 1.097 3.211 -2.368) 4.138 6.880 ( 4.680 -9.114 -6.225) 11.988 7.227 ( -0.043 6.631 -1.927) 6.906 7.439 ( -0.868 -1.931 -2.792) 3.504 7.571 ( -0.343 11.391 -0.311) 11.401 7.732 ( -0.922 1.746 -2.679) 3.328 7.746 ( 1.299 -1.705 -4.541) 5.021 7.793 ( 0.881 1.559 -6.618) 6.856 8.027 ( 3.192 3.363 -6.244) 7.778 8.282 ( 2.212 -2.479 -0.538) 3.366 8.688 ( 1.249 -0.240 0.802) 1.503 8.733 ( 2.076 -2.379 -0.547) 3.204 9.499 ( -1.068 1.540 1.461) 2.377 9.577 ( -1.357 -1.418 1.113) 2.257 9.850 ( -3.039 0.398 1.929) 3.621 9.929 ( -0.604 -3.046 -1.171) 3.319 10.544 ( -3.947 15.105 9.960) 18.519 10.676 ( -2.078 12.934 7.061) 14.882 12.345 ( -1.730 9.111 4.521) 10.317 13.271 ( -3.953 -24.169 12.712) 27.593 13.925 ( -0.050 32.443 -10.142) 33.991 15.390 ( -0.409 -8.684 -0.939) 8.744 16.071 ( 1.124 -0.772 -7.854) 7.972 17.131 ( 0.783 -25.769 3.352) 25.998 18.647 ( -2.991 6.172 -0.055) 6.859 18.733 ( -11.631 3.424 -3.824) 12.713 22.230 ( -2.004 4.380 -5.435) 7.262 22.451 ( -0.086 -5.404 -0.994) 5.495 22.715 ( 3.088 8.345 0.721) 8.927 23.093 ( 10.207 0.483 2.304) 10.475 23.155 ( -1.089 -5.544 -1.150) 5.765 23.269 ( 5.814 -3.398 2.761) 7.278 24.162 ( 0.415 3.543 1.507) 3.873 24.367 ( -3.788 -5.237 1.695) 6.682 ======================= Grid point 192 (102/136) ======================= q-point: ( 0.12 0.33 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.111 ( -9.288 3.154 11.461) 15.086 1.296 ( -13.084 -6.008 4.659) 15.132 1.840 ( -0.012 7.065 8.110) 10.755 1.954 ( 3.520 3.565 -13.938) 14.811 2.119 ( -0.224 4.754 -1.393) 4.959 2.225 ( 4.999 -6.509 -0.739) 8.240 2.414 ( 5.044 -8.593 -5.308) 11.290 2.491 ( 2.238 -6.339 -7.174) 9.831 2.625 ( 1.195 4.431 -2.700) 5.324 2.762 ( 0.094 4.951 -1.903) 5.305 2.843 ( 5.197 -2.579 1.056) 5.897 2.967 ( 1.176 -0.409 0.462) 1.328 3.264 ( -5.871 5.967 14.916) 17.105 3.439 ( 1.671 3.364 1.085) 3.910 3.546 ( -0.517 -1.637 -0.883) 1.931 3.680 ( 2.295 0.162 4.633) 5.172 3.874 ( -4.273 4.643 3.722) 7.326 3.949 ( -0.957 0.972 -1.688) 2.170 4.072 ( -0.150 6.009 -0.919) 6.080 4.213 ( 0.775 4.293 8.153) 9.246 4.268 ( 0.577 -0.531 0.837) 1.147 4.479 ( -0.066 0.024 -2.043) 2.044 4.570 ( 1.406 -4.220 -2.299) 5.007 4.738 ( 3.631 -10.793 -5.197) 12.517 4.993 ( -3.486 -0.662 3.234) 4.801 5.051 ( -2.233 7.629 4.152) 8.969 5.251 ( -2.566 -4.789 -3.965) 6.727 5.324 ( 8.047 -1.197 -1.424) 8.259 5.522 ( 0.798 -11.832 -0.323) 11.863 5.651 ( -5.220 -11.302 7.346) 14.455 5.988 ( 4.545 8.304 -8.541) 12.750 6.510 ( 0.149 -15.170 0.426) 15.177 6.620 ( -3.265 4.008 -0.758) 5.225 6.846 ( -1.652 -8.940 -9.332) 13.028 7.226 ( 0.758 6.485 -1.389) 6.675 7.458 ( 3.455 -3.250 -0.532) 4.773 7.577 ( 0.261 10.787 2.098) 10.992 7.706 ( 2.205 4.048 -6.565) 8.022 7.744 ( 1.268 -1.722 -4.037) 4.568 7.781 ( 2.001 -0.029 -2.768) 3.415 8.038 ( 2.377 3.699 -5.739) 7.230 8.270 ( -2.448 -1.531 -2.304) 3.694 8.696 ( -0.392 0.900 -1.013) 1.411 8.765 ( 2.328 -3.613 -2.299) 4.874 9.482 ( -1.636 2.260 1.398) 3.121 9.588 ( 1.007 -1.103 2.578) 2.980 9.839 ( -0.381 -0.191 4.452) 4.473 9.906 ( -1.270 -3.113 -0.154) 3.366 10.517 ( -6.235 15.162 9.763) 19.081 10.664 ( -4.443 12.243 6.826) 14.704 12.341 ( -2.255 8.184 4.705) 9.706 13.200 ( -12.873 -26.151 12.378) 31.667 13.838 ( -1.524 38.725 -7.427) 39.460 15.325 ( -5.693 -1.108 0.676) 5.839 15.966 ( -6.004 -8.862 -5.735) 12.144 16.974 ( -16.390 -25.750 2.190) 30.602 18.517 ( -11.853 6.646 2.466) 13.811 18.583 ( -5.203 4.086 7.983) 10.368 22.213 ( 1.434 6.690 -2.653) 7.339 22.520 ( 7.513 -6.226 0.000) 9.757 22.773 ( 4.878 5.542 -1.655) 7.566 23.024 ( -7.093 -3.944 -5.520) 9.815 23.221 ( -0.605 -1.310 -2.858) 3.202 23.257 ( -1.405 -1.752 -1.277) 2.584 24.288 ( 13.030 7.179 1.028) 14.913 24.692 ( 26.886 -10.560 1.475) 28.923 ======================= Grid point 193 (103/136) ======================= q-point: ( 0.25 0.33 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.070 ( -1.166 -1.501 5.695) 6.003 1.142 ( -5.515 -7.856 8.818) 13.034 1.866 ( -1.967 6.155 -14.631) 15.994 1.894 ( -0.720 6.238 7.162) 9.525 2.082 ( -1.152 4.018 -2.860) 5.065 2.327 ( 4.977 -8.271 1.524) 9.773 2.428 ( 0.601 -11.834 -8.682) 14.689 2.504 ( 3.419 -6.448 -2.530) 7.725 2.682 ( 4.693 8.912 1.466) 10.178 2.759 ( 0.607 5.668 -0.315) 5.709 2.968 ( 4.906 -3.793 2.661) 6.748 3.010 ( 2.491 -1.534 0.655) 2.998 3.256 ( -4.605 6.283 11.215) 13.655 3.481 ( 1.615 1.817 -0.059) 2.431 3.544 ( -0.424 1.986 3.858) 4.360 3.749 ( -1.720 1.467 9.889) 10.144 3.822 ( -3.196 5.553 4.772) 7.989 3.944 ( 2.191 -2.759 -3.959) 5.300 4.068 ( 1.182 5.458 -2.408) 6.082 4.265 ( 0.098 0.814 -0.683) 1.067 4.300 ( 1.288 2.059 6.829) 7.248 4.468 ( 1.239 1.814 -3.815) 4.403 4.574 ( 1.111 -4.682 -3.154) 5.754 4.775 ( 2.703 -7.781 -2.289) 8.549 4.936 ( -4.043 -0.931 -0.067) 4.150 4.991 ( -6.003 6.520 3.553) 9.548 5.153 ( -1.590 -3.848 -5.981) 7.288 5.464 ( -6.267 -11.275 4.209) 13.569 5.545 ( 12.672 -4.046 -1.014) 13.341 5.671 ( 0.918 -6.923 4.780) 8.462 5.977 ( 1.934 8.358 -11.144) 14.064 6.480 ( -2.873 -7.687 -2.643) 8.622 6.549 ( -3.734 -1.892 2.334) 4.793 6.729 ( -1.280 -11.915 -11.901) 16.889 7.223 ( -0.131 8.514 -0.906) 8.563 7.531 ( 2.997 -2.930 1.199) 4.359 7.602 ( 1.607 8.147 -0.339) 8.311 7.700 ( 1.907 4.217 -6.694) 8.139 7.766 ( 3.444 0.093 -1.580) 3.791 7.825 ( 3.833 -0.261 -1.636) 4.175 8.037 ( 1.380 1.442 -4.084) 4.546 8.168 ( -5.434 -1.046 -2.952) 6.272 8.663 ( -1.241 1.981 -2.719) 3.586 8.788 ( 2.592 -5.502 -4.660) 7.661 9.464 ( -1.545 3.566 2.278) 4.504 9.641 ( 1.772 -1.515 3.410) 4.131 9.879 ( -1.445 -2.172 1.681) 3.103 9.891 ( 1.087 -1.019 5.259) 5.466 10.457 ( -6.924 15.111 9.585) 19.188 10.611 ( -5.928 11.741 6.928) 14.866 12.330 ( -2.449 6.665 5.022) 8.697 13.010 ( -14.173 -18.369 12.834) 26.514 13.765 ( -2.013 36.142 -3.660) 36.383 15.213 ( -6.384 3.751 2.779) 7.909 15.794 ( -6.990 -15.604 -3.920) 17.541 16.682 ( -14.061 -23.882 3.850) 27.980 18.246 ( -16.516 8.033 0.791) 18.383 18.473 ( -14.641 -0.770 5.428) 15.634 22.169 ( -3.007 9.520 -4.440) 10.926 22.639 ( -0.937 -10.478 -3.877) 11.212 22.933 ( 12.941 1.216 3.587) 13.484 22.995 ( 13.200 -1.239 0.393) 13.264 23.142 ( -1.589 2.885 -2.517) 4.146 23.287 ( 1.999 -2.371 -0.720) 3.183 24.589 ( 15.218 11.001 -0.703) 18.791 25.165 ( 20.434 -13.831 -4.173) 25.025 ======================= Grid point 194 (104/136) ======================= q-point: ( 0.38 0.33 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.143 ( 5.602 -1.910 0.937) 5.992 1.244 ( 6.800 -9.074 12.651) 16.989 1.662 ( -7.213 10.140 -14.350) 18.994 1.910 ( -2.534 4.140 5.582) 7.397 2.064 ( 1.052 2.289 -1.591) 2.979 2.327 ( -3.278 -13.348 -9.116) 16.493 2.430 ( 3.451 -9.085 1.393) 9.818 2.556 ( 3.691 -9.692 -3.175) 10.846 2.777 ( 1.015 6.770 0.657) 6.877 2.799 ( 4.370 11.525 4.763) 13.214 3.033 ( 0.687 -2.924 0.896) 3.134 3.075 ( 2.677 -1.587 2.524) 4.007 3.258 ( -1.886 5.391 6.421) 8.594 3.476 ( -0.476 0.539 -3.899) 3.965 3.602 ( -0.637 7.464 12.753) 14.790 3.736 ( -4.033 2.103 7.618) 8.872 3.849 ( -0.887 3.585 8.598) 9.357 3.955 ( 1.328 -4.966 -2.678) 5.796 4.074 ( 1.708 3.539 -4.920) 6.297 4.256 ( 0.348 1.891 -1.315) 2.330 4.378 ( 2.061 -0.595 4.579) 5.057 4.467 ( 1.469 4.953 -3.784) 6.404 4.564 ( 0.274 -3.269 -4.290) 5.400 4.772 ( -2.660 4.324 -0.524) 5.104 4.860 ( -2.823 -4.637 0.179) 5.431 4.912 ( -3.474 -1.464 1.972) 4.254 5.120 ( 2.388 -4.494 -4.558) 6.832 5.359 ( -8.116 -11.750 6.023) 15.499 5.688 ( 0.465 -0.830 -0.881) 1.297 5.789 ( 10.508 -5.298 -1.603) 11.877 5.919 ( 1.221 8.875 -10.600) 13.878 6.382 ( -4.972 -0.577 -0.668) 5.050 6.503 ( -2.600 -4.253 0.517) 5.012 6.649 ( 2.375 -17.961 -12.136) 21.806 7.218 ( 0.362 10.255 -0.634) 10.281 7.565 ( 0.170 3.892 0.671) 3.953 7.647 ( 3.918 0.497 -2.804) 4.844 7.702 ( 2.624 3.714 -4.230) 6.211 7.814 ( 1.971 1.714 -1.215) 2.881 7.898 ( 4.578 -0.386 -1.544) 4.847 8.033 ( -1.438 -0.813 -0.820) 1.844 8.053 ( -1.529 -1.870 -3.836) 4.534 8.616 ( -1.210 2.455 -3.334) 4.314 8.792 ( 1.639 -6.576 -5.718) 8.868 9.457 ( -1.154 4.260 2.958) 5.313 9.692 ( 0.827 -3.265 2.789) 4.373 9.865 ( -0.898 0.296 2.132) 2.332 9.956 ( 0.954 -2.011 5.428) 5.867 10.405 ( -5.422 15.335 9.946) 19.066 10.551 ( -5.302 12.051 7.188) 15.000 12.324 ( -1.931 5.551 5.093) 7.777 12.904 ( -7.041 -15.474 15.904) 23.280 13.705 ( -1.317 35.471 -3.484) 35.666 15.140 ( -3.454 4.542 3.954) 6.943 15.677 ( -2.085 -17.790 -2.437) 18.077 16.502 ( -7.924 -23.909 4.660) 25.615 17.935 ( -13.816 7.147 -1.606) 15.637 18.115 ( -20.219 0.598 -3.296) 20.494 22.079 ( -1.583 9.216 -5.784) 10.995 22.549 ( -1.849 -11.098 -5.144) 12.372 23.110 ( -0.248 3.638 -2.047) 4.182 23.208 ( 8.238 0.190 0.404) 8.250 23.336 ( 7.307 0.318 3.710) 8.201 23.424 ( 18.490 -2.572 12.872) 22.676 24.808 ( 7.995 10.605 -2.150) 13.453 25.381 ( 6.717 -13.834 -8.993) 17.815 ======================= Grid point 195 (105/136) ======================= q-point: (-0.50 0.33 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.267 ( 6.209 3.214 -0.166) 6.994 1.418 ( -5.417 11.483 -7.116) 14.555 1.520 ( 8.615 -9.916 7.017) 14.892 1.882 ( -3.418 -0.354 4.247) 5.464 2.083 ( 0.808 1.465 -1.110) 2.008 2.179 ( -3.609 -12.465 -9.582) 16.131 2.481 ( 1.073 -9.596 1.022) 9.710 2.602 ( 3.757 -10.050 -4.026) 11.459 2.794 ( 0.272 8.449 -0.037) 8.454 2.900 ( 1.279 9.900 5.372) 11.336 3.041 ( 0.452 -1.097 -0.142) 1.195 3.127 ( 0.458 -0.941 3.103) 3.275 3.276 ( 0.880 3.105 1.251) 3.461 3.413 ( -3.527 3.726 -1.912) 5.475 3.634 ( -7.138 6.560 14.731) 17.635 3.771 ( 1.890 1.243 5.468) 5.917 3.877 ( -2.471 2.688 7.552) 8.388 3.962 ( 0.403 -5.054 0.500) 5.095 4.065 ( 1.960 3.050 -5.007) 6.182 4.262 ( 1.105 3.718 -2.618) 4.679 4.395 ( -1.490 2.954 -2.045) 3.889 4.499 ( -0.075 3.840 2.981) 4.862 4.523 ( 2.687 -2.426 -6.889) 7.782 4.715 ( -4.182 8.973 4.238) 10.768 4.815 ( -1.144 -3.455 -0.632) 3.694 4.891 ( -1.022 -10.539 1.705) 10.724 5.172 ( 3.816 -5.285 -0.277) 6.524 5.246 ( -5.923 -10.548 2.799) 12.417 5.664 ( -0.403 3.818 -3.179) 4.984 5.847 ( -1.065 3.942 -3.188) 5.181 5.954 ( 6.966 -2.182 -7.724) 10.627 6.303 ( -2.418 -0.024 -0.445) 2.458 6.462 ( -1.454 -3.057 0.118) 3.387 6.633 ( 4.169 -20.179 -10.538) 23.144 7.229 ( 1.564 11.346 -1.381) 11.536 7.570 ( 0.737 7.815 -1.359) 7.966 7.684 ( 1.551 -3.677 -2.616) 4.771 7.736 ( 3.883 3.561 -4.577) 6.979 7.827 ( 0.254 2.246 -0.035) 2.261 7.956 ( 1.639 -1.415 -2.511) 3.316 7.988 ( 1.014 -0.587 -1.704) 2.068 8.052 ( 1.165 -2.796 -2.384) 3.854 8.572 ( -1.120 1.959 -2.130) 3.103 8.767 ( -0.120 -7.018 -5.107) 8.680 9.463 ( -0.455 4.374 2.898) 5.267 9.710 ( -0.505 -4.726 1.813) 5.087 9.880 ( 0.746 1.883 1.889) 2.770 10.000 ( -0.125 -2.353 4.132) 4.756 10.398 ( -3.129 15.628 10.397) 19.030 10.520 ( -3.164 12.986 7.115) 15.142 12.328 ( -1.448 5.612 4.590) 7.393 12.955 ( -1.417 -19.441 16.764) 25.710 13.686 ( 3.582 37.763 -5.257) 38.295 15.142 ( 0.616 3.653 3.764) 5.281 15.677 ( 3.568 -17.807 -3.036) 18.412 16.452 ( -0.136 -21.903 4.783) 22.420 17.737 ( -5.392 5.720 -2.093) 8.135 17.791 ( -6.601 2.897 -1.640) 7.393 22.034 ( 1.283 8.530 -5.583) 10.275 22.504 ( 0.181 -11.648 -3.710) 12.226 23.092 ( -0.407 3.978 -1.432) 4.247 23.256 ( 0.198 -2.275 -1.494) 2.729 23.502 ( 3.377 7.545 3.823) 9.108 23.817 ( 8.827 -5.495 11.915) 15.814 24.869 ( -0.367 6.580 -0.435) 6.605 25.304 ( -6.270 -11.877 -10.488) 17.040 ======================= Grid point 196 (106/136) ======================= q-point: (-0.38 0.33 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.312 ( 3.528 11.699 -9.557) 15.513 1.374 ( 2.812 6.026 2.468) 7.093 1.642 ( -0.743 -5.470 1.425) 5.701 1.890 ( -0.552 -6.183 6.450) 8.952 2.002 ( -2.465 -6.650 -7.867) 10.592 2.146 ( 1.671 -4.711 0.028) 4.999 2.500 ( 0.994 -8.788 -1.424) 8.958 2.628 ( 1.905 -9.076 -4.809) 10.447 2.786 ( -0.869 7.993 0.286) 8.046 2.914 ( -2.096 8.025 2.277) 8.601 3.047 ( 0.121 0.560 -2.082) 2.159 3.137 ( -1.209 -0.733 1.813) 2.299 3.293 ( -1.574 1.826 0.689) 2.508 3.359 ( 0.321 6.203 2.259) 6.609 3.573 ( -8.931 4.367 12.283) 15.802 3.810 ( -1.339 0.320 2.514) 2.867 3.876 ( -2.610 1.915 6.274) 7.060 3.971 ( 0.271 -1.595 0.100) 1.621 4.094 ( 2.169 4.705 -1.149) 5.307 4.239 ( -1.208 4.347 -2.014) 4.941 4.360 ( -0.396 5.082 -0.874) 5.171 4.449 ( -1.067 1.983 -4.062) 4.644 4.597 ( 4.135 -1.346 -0.290) 4.358 4.686 ( -2.302 4.236 5.441) 7.270 4.795 ( -1.554 -1.825 -0.626) 2.477 4.879 ( -1.343 -14.219 2.713) 14.537 5.152 ( -2.855 -4.823 2.966) 6.341 5.291 ( 5.558 -7.513 0.114) 9.346 5.645 ( 0.264 3.393 -1.939) 3.917 5.801 ( -1.156 7.279 -2.322) 7.727 5.973 ( 0.695 -5.225 -6.524) 8.387 6.286 ( 1.285 -2.337 -1.406) 3.015 6.461 ( 0.924 -2.217 1.441) 2.801 6.649 ( 4.976 -19.033 -9.232) 21.731 7.253 ( 2.199 11.867 -2.572) 12.340 7.570 ( 0.570 10.813 -2.604) 11.137 7.680 ( 0.789 -4.750 -3.169) 5.765 7.765 ( 2.361 0.484 -4.535) 5.135 7.820 ( -0.884 3.722 -1.835) 4.243 7.952 ( 0.334 -1.458 -1.621) 2.205 8.014 ( 2.577 -0.637 -3.911) 4.727 8.055 ( 1.483 -2.364 -2.225) 3.569 8.551 ( -0.055 0.663 0.104) 0.673 8.722 ( -0.881 -6.953 -3.409) 7.793 9.480 ( 0.135 4.083 2.436) 4.757 9.703 ( -1.538 -4.239 1.534) 4.763 9.912 ( 1.532 1.328 0.272) 2.046 10.011 ( -1.298 -2.104 2.642) 3.618 10.428 ( -1.734 15.571 9.942) 18.556 10.534 ( -0.823 13.608 7.212) 15.423 12.333 ( -1.369 6.646 4.196) 7.978 13.041 ( -1.031 -19.301 11.844) 22.669 13.778 ( 9.397 32.900 -6.010) 34.740 15.205 ( 3.649 -1.619 0.851) 4.082 15.751 ( 7.271 -10.848 -5.133) 14.032 16.572 ( 8.408 -20.772 2.652) 22.565 17.789 ( 12.723 6.805 6.057) 15.648 17.876 ( 12.627 1.793 4.414) 13.495 22.048 ( 4.137 7.956 -4.554) 10.057 22.494 ( 1.157 -11.234 -2.494) 11.566 23.070 ( -1.334 3.902 -0.656) 4.176 23.220 ( -3.535 -1.073 -1.067) 3.846 23.464 ( -7.690 7.751 -1.090) 10.973 23.846 ( -11.188 -7.461 -1.763) 13.562 24.774 ( -10.200 3.671 -0.357) 10.846 25.076 ( -10.323 -8.674 0.451) 13.491 ======================= Grid point 197 (107/136) ======================= q-point: (-0.25 0.33 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.364 ( 3.517 5.363 -2.338) 6.826 1.448 ( 4.992 11.053 -0.203) 12.130 1.613 ( 2.071 -2.649 -5.997) 6.875 1.863 ( -3.489 0.158 2.231) 4.144 1.970 ( 0.847 -7.621 -1.361) 7.787 2.183 ( 0.602 -9.309 3.289) 9.891 2.478 ( -0.821 -8.071 -5.893) 10.027 2.603 ( -1.014 -7.639 -4.020) 8.692 2.774 ( -0.591 6.616 0.494) 6.661 2.861 ( -2.814 9.800 -5.058) 11.382 3.012 ( -1.556 -1.582 -1.179) 2.513 3.103 ( -2.895 -1.089 -1.361) 3.379 3.255 ( -5.275 6.563 9.802) 12.922 3.436 ( 5.177 3.349 0.245) 6.170 3.487 ( -7.432 2.387 8.587) 11.605 3.758 ( -4.611 -0.117 -0.471) 4.637 3.876 ( -1.232 3.113 5.183) 6.171 3.986 ( 1.269 1.166 -0.015) 1.723 4.088 ( -2.567 6.484 2.458) 7.394 4.211 ( -0.197 3.816 -1.964) 4.296 4.319 ( -4.123 2.715 0.483) 4.961 4.455 ( 3.076 1.934 -0.752) 3.710 4.637 ( -2.283 -5.253 0.362) 5.739 4.685 ( 0.555 -1.199 -0.702) 1.496 4.768 ( 1.843 1.834 1.758) 3.138 4.916 ( 1.928 -13.475 4.963) 14.489 5.142 ( -1.070 -0.874 2.129) 2.538 5.389 ( 3.399 -9.107 1.554) 9.844 5.623 ( -1.496 1.284 -2.935) 3.536 5.785 ( 2.160 10.567 -3.396) 11.307 5.912 ( -2.935 -8.127 -2.460) 8.984 6.326 ( 3.056 -6.377 0.449) 7.086 6.521 ( 4.058 -0.878 1.206) 4.324 6.695 ( 6.449 -15.970 -7.768) 18.894 7.267 ( 1.233 11.409 -3.208) 11.915 7.553 ( -0.061 10.275 -3.232) 10.771 7.663 ( -0.568 -4.258 -4.701) 6.368 7.758 ( -0.604 3.255 -0.785) 3.403 7.783 ( 0.753 0.773 -5.212) 5.322 7.919 ( -1.590 0.990 -4.284) 4.676 8.019 ( 1.702 -1.234 -5.492) 5.881 8.109 ( 4.653 -2.062 -0.007) 5.090 8.576 ( 1.816 -0.173 1.841) 2.592 8.694 ( 0.114 -6.097 -1.721) 6.337 9.498 ( -0.027 3.238 1.814) 3.712 9.670 ( -2.882 -2.999 1.189) 4.326 9.934 ( 0.709 0.131 -0.928) 1.175 9.986 ( -2.601 -1.571 0.983) 3.194 10.475 ( -0.896 15.286 9.541) 18.042 10.586 ( 0.294 13.556 7.481) 15.486 12.337 ( -1.340 7.966 4.184) 9.097 13.107 ( 0.741 -15.698 8.735) 17.980 13.908 ( 8.010 25.005 -7.331) 27.261 15.283 ( 4.673 -8.810 -1.558) 10.094 15.886 ( 10.986 -1.870 -7.577) 13.476 16.761 ( 9.972 -19.844 -0.149) 22.209 18.194 ( 20.826 5.357 2.991) 21.711 18.374 ( 30.085 -1.082 11.376) 32.183 22.133 ( 7.510 8.018 -3.007) 11.390 22.522 ( 3.317 -9.058 -0.166) 9.647 22.975 ( -12.697 4.304 -0.433) 13.413 23.076 ( -7.238 1.353 -1.106) 7.446 23.311 ( -4.484 -0.959 -2.658) 5.301 23.392 ( -25.135 -4.750 -11.501) 28.047 24.521 ( -14.390 7.250 1.593) 16.192 24.903 ( -13.477 -8.767 8.213) 18.054 ======================= Grid point 198 (108/136) ======================= q-point: (-0.12 0.33 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( -8.226 8.156 10.839) 15.864 1.516 ( 2.045 3.581 -2.676) 4.916 1.720 ( 15.114 3.556 -12.921) 20.200 1.827 ( -3.917 -0.636 6.142) 7.312 1.998 ( 4.352 -2.254 -3.034) 5.764 2.207 ( -1.551 -10.197 4.691) 11.331 2.404 ( -0.634 -8.159 -7.847) 11.338 2.544 ( -1.344 -7.329 -4.014) 8.464 2.737 ( -3.750 8.874 -7.897) 12.457 2.771 ( 0.408 5.560 -1.901) 5.890 2.961 ( -4.541 0.006 -1.129) 4.679 3.014 ( -2.755 -0.928 -3.844) 4.820 3.242 ( -6.132 7.961 16.916) 19.675 3.427 ( -3.097 1.092 3.225) 4.603 3.532 ( 4.705 0.654 -1.108) 4.878 3.653 ( -4.359 -0.642 -2.122) 4.890 3.908 ( 0.474 4.529 4.091) 6.121 4.007 ( 0.050 2.912 1.028) 3.088 4.060 ( -2.701 5.519 4.587) 7.668 4.201 ( -0.732 4.648 0.914) 4.794 4.241 ( -3.708 1.771 1.422) 4.348 4.499 ( 1.278 -0.442 -0.269) 1.379 4.569 ( -3.133 -4.668 1.165) 5.741 4.699 ( 3.173 -7.493 -6.556) 10.450 4.874 ( 5.086 2.719 4.432) 7.273 5.008 ( 2.490 -8.900 7.179) 11.702 5.122 ( -2.247 0.507 1.490) 2.743 5.443 ( 1.481 -10.173 1.198) 10.350 5.534 ( -3.597 0.486 -6.736) 7.652 5.827 ( -3.152 -6.246 2.520) 7.436 5.846 ( 3.994 5.713 -4.810) 8.469 6.403 ( 3.018 -10.799 3.579) 11.770 6.612 ( 4.551 0.611 -1.204) 4.747 6.787 ( 7.954 -11.509 -5.794) 15.143 7.252 ( -0.335 9.195 -2.789) 9.615 7.510 ( -2.111 2.594 -4.255) 5.412 7.598 ( -1.689 6.280 -2.749) 7.060 7.753 ( -0.013 1.387 -0.683) 1.546 7.764 ( 0.996 -0.713 -5.255) 5.395 7.846 ( -1.320 2.114 -6.439) 6.904 8.015 ( 2.629 0.924 -6.365) 6.949 8.208 ( 4.815 -2.607 0.612) 5.509 8.637 ( 2.521 -0.211 2.302) 3.420 8.701 ( 1.466 -4.193 -0.825) 4.518 9.504 ( -0.572 2.143 1.445) 2.647 9.616 ( -3.107 -2.017 0.815) 3.793 9.910 ( -3.285 0.072 0.458) 3.317 9.948 ( -0.551 -2.091 -1.401) 2.577 10.524 ( -1.636 15.049 9.781) 18.023 10.644 ( -0.241 13.338 7.383) 15.247 12.342 ( -1.383 8.968 4.362) 10.069 13.201 ( 1.255 -17.409 10.340) 20.287 13.963 ( 3.786 24.858 -9.090) 26.737 15.359 ( 3.964 -11.549 -1.515) 12.304 16.029 ( 9.038 1.230 -8.889) 12.736 16.968 ( 10.660 -20.363 1.753) 23.051 18.553 ( 12.976 6.935 -0.239) 14.715 18.865 ( 9.947 -6.107 -3.394) 12.156 22.264 ( 6.041 8.298 -3.721) 10.918 22.576 ( -5.939 -3.633 -1.488) 7.119 22.749 ( -13.058 -0.693 -0.998) 13.114 22.796 ( 3.851 -1.861 4.773) 6.409 23.125 ( 0.126 2.173 -0.126) 2.180 23.251 ( -1.921 -2.692 -1.257) 3.538 24.271 ( -11.836 7.284 1.853) 14.021 24.634 ( -18.642 -8.038 4.779) 20.856 ======================= Grid point 199 (109/136) ======================= q-point: ( 0.00 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( -11.381 -6.598 6.692) 14.760 1.386 ( -11.381 6.598 6.692) 14.760 1.922 ( 5.539 -5.161 -3.401) 8.300 1.922 ( 5.539 5.161 -3.401) 8.300 2.090 ( 5.267 -2.610 0.400) 5.892 2.090 ( 5.267 2.610 0.400) 5.892 2.335 ( 1.786 -5.979 -8.325) 10.404 2.335 ( 1.786 5.979 -8.325) 10.404 2.763 ( -3.366 -3.912 -2.331) 5.663 2.763 ( -3.366 3.912 -2.331) 5.663 2.904 ( -0.435 -4.701 -2.149) 5.187 2.904 ( -0.435 4.701 -2.149) 5.187 3.422 ( -1.214 -5.009 4.529) 6.862 3.422 ( -1.214 5.009 4.529) 6.862 3.554 ( -0.337 -2.303 1.368) 2.700 3.554 ( -0.337 2.303 1.368) 2.700 3.979 ( -3.152 -1.629 2.333) 4.246 3.979 ( -3.152 1.629 2.333) 4.246 4.204 ( 0.559 -3.433 3.517) 4.946 4.204 ( 0.559 3.433 3.517) 4.946 4.388 ( -0.414 -14.394 -1.348) 14.463 4.388 ( -0.414 14.394 -1.348) 14.463 4.499 ( 1.164 -1.819 -1.718) 2.759 4.499 ( 1.164 1.819 -1.718) 2.759 5.056 ( 3.452 -4.207 4.994) 7.386 5.056 ( 3.452 4.207 4.994) 7.386 5.243 ( 0.394 -11.230 1.382) 11.322 5.243 ( 0.394 11.230 1.382) 11.322 5.492 ( -5.291 -8.861 -2.227) 10.558 5.492 ( -5.291 8.861 -2.227) 10.558 6.166 ( 3.538 -13.073 -2.289) 13.736 6.166 ( 3.538 13.073 -2.289) 13.736 6.743 ( 3.344 -4.730 -3.534) 6.786 6.743 ( 3.344 4.730 -3.534) 6.786 7.358 ( -1.057 -5.231 -2.835) 6.043 7.358 ( -1.057 5.231 -2.835) 6.043 7.718 ( 0.917 -2.608 -1.988) 3.405 7.718 ( 0.917 2.608 -1.988) 3.405 7.781 ( -0.506 -3.501 -5.112) 6.216 7.781 ( -0.506 3.501 -5.112) 6.216 8.157 ( 3.240 -7.674 -2.918) 8.827 8.157 ( 3.240 7.674 -2.918) 8.827 8.695 ( 1.491 -1.552 1.256) 2.492 8.695 ( 1.491 1.552 1.256) 2.492 9.540 ( -0.703 -2.043 0.447) 2.207 9.540 ( -0.703 2.043 0.447) 2.207 9.872 ( -2.086 -1.892 0.484) 2.858 9.872 ( -2.086 1.892 0.484) 2.858 10.774 ( -3.424 -4.364 9.234) 10.772 10.774 ( -3.424 4.364 9.234) 10.772 12.704 ( -4.245 -23.976 9.511) 26.141 12.704 ( -4.245 23.976 9.511) 26.141 14.733 ( 2.521 -38.747 -5.978) 39.286 14.733 ( 2.521 38.747 -5.978) 39.286 16.527 ( -0.735 -29.063 -3.237) 29.252 16.527 ( -0.735 29.063 -3.237) 29.252 18.741 ( -5.234 -2.367 -0.840) 5.805 18.741 ( -5.234 2.367 -0.840) 5.805 22.332 ( -1.934 -5.226 -3.761) 6.723 22.332 ( -1.934 5.226 -3.761) 6.723 22.925 ( 6.977 -10.402 1.492) 12.614 22.925 ( 6.977 10.402 1.492) 12.614 23.193 ( 2.125 -3.707 1.508) 4.532 23.193 ( 2.125 3.707 1.508) 4.532 24.255 ( -2.162 -4.997 1.560) 5.663 24.255 ( -2.162 4.997 1.560) 5.663 ======================= Grid point 201 (110/136) ======================= q-point: ( 0.12 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( -13.109 -4.174 7.862) 15.845 1.190 ( -13.109 4.174 7.862) 15.845 1.969 ( 1.498 -4.599 -1.592) 5.092 1.969 ( 1.498 4.599 -1.592) 5.092 2.179 ( 3.351 -4.370 -0.246) 5.513 2.179 ( 3.351 4.370 -0.246) 5.513 2.317 ( 3.215 -6.211 -10.872) 12.927 2.317 ( 3.215 6.211 -10.872) 12.927 2.760 ( 2.901 -5.274 1.870) 6.303 2.760 ( 2.901 5.274 1.870) 6.303 2.890 ( 0.700 -5.720 -1.206) 5.887 2.890 ( 0.700 5.720 -1.206) 5.887 3.420 ( -1.970 -6.407 4.021) 7.817 3.420 ( -1.970 6.407 4.021) 7.817 3.593 ( 2.669 -6.223 1.831) 7.015 3.593 ( 2.669 6.223 1.831) 7.015 3.927 ( -4.075 -1.650 3.895) 5.874 3.927 ( -4.075 1.650 3.895) 5.874 4.237 ( 0.373 -3.476 1.487) 3.799 4.237 ( 0.373 3.476 1.487) 3.799 4.382 ( 0.361 -13.513 0.025) 13.518 4.382 ( 0.361 13.513 0.025) 13.518 4.519 ( 2.505 -3.983 -2.482) 5.319 4.519 ( 2.505 3.983 -2.482) 5.319 5.103 ( -1.049 -7.041 1.073) 7.199 5.103 ( -1.049 7.041 1.073) 7.199 5.269 ( -0.883 -11.193 1.014) 11.274 5.269 ( -0.883 11.193 1.014) 11.274 5.423 ( 0.825 -8.853 1.757) 9.064 5.423 ( 0.825 8.853 1.757) 9.064 6.201 ( 2.574 -12.268 -4.629) 13.363 6.201 ( 2.574 12.268 -4.629) 13.363 6.711 ( -2.873 -4.721 -5.063) 7.495 6.711 ( -2.873 4.721 -5.063) 7.495 7.359 ( 2.101 -5.612 -0.805) 6.046 7.359 ( 2.101 5.612 -0.805) 6.046 7.732 ( 0.159 -1.791 0.493) 1.864 7.732 ( 0.159 1.791 0.493) 1.864 7.749 ( 2.555 -2.225 -5.875) 6.782 7.749 ( 2.555 2.225 -5.875) 6.782 8.167 ( 0.273 -6.970 -4.295) 8.192 8.167 ( 0.273 6.970 -4.295) 8.192 8.712 ( 0.261 -1.634 -0.916) 1.891 8.712 ( 0.261 1.634 -0.916) 1.891 9.543 ( 0.491 -2.962 0.870) 3.126 9.543 ( 0.491 2.962 0.870) 3.126 9.851 ( -1.110 -1.571 2.582) 3.219 9.851 ( -1.110 1.571 2.582) 3.219 10.751 ( -5.899 -4.670 9.207) 11.889 10.751 ( -5.899 4.670 9.207) 11.889 12.665 ( -7.035 -21.781 9.895) 24.936 12.665 ( -7.035 21.781 9.895) 24.936 14.702 ( -0.863 -40.015 -6.567) 40.559 14.702 ( -0.863 40.015 -6.567) 40.559 16.370 ( -12.596 -29.044 -0.466) 31.661 16.370 ( -12.596 29.044 -0.466) 31.661 18.607 ( -9.436 -1.719 4.373) 10.541 18.607 ( -9.436 1.719 4.373) 10.541 22.368 ( 5.657 -7.489 -1.153) 9.456 22.368 ( 5.657 7.489 -1.153) 9.456 22.907 ( -3.312 -6.479 -4.444) 8.526 22.907 ( -3.312 6.479 -4.444) 8.526 23.224 ( 0.152 -1.206 -1.024) 1.589 23.224 ( 0.152 1.206 -1.024) 1.589 24.471 ( 19.568 -9.671 2.044) 21.923 24.471 ( 19.568 9.671 2.044) 21.923 ======================= Grid point 203 (111/136) ======================= q-point: ( 0.25 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.057 ( -4.985 -0.921 7.743) 9.255 1.057 ( -4.985 0.921 7.743) 9.255 1.965 ( -0.172 -2.509 -3.127) 4.013 1.965 ( -0.172 2.509 -3.127) 4.013 2.186 ( -1.388 -7.974 -4.926) 9.475 2.186 ( -1.388 7.974 -4.926) 9.475 2.322 ( 3.939 -7.295 -4.476) 9.422 2.322 ( 3.939 7.295 -4.476) 9.422 2.851 ( 2.752 -5.309 4.501) 7.484 2.851 ( 2.752 5.309 4.501) 7.484 2.927 ( 3.728 -5.933 -0.021) 7.007 2.927 ( 3.728 5.933 -0.021) 7.007 3.411 ( -1.460 -6.816 2.751) 7.494 3.411 ( -1.460 6.816 2.751) 7.494 3.667 ( 2.625 -7.713 3.857) 9.015 3.667 ( 2.625 7.713 3.857) 9.015 3.885 ( -3.616 -3.008 4.736) 6.675 3.885 ( -3.616 3.008 4.736) 6.675 4.241 ( -0.168 -4.602 -0.256) 4.613 4.241 ( -0.168 4.602 -0.256) 4.613 4.390 ( 0.437 -9.197 -0.409) 9.217 4.390 ( 0.437 9.197 -0.409) 9.217 4.565 ( 3.530 -5.926 -1.206) 7.002 4.565 ( 3.530 5.926 -1.206) 7.002 5.053 ( -2.597 -6.502 -3.428) 7.796 5.053 ( -2.597 6.502 -3.428) 7.796 5.203 ( -6.348 -11.905 4.246) 14.144 5.203 ( -6.348 11.905 4.246) 14.144 5.544 ( 7.987 -3.735 1.570) 8.956 5.544 ( 7.987 3.735 1.570) 8.956 6.198 ( 1.974 -12.720 -8.071) 15.193 6.198 ( 1.974 12.720 -8.071) 15.193 6.593 ( -4.899 -3.385 -4.512) 7.471 6.593 ( -4.899 3.385 -4.512) 7.471 7.400 ( 1.891 -7.549 0.265) 7.787 7.400 ( 1.891 7.549 0.265) 7.787 7.723 ( 0.770 -1.923 -1.877) 2.796 7.723 ( 0.770 1.923 -1.877) 2.796 7.802 ( 4.526 -1.592 -2.309) 5.325 7.802 ( 4.526 1.592 -2.309) 5.325 8.108 ( -2.684 -4.051 -4.275) 6.472 8.108 ( -2.684 4.051 -4.275) 6.472 8.700 ( 0.315 -2.475 -3.441) 4.250 8.700 ( 0.315 2.475 -3.441) 4.250 9.563 ( 0.477 -5.047 1.207) 5.211 9.563 ( 0.477 5.047 1.207) 5.211 9.867 ( -0.075 -0.812 4.490) 4.564 9.867 ( -0.075 0.812 4.490) 4.564 10.692 ( -6.870 -4.762 9.357) 12.547 10.692 ( -6.870 4.762 9.357) 12.547 12.593 ( -7.565 -17.650 10.587) 21.928 12.593 ( -7.565 17.650 10.587) 21.928 14.620 ( -2.201 -40.444 -6.155) 40.969 14.620 ( -2.200 40.444 -6.155) 40.969 16.119 ( -12.620 -27.055 3.121) 30.017 16.119 ( -12.620 27.055 3.121) 30.017 18.398 ( -15.604 -5.741 2.308) 16.786 18.398 ( -15.604 5.741 2.308) 16.786 22.398 ( -2.291 -11.464 -4.175) 12.414 22.398 ( -2.291 11.464 -4.175) 12.414 22.962 ( 12.850 -1.507 1.166) 12.990 22.962 ( 12.850 1.507 1.166) 12.990 23.220 ( 0.708 -3.738 -0.603) 3.852 23.220 ( 0.708 3.739 -0.603) 3.852 24.861 ( 17.680 -13.936 -1.656) 22.573 24.861 ( 17.680 13.937 -1.656) 22.573 ======================= Grid point 205 (112/136) ======================= q-point: ( 0.38 -0.50 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( 6.217 -1.712 7.207) 9.670 1.132 ( 6.217 1.712 7.207) 9.670 1.889 ( -3.773 -8.088 -9.103) 12.748 1.889 ( -3.773 8.088 -9.103) 12.748 2.114 ( -2.214 -3.866 -0.988) 4.563 2.114 ( -2.214 3.866 -0.988) 4.563 2.375 ( 3.365 -5.341 -1.798) 6.564 2.375 ( 3.365 5.341 -1.798) 6.564 2.923 ( 2.099 -5.947 2.591) 6.818 2.923 ( 2.099 5.947 2.591) 6.818 3.005 ( 2.742 -5.557 2.425) 6.655 3.005 ( 2.742 5.557 2.425) 6.655 3.403 ( -0.942 -6.780 1.038) 6.924 3.403 ( -0.942 6.780 1.038) 6.924 3.749 ( 1.718 -6.437 6.421) 9.252 3.749 ( 1.718 6.437 6.421) 9.252 3.851 ( -3.501 -4.321 5.203) 7.615 3.851 ( -3.501 4.321 5.203) 7.615 4.230 ( -0.137 -6.389 -1.739) 6.622 4.230 ( -0.137 6.389 -1.739) 6.622 4.400 ( 1.459 -5.139 -1.130) 5.461 4.400 ( 1.459 5.139 -1.130) 5.461 4.619 ( 1.626 -6.237 0.374) 6.456 4.619 ( 1.626 6.237 0.374) 6.456 4.981 ( -1.235 -7.027 -4.639) 8.510 4.981 ( -1.235 7.027 -4.639) 8.510 5.108 ( -7.048 -10.751 6.026) 14.198 5.108 ( -7.048 10.751 6.026) 14.198 5.697 ( 6.681 -2.426 -1.183) 7.205 5.697 ( 6.681 2.426 -1.183) 7.205 6.169 ( 2.346 -14.210 -10.336) 17.727 6.169 ( 2.346 14.210 -10.336) 17.727 6.479 ( -3.759 -2.551 -2.686) 5.277 6.479 ( -3.759 2.551 -2.686) 5.277 7.433 ( 1.394 -9.251 0.470) 9.367 7.433 ( 1.394 9.251 0.470) 9.367 7.735 ( 1.602 -1.824 -1.969) 3.126 7.735 ( 1.602 1.824 -1.969) 3.126 7.870 ( 3.911 -2.258 -2.339) 5.086 7.870 ( 3.911 2.258 -2.339) 5.086 8.028 ( -2.172 -0.301 -2.800) 3.556 8.028 ( -2.172 0.301 -2.800) 3.556 8.675 ( 0.165 -3.873 -4.773) 6.149 8.675 ( 0.165 3.873 -4.773) 6.149 9.575 ( -0.209 -6.332 1.493) 6.509 9.575 ( -0.209 6.332 1.493) 6.509 9.905 ( 0.264 -2.591 4.714) 5.386 9.905 ( 0.264 2.591 4.714) 5.386 10.639 ( -5.458 -4.443 9.719) 12.000 10.639 ( -5.458 4.443 9.719) 12.000 12.547 ( -5.278 -15.137 11.401) 19.671 12.547 ( -5.278 15.137 11.401) 19.671 14.553 ( 0.083 -40.473 -5.294) 40.818 14.553 ( 0.083 40.473 -5.294) 40.818 15.960 ( -6.521 -25.522 4.710) 26.760 15.960 ( -6.521 25.522 4.710) 26.760 18.066 ( -16.623 -4.639 -2.609) 17.454 18.066 ( -16.623 4.639 -2.609) 17.454 22.303 ( -1.976 -11.348 -6.067) 13.019 22.303 ( -1.976 11.348 -6.067) 13.019 23.183 ( 2.372 -2.603 -1.153) 3.705 23.183 ( 2.372 2.603 -1.153) 3.705 23.366 ( 14.912 -2.443 9.239) 17.712 23.366 ( 14.912 2.443 9.239) 17.712 25.076 ( 6.786 -13.932 -5.198) 16.346 25.076 ( 6.786 13.932 -5.198) 16.346 ======================= Grid point 207 (113/136) ======================= q-point: (-0.50 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.343 ( 8.923 -5.465 5.612) 11.874 1.343 ( 8.923 5.465 5.612) 11.874 1.717 ( -4.306 -13.495 -11.736) 18.395 1.717 ( -4.306 13.495 -11.736) 18.395 2.080 ( -2.755 -2.253 2.786) 4.519 2.080 ( -2.755 2.253 2.786) 4.519 2.423 ( 3.268 -5.023 -2.249) 6.401 2.423 ( 3.268 5.023 -2.249) 6.401 2.956 ( -0.223 -5.861 0.726) 5.910 2.956 ( -0.223 5.861 0.726) 5.910 3.070 ( 2.115 -4.388 2.330) 5.400 3.070 ( 2.115 4.388 2.330) 5.400 3.383 ( -1.566 -5.430 0.098) 5.652 3.383 ( -1.566 5.430 0.098) 5.652 3.778 ( -4.629 -4.696 8.070) 10.422 3.778 ( -4.629 4.696 8.070) 10.422 3.869 ( 1.701 -2.380 4.308) 5.207 3.869 ( 1.701 2.380 4.308) 5.207 4.219 ( 0.829 -8.329 -2.048) 8.617 4.219 ( 0.829 8.329 -2.048) 8.617 4.427 ( 2.143 -3.282 -2.305) 4.548 4.427 ( 2.143 3.282 -2.305) 4.548 4.618 ( -1.895 -5.888 1.480) 6.360 4.618 ( -1.895 5.888 1.480) 6.360 4.913 ( -5.038 -3.939 -0.336) 6.404 4.913 ( -5.038 3.939 -0.336) 6.404 5.069 ( 0.262 -2.108 4.152) 4.664 5.069 ( 0.262 2.108 4.152) 4.664 5.767 ( 2.615 -5.961 -3.728) 7.502 5.767 ( 2.615 5.961 -3.728) 7.502 6.142 ( 2.470 -14.166 -10.117) 17.582 6.142 ( 2.470 14.166 -10.117) 17.583 6.419 ( -0.740 -2.151 -1.342) 2.641 6.419 ( -0.740 2.151 -1.342) 2.641 7.466 ( 1.991 -9.916 -0.520) 10.127 7.466 ( 1.991 9.916 -0.520) 10.127 7.746 ( 0.941 -2.624 -2.108) 3.495 7.746 ( 0.941 2.624 -2.108) 3.495 7.909 ( 1.829 -3.337 -2.725) 4.680 7.909 ( 1.829 3.337 -2.725) 4.680 7.998 ( 0.977 -2.176 -2.139) 3.204 7.998 ( 0.977 2.176 -2.139) 3.204 8.636 ( -0.813 -4.575 -3.993) 6.126 8.636 ( -0.813 4.575 -3.993) 6.126 9.581 ( -0.217 -6.364 1.491) 6.540 9.581 ( -0.217 6.364 1.491) 6.540 9.940 ( 0.124 -3.108 3.605) 4.761 9.940 ( 0.124 3.108 3.605) 4.761 10.628 ( -3.165 -3.787 9.655) 10.844 10.628 ( -3.165 3.787 9.655) 10.844 12.556 ( -2.600 -15.904 11.288) 19.675 12.556 ( -2.600 15.904 11.288) 19.675 14.549 ( 3.398 -40.453 -5.643) 40.985 14.549 ( 3.398 40.453 -5.643) 40.985 15.945 ( 1.895 -24.212 3.923) 24.601 15.945 ( 1.895 24.212 3.923) 24.601 17.810 ( -5.929 -1.241 -1.686) 6.288 17.810 ( -5.929 1.241 -1.686) 6.288 22.250 ( 0.716 -11.358 -5.331) 12.567 22.250 ( 0.716 11.358 -5.331) 12.567 23.185 ( -0.299 -4.132 -1.032) 4.269 23.185 ( -0.299 4.132 -1.032) 4.269 23.671 ( 6.527 -7.781 8.209) 13.059 23.671 ( 6.527 7.781 8.209) 13.059 25.056 ( -4.019 -10.632 -5.120) 12.466 25.056 ( -4.019 10.632 -5.120) 12.466 ======================= Grid point 209 (114/136) ======================= q-point: (-0.38 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.477 ( 2.904 -7.333 -4.271) 8.969 1.477 ( 2.904 7.333 -4.271) 8.969 1.637 ( 3.661 -13.903 -3.780) 14.865 1.637 ( 3.661 13.903 -3.780) 14.865 2.037 ( -3.970 -5.827 3.684) 7.956 2.037 ( -3.970 5.827 3.684) 7.956 2.463 ( 2.632 -4.891 -3.767) 6.711 2.463 ( 2.632 4.891 -3.767) 6.711 2.937 ( -1.890 -5.215 1.144) 5.664 2.937 ( -1.890 5.215 1.144) 5.664 3.100 ( -0.198 -3.052 -1.053) 3.235 3.100 ( -0.198 3.052 -1.053) 3.235 3.359 ( -0.948 -3.955 1.481) 4.328 3.359 ( -0.948 3.955 1.481) 4.328 3.736 ( -5.599 -7.561 7.956) 12.321 3.736 ( -5.599 7.561 7.956) 12.321 3.917 ( 0.736 -2.657 1.970) 3.389 3.917 ( 0.736 2.657 1.970) 3.389 4.240 ( 2.032 -6.373 -1.278) 6.810 4.240 ( 2.032 6.373 -1.278) 6.810 4.427 ( -0.180 -3.014 -2.979) 4.242 4.427 ( -0.180 3.014 -2.979) 4.242 4.601 ( -1.130 -3.134 1.726) 3.752 4.601 ( -1.130 3.134 1.726) 3.752 4.811 ( -5.280 -3.436 3.757) 7.335 4.811 ( -5.280 3.436 3.757) 7.335 5.141 ( 3.136 -5.136 3.300) 6.863 5.141 ( 3.136 5.136 3.300) 6.863 5.763 ( 0.117 -7.079 -3.659) 7.969 5.763 ( 0.117 7.079 -3.659) 7.969 6.108 ( 1.259 -13.694 -8.747) 16.298 6.108 ( 1.259 13.694 -8.747) 16.298 6.434 ( 3.163 -1.790 -1.137) 3.808 6.434 ( 3.163 1.790 -1.137) 3.808 7.498 ( 2.179 -10.146 -2.455) 10.664 7.498 ( 2.179 10.146 -2.455) 10.664 7.739 ( -0.008 -3.901 -2.298) 4.527 7.739 ( -0.008 3.901 -2.298) 4.527 7.906 ( 0.146 -3.414 -2.335) 4.139 7.906 ( 0.146 3.414 -2.335) 4.139 8.019 ( 2.740 -1.942 -3.529) 4.872 8.019 ( 2.740 1.942 -3.529) 4.872 8.596 ( -0.833 -4.128 -1.494) 4.468 8.596 ( -0.833 4.128 -1.494) 4.468 9.588 ( -0.200 -5.732 1.140) 5.847 9.588 ( -0.200 5.732 1.140) 5.847 9.959 ( -0.340 -2.609 2.004) 3.307 9.959 ( -0.340 2.609 2.004) 3.307 10.653 ( -1.478 -3.473 9.119) 9.870 10.653 ( -1.478 3.473 9.119) 9.870 12.599 ( -1.278 -18.304 10.002) 20.898 12.599 ( -1.278 18.304 10.002) 20.898 14.587 ( 4.919 -38.929 -6.557) 39.783 14.587 ( 4.919 38.929 -6.557) 39.783 16.078 ( 9.577 -24.171 -0.205) 26.000 16.078 ( 9.577 24.171 -0.205) 26.000 17.878 ( 12.304 -1.814 5.094) 13.440 17.878 ( 12.304 1.814 5.094) 13.440 22.251 ( 2.996 -10.761 -3.878) 11.824 22.251 ( 2.996 10.761 -3.878) 11.824 23.161 ( -1.807 -3.974 -0.442) 4.387 23.161 ( -1.807 3.974 -0.442) 4.387 23.658 ( -11.115 -9.570 -1.634) 14.758 23.658 ( -11.115 9.570 -1.634) 14.758 24.897 ( -9.692 -7.473 1.077) 12.286 24.897 ( -9.692 7.473 1.077) 12.286 ======================= Grid point 211 (115/136) ======================= q-point: (-0.25 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.492 ( 4.979 -6.154 -8.552) 11.653 1.492 ( 4.979 6.154 -8.552) 11.653 1.711 ( 3.735 -12.006 0.397) 12.579 1.711 ( 3.735 12.006 0.397) 12.579 1.998 ( -2.614 -7.896 4.356) 9.389 1.998 ( -2.614 7.896 4.356) 9.389 2.450 ( -0.438 -4.727 -5.700) 7.418 2.450 ( -0.438 4.727 -5.700) 7.418 2.916 ( -1.113 -5.807 1.184) 6.030 2.916 ( -1.113 5.807 1.184) 6.030 3.041 ( -3.826 -4.974 -3.533) 7.202 3.041 ( -3.826 4.974 -3.533) 7.202 3.371 ( 0.333 -5.026 2.495) 5.621 3.371 ( 0.333 5.026 2.495) 5.621 3.672 ( -6.307 -8.486 6.035) 12.174 3.672 ( -6.307 8.486 6.035) 12.174 3.947 ( 1.561 -3.277 1.159) 3.811 3.947 ( 1.561 3.277 1.159) 3.811 4.242 ( -1.709 -3.695 0.027) 4.071 4.242 ( -1.709 3.695 0.027) 4.071 4.406 ( 0.565 -6.803 -2.267) 7.193 4.406 ( 0.565 6.803 -2.267) 7.193 4.563 ( -3.263 -1.110 -0.149) 3.450 4.563 ( -3.263 1.110 -0.149) 3.450 4.815 ( 1.629 -1.490 6.589) 6.948 4.815 ( 1.629 1.490 6.589) 6.948 5.210 ( 1.362 -7.027 2.953) 7.743 5.210 ( 1.362 7.027 2.953) 7.743 5.716 ( -2.441 -7.146 -3.597) 8.364 5.716 ( -2.441 7.146 -3.597) 8.364 6.082 ( 2.119 -14.492 -5.744) 15.733 6.082 ( 2.119 14.492 -5.744) 15.733 6.520 ( 6.488 -1.878 -1.336) 6.886 6.520 ( 6.488 1.878 -1.336) 6.886 7.497 ( -0.124 -9.380 -4.369) 10.349 7.497 ( -0.124 9.380 -4.369) 10.349 7.721 ( 0.211 -4.849 -2.273) 5.360 7.721 ( 0.211 4.849 -2.273) 5.360 7.883 ( -0.514 -5.053 -3.273) 6.042 7.883 ( -0.514 5.053 -3.273) 6.042 8.049 ( 3.321 -3.531 -3.469) 5.961 8.049 ( 3.321 3.531 -3.469) 5.961 8.595 ( 0.976 -2.705 1.089) 3.075 8.595 ( 0.976 2.705 1.089) 3.075 9.583 ( -0.991 -4.509 0.599) 4.655 9.583 ( -0.991 4.509 0.599) 4.655 9.952 ( -1.392 -1.468 0.459) 2.075 9.952 ( -1.392 1.468 0.459) 2.075 10.700 ( -0.622 -3.735 8.900) 9.672 10.700 ( -0.622 3.735 8.900) 9.672 12.648 ( -0.901 -20.771 9.023) 22.664 12.648 ( -0.901 20.771 9.023) 22.664 14.640 ( 5.467 -37.294 -6.335) 38.221 14.640 ( 5.467 37.294 -6.335) 38.221 16.274 ( 11.885 -24.376 -4.494) 27.489 16.274 ( 11.885 24.376 -4.494) 27.489 18.306 ( 23.773 -4.669 6.738) 25.146 18.306 ( 23.773 4.669 6.738) 25.146 22.321 ( 6.710 -9.310 -1.407) 11.562 22.321 ( 6.710 9.310 -1.407) 11.562 23.063 ( -11.715 -2.999 -1.678) 12.209 23.063 ( -11.715 2.999 -1.678) 12.209 23.315 ( -13.844 -1.987 -5.788) 15.137 23.315 ( -13.844 1.987 -5.788) 15.137 24.703 ( -13.425 -9.366 5.273) 17.197 24.703 ( -13.425 9.366 5.273) 17.197 ======================= Grid point 213 (116/136) ======================= q-point: (-0.12 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( -2.696 -5.073 0.580) 5.774 1.500 ( -2.696 5.073 0.580) 5.774 1.807 ( 8.539 -4.317 -5.395) 10.984 1.807 ( 8.539 4.317 -5.395) 10.984 2.010 ( 0.711 -6.721 4.265) 7.992 2.010 ( 0.711 6.721 4.265) 7.992 2.383 ( -1.138 -5.366 -6.316) 8.366 2.383 ( -1.138 5.366 -6.316) 8.366 2.881 ( -4.448 -1.103 -2.141) 5.058 2.881 ( -4.448 1.103 -2.141) 5.058 2.935 ( -2.002 -2.616 -3.122) 4.538 2.935 ( -2.002 2.616 -3.122) 4.538 3.399 ( 0.295 -5.130 3.288) 6.101 3.399 ( 0.295 5.130 3.288) 6.101 3.592 ( -4.962 -5.407 3.328) 8.058 3.592 ( -4.962 5.407 3.328) 8.058 3.988 ( 1.076 -2.730 1.115) 3.139 3.988 ( 1.076 2.730 1.115) 3.139 4.199 ( -2.931 -4.201 3.246) 6.065 4.199 ( -2.931 4.201 3.246) 6.065 4.404 ( 0.583 -11.591 -2.620) 11.898 4.404 ( 0.583 11.591 -2.620) 11.898 4.508 ( -1.600 -0.678 -0.369) 1.776 4.508 ( -1.600 0.678 -0.369) 1.776 4.930 ( 4.488 -2.993 6.438) 8.400 4.930 ( 4.488 2.993 6.438) 8.400 5.236 ( -0.419 -9.218 2.194) 9.485 5.236 ( -0.419 9.218 2.194) 9.485 5.616 ( -4.735 -7.499 -3.944) 9.706 5.616 ( -4.735 7.499 -3.944) 9.706 6.110 ( 3.639 -14.120 -2.598) 14.811 6.110 ( 3.639 14.120 -2.598) 14.811 6.649 ( 7.433 -3.086 -1.896) 8.268 6.649 ( 7.433 3.086 -1.896) 8.268 7.430 ( -2.769 -6.888 -4.544) 8.704 7.430 ( -2.769 6.888 -4.544) 8.704 7.717 ( 0.946 -3.705 -2.334) 4.480 7.717 ( 0.946 3.705 -2.334) 4.480 7.836 ( -1.080 -4.227 -4.963) 6.608 7.836 ( -1.080 4.227 -4.963) 6.608 8.101 ( 4.064 -6.255 -2.296) 7.804 8.101 ( 4.064 6.255 -2.296) 7.804 8.642 ( 2.299 -1.492 2.090) 3.446 8.642 ( 2.299 1.492 2.090) 3.446 9.561 ( -1.494 -2.971 0.258) 3.335 9.561 ( -1.494 2.971 0.258) 3.335 9.915 ( -2.235 -0.781 -0.271) 2.382 9.915 ( -2.235 0.781 -0.271) 2.382 10.750 ( -1.254 -4.053 9.101) 10.041 10.750 ( -1.254 4.053 9.101) 10.041 12.692 ( -1.737 -23.105 9.097) 24.892 12.692 ( -1.737 23.105 9.097) 24.892 14.700 ( 4.978 -37.457 -5.744) 38.220 14.700 ( 4.978 37.457 -5.744) 38.220 16.456 ( 9.658 -25.869 -4.779) 28.023 16.456 ( 9.658 25.869 -4.779) 28.023 18.711 ( 11.828 -7.629 -0.403) 14.081 18.711 ( 11.828 7.629 -0.403) 14.081 22.447 ( 1.403 -8.003 -3.403) 8.809 22.447 ( 1.403 8.003 -3.403) 8.809 22.756 ( -5.021 -1.359 2.019) 5.579 22.756 ( -5.021 1.359 2.019) 5.579 23.187 ( -1.668 -3.197 -0.389) 3.627 23.187 ( -1.668 3.197 -0.389) 3.627 24.448 ( -15.328 -8.868 3.247) 18.004 24.448 ( -15.328 8.868 3.247) 18.004 ======================= Grid point 231 (117/136) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.412 ( 0.000 0.000 -0.000) 0.000 1.430 ( -0.000 0.000 0.000) 0.000 1.596 ( 0.000 0.000 -0.000) 0.000 1.789 ( 0.000 0.000 0.000) 0.000 2.105 ( 0.000 0.000 0.000) 0.000 2.258 ( -0.000 0.000 0.000) 0.000 2.296 ( 0.000 0.000 0.000) 0.000 2.625 ( -0.000 0.000 0.000) 0.000 2.682 ( 0.000 0.000 0.000) 0.000 2.753 ( -0.000 0.000 0.000) 0.000 2.798 ( -0.000 0.000 0.000) 0.000 2.862 ( 0.000 0.000 0.000) 0.000 3.322 ( 0.000 0.000 0.000) 0.000 3.501 ( 0.000 0.000 -0.000) 0.000 3.502 ( 0.000 0.000 0.000) 0.000 3.609 ( 0.000 0.000 0.000) 0.000 3.797 ( -0.000 0.000 0.000) 0.000 3.966 ( -0.000 0.000 0.000) 0.000 4.037 ( 0.000 0.000 -0.000) 0.000 4.161 ( 0.000 0.000 0.000) 0.000 4.187 ( -0.000 0.000 0.000) 0.000 4.601 ( 0.000 0.000 -0.000) 0.000 4.604 ( -0.000 0.000 0.000) 0.000 4.682 ( 0.000 0.000 0.000) 0.000 5.080 ( -0.000 0.000 0.000) 0.000 5.148 ( 0.000 0.000 -0.000) 0.000 5.396 ( 0.000 0.000 0.000) 0.000 5.416 ( 0.000 0.000 -0.000) 0.000 5.481 ( 0.000 0.000 0.000) 0.000 6.037 ( -0.000 0.000 -0.000) 0.000 6.085 ( 0.000 0.000 0.000) 0.000 6.689 ( 0.000 0.000 -0.000) 0.000 6.836 ( 0.000 0.000 0.000) 0.000 7.000 ( 0.000 0.000 0.000) 0.000 7.124 ( -0.000 0.000 0.000) 0.000 7.357 ( 0.000 0.000 0.000) 0.000 7.384 ( -0.000 0.000 0.000) 0.000 7.420 ( 0.000 0.000 0.000) 0.000 7.584 ( 0.000 0.000 0.000) 0.000 8.023 ( 0.000 0.000 0.000) 0.000 8.092 ( 0.000 0.000 0.000) 0.000 8.250 ( 0.000 0.000 0.000) 0.000 8.355 ( 0.000 0.000 0.000) 0.000 8.848 ( 0.000 0.000 0.000) 0.000 9.476 ( 0.000 0.000 0.000) 0.000 9.673 ( 0.000 0.000 0.000) 0.000 9.878 ( -0.000 0.000 0.000) 0.000 9.963 ( 0.000 0.000 0.000) 0.000 10.118 ( 0.000 0.000 -0.000) 0.000 10.237 ( 0.000 0.000 0.000) 0.000 12.080 ( 0.000 0.000 0.000) 0.000 12.967 ( -0.000 0.000 0.000) 0.000 14.306 ( 0.000 0.000 0.000) 0.000 14.653 ( 0.000 0.000 0.000) 0.000 17.158 ( 0.000 0.000 0.000) 0.000 17.928 ( 0.000 0.000 0.000) 0.000 18.088 ( -0.000 0.000 -0.000) 0.000 18.489 ( 0.000 0.000 0.000) 0.000 22.038 ( 0.000 0.000 0.000) 0.000 22.531 ( 0.000 0.000 0.000) 0.000 22.642 ( 0.000 0.000 0.000) 0.000 22.998 ( 0.000 0.000 0.000) 0.000 23.304 ( 0.000 0.000 0.000) 0.000 23.406 ( -0.000 0.000 0.000) 0.000 24.108 ( -0.000 0.000 0.000) 0.000 24.523 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 233 (118/136) ======================= q-point: ( 0.12 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.298 ( -11.730 0.000 12.757) 17.330 1.475 ( 6.515 0.000 -18.434) 19.552 1.601 ( 2.177 0.000 -4.266) 4.790 1.857 ( 4.178 0.000 5.931) 7.255 2.068 ( -4.500 0.000 7.426) 8.683 2.075 ( -7.473 0.000 1.868) 7.703 2.529 ( 7.392 0.000 3.215) 8.061 2.608 ( 2.418 0.000 0.902) 2.581 2.728 ( 3.091 0.000 0.199) 3.098 2.807 ( 1.882 0.000 -0.722) 2.016 2.831 ( 6.441 0.000 -2.791) 7.020 2.899 ( 3.592 0.000 0.568) 3.637 3.294 ( -2.511 0.000 -0.837) 2.647 3.488 ( 2.135 0.000 -8.107) 8.384 3.507 ( 0.962 0.000 -0.340) 1.021 3.654 ( 0.992 0.000 8.283) 8.342 3.782 ( -2.771 0.000 3.057) 4.126 3.952 ( -3.765 0.000 7.570) 8.454 4.073 ( 5.611 0.000 -7.061) 9.019 4.093 ( -1.832 0.000 -6.806) 7.048 4.227 ( 1.723 0.000 1.621) 2.366 4.554 ( 0.206 0.000 -7.716) 7.719 4.631 ( -2.565 0.000 7.757) 8.171 4.661 ( -1.686 0.000 -0.844) 1.886 5.045 ( -2.747 0.000 -0.664) 2.827 5.110 ( -2.083 0.000 -4.501) 4.960 5.410 ( 1.468 0.000 -3.805) 4.078 5.424 ( -4.121 0.000 -2.540) 4.841 5.478 ( 6.214 0.000 2.054) 6.545 6.022 ( 0.364 0.000 -3.589) 3.607 6.145 ( 1.795 0.000 7.456) 7.669 6.592 ( -10.702 0.000 6.829) 12.695 6.838 ( 1.813 0.000 -6.517) 6.764 6.936 ( -5.396 0.000 -6.396) 8.368 7.030 ( -2.818 0.000 -6.254) 6.859 7.372 ( -0.655 0.000 1.730) 1.850 7.396 ( -0.536 0.000 6.949) 6.970 7.503 ( 6.502 0.000 0.238) 6.507 7.658 ( 5.902 0.000 2.027) 6.240 8.015 ( -1.066 0.000 0.393) 1.136 8.061 ( -2.407 0.000 -0.369) 2.435 8.227 ( -1.647 0.000 -1.138) 2.003 8.385 ( 1.500 0.000 2.745) 3.129 8.856 ( 1.392 0.000 -1.735) 2.225 9.465 ( -1.157 0.000 0.234) 1.180 9.684 ( 0.434 0.000 1.939) 1.987 9.868 ( -0.268 0.000 -0.981) 1.017 9.992 ( 1.717 0.000 2.122) 2.729 10.101 ( -1.767 0.000 -0.023) 1.768 10.216 ( -1.764 0.000 -0.894) 1.978 12.078 ( -0.096 0.000 -0.476) 0.486 12.919 ( -3.703 0.000 -1.406) 3.961 14.210 ( -13.481 0.000 11.940) 18.008 14.653 ( 0.022 0.000 -0.023) 0.032 17.158 ( -0.034 0.000 0.053) 0.063 17.286 ( -27.996 0.000 -8.552) 29.273 18.353 ( -13.426 0.000 1.120) 13.472 18.628 ( 8.418 0.000 19.674) 21.399 22.015 ( -4.277 0.000 1.368) 4.490 22.648 ( 11.499 0.000 -0.995) 11.542 22.726 ( 9.745 0.000 3.907) 10.499 22.948 ( -2.025 0.000 -7.433) 7.704 23.156 ( -12.975 0.000 -5.555) 14.114 23.308 ( 0.395 0.000 -0.110) 0.410 24.113 ( 7.301 0.000 -0.547) 7.322 24.928 ( 27.874 0.000 -3.549) 28.099 ======================= Grid point 234 (119/136) ======================= q-point: ( 0.25 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.167 ( -7.401 0.000 2.549) 7.828 1.404 ( -1.521 0.000 -12.092) 12.187 1.611 ( 2.342 0.000 -5.216) 5.718 1.998 ( 4.029 0.000 2.784) 4.898 2.043 ( 1.448 0.000 10.851) 10.947 2.106 ( 1.838 0.000 11.666) 11.810 2.541 ( -1.087 0.000 0.214) 1.108 2.772 ( 5.772 0.000 2.317) 6.220 2.782 ( 2.678 0.000 -0.358) 2.702 2.841 ( 1.913 0.000 0.336) 1.942 2.906 ( 3.443 0.000 -6.518) 7.372 2.992 ( 4.748 0.000 1.152) 4.885 3.225 ( -3.342 0.000 -1.180) 3.544 3.475 ( 2.985 0.000 -8.766) 9.260 3.551 ( 3.976 0.000 -0.470) 4.004 3.734 ( -3.230 0.000 0.129) 3.233 3.756 ( 0.779 0.000 13.926) 13.948 3.941 ( -2.999 0.000 7.442) 8.024 4.022 ( -0.311 0.000 -6.004) 6.012 4.127 ( 4.645 0.000 -6.481) 7.974 4.282 ( 3.323 0.000 0.784) 3.414 4.475 ( -2.238 0.000 -10.527) 10.762 4.616 ( -1.892 0.000 -0.756) 2.038 4.622 ( -3.819 0.000 7.508) 8.424 4.970 ( -3.966 0.000 -2.852) 4.885 5.051 ( 0.646 0.000 -3.674) 3.730 5.314 ( -4.710 0.000 -2.995) 5.582 5.389 ( -0.872 0.000 -3.605) 3.709 5.647 ( 9.457 0.000 -0.228) 9.460 6.005 ( 0.555 0.000 -3.266) 3.313 6.222 ( -0.773 0.000 9.237) 9.269 6.427 ( -11.287 0.000 8.142) 13.917 6.740 ( -5.641 0.000 -13.145) 14.304 6.810 ( 0.573 0.000 -6.314) 6.340 6.960 ( -2.512 0.000 -0.667) 2.599 7.379 ( -0.262 0.000 1.722) 1.742 7.433 ( 0.639 0.000 4.081) 4.131 7.639 ( 6.541 0.000 0.669) 6.575 7.794 ( 5.323 0.000 3.299) 6.263 7.983 ( -2.634 0.000 0.547) 2.690 8.018 ( -1.684 0.000 0.246) 1.702 8.187 ( -1.102 0.000 -1.591) 1.935 8.432 ( 0.641 0.000 3.862) 3.915 8.873 ( 2.071 0.000 -2.939) 3.595 9.439 ( -1.699 0.000 0.439) 1.754 9.719 ( 1.269 0.000 2.894) 3.160 9.860 ( 0.040 0.000 -0.534) 0.536 10.044 ( 1.755 0.000 2.021) 2.677 10.052 ( -3.133 0.000 -0.159) 3.137 10.160 ( -2.957 0.000 -1.365) 3.257 12.071 ( -0.152 0.000 -0.688) 0.704 12.846 ( -2.237 0.000 0.293) 2.256 14.007 ( -17.272 0.000 16.072) 23.593 14.654 ( 0.030 0.000 -0.029) 0.042 16.829 ( -15.117 0.000 -1.486) 15.190 17.159 ( 0.062 0.000 0.071) 0.094 18.048 ( -17.396 0.000 1.324) 17.446 18.453 ( -31.298 0.000 -1.374) 31.329 21.894 ( -6.324 0.000 -0.502) 6.343 22.846 ( -0.172 0.000 -5.310) 5.313 22.906 ( 14.548 0.000 -1.142) 14.592 23.002 ( -2.755 0.000 -1.290) 3.042 23.195 ( 27.340 0.000 15.165) 31.264 23.316 ( 0.447 0.000 -0.195) 0.488 24.334 ( 13.955 0.000 0.377) 13.960 25.331 ( 17.795 0.000 -10.432) 20.628 ======================= Grid point 235 (120/136) ======================= q-point: ( 0.38 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.055 ( -2.987 0.000 -5.066) 5.881 1.281 ( -4.272 0.000 -3.313) 5.406 1.619 ( 1.741 0.000 -3.351) 3.777 2.055 ( 1.266 0.000 2.762) 3.038 2.225 ( 6.222 0.000 9.199) 11.106 2.308 ( 8.779 0.000 13.632) 16.214 2.533 ( 0.191 0.000 0.114) 0.222 2.803 ( 0.015 0.000 -0.882) 0.882 2.833 ( 0.448 0.000 -0.931) 1.033 2.835 ( -3.704 0.000 -9.731) 10.412 2.885 ( 1.296 0.000 -0.174) 1.307 3.079 ( 2.811 0.000 1.544) 3.207 3.167 ( -1.832 0.000 -0.284) 1.854 3.474 ( 2.637 0.000 -6.444) 6.963 3.630 ( 3.828 0.000 -0.882) 3.929 3.666 ( -4.080 0.000 2.187) 4.629 3.886 ( 3.020 0.000 10.774) 11.189 3.945 ( -1.257 0.000 4.493) 4.665 3.995 ( 0.448 0.000 -2.267) 2.310 4.145 ( 1.110 0.000 -3.715) 3.877 4.287 ( -6.166 0.000 -6.337) 8.841 4.394 ( 6.315 0.000 -6.424) 9.009 4.598 ( 0.337 0.000 0.267) 0.429 4.613 ( -2.160 0.000 7.375) 7.685 4.846 ( -5.710 0.000 -4.830) 7.479 5.098 ( 5.257 0.000 -0.809) 5.319 5.211 ( -3.604 0.000 -2.210) 4.227 5.324 ( -3.704 0.000 -2.025) 4.221 5.806 ( 7.265 0.000 -2.210) 7.593 5.996 ( 0.760 0.000 -2.568) 2.678 6.253 ( -2.501 0.000 9.144) 9.480 6.296 ( -7.546 0.000 6.655) 10.062 6.559 ( -3.165 0.000 -11.281) 11.716 6.782 ( 0.497 0.000 -3.715) 3.748 6.917 ( -1.561 0.000 -0.205) 1.574 7.383 ( -0.311 0.000 1.021) 1.067 7.486 ( 2.110 0.000 2.278) 3.105 7.747 ( 3.918 0.000 0.392) 3.938 7.894 ( 2.546 0.000 2.538) 3.595 7.928 ( -2.748 0.000 -0.045) 2.748 8.004 ( -0.280 0.000 0.813) 0.859 8.167 ( -0.063 0.000 -1.136) 1.137 8.465 ( 0.090 0.000 3.050) 3.051 8.888 ( 1.465 0.000 -2.627) 3.008 9.412 ( -1.216 0.000 0.292) 1.250 9.767 ( 1.347 0.000 2.363) 2.721 9.860 ( 0.136 0.000 -0.140) 0.195 9.991 ( -2.523 0.000 -0.229) 2.534 10.082 ( 0.979 0.000 1.115) 1.484 10.091 ( -2.806 0.000 -1.176) 3.043 12.063 ( -0.121 0.000 -0.498) 0.512 12.856 ( 2.075 0.000 1.680) 2.670 13.804 ( -13.303 0.000 11.144) 17.354 14.654 ( 0.021 0.000 -0.017) 0.027 16.695 ( 0.127 0.000 5.921) 5.922 17.162 ( 0.244 0.000 0.042) 0.248 17.664 ( -35.956 0.000 -17.223) 39.868 17.762 ( -11.658 0.000 0.798) 11.685 21.807 ( -2.658 0.000 0.098) 2.660 22.829 ( 0.805 0.000 -2.228) 2.369 22.964 ( -1.000 0.000 -0.022) 1.000 23.145 ( 9.897 0.000 -0.612) 9.916 23.318 ( -0.228 0.000 -0.216) 0.314 23.820 ( 19.689 0.000 15.508) 25.063 24.630 ( 14.066 0.000 5.158) 14.982 25.453 ( 4.583 0.000 -13.572) 14.325 ======================= Grid point 236 (121/136) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.001 ( -0.000 0.000 -0.000) 0.000 1.223 ( -0.000 0.000 0.000) 0.000 1.625 ( -0.000 0.000 -0.000) 0.000 2.079 ( -0.000 0.000 -0.000) 0.000 2.336 ( -0.000 0.000 0.000) 0.000 2.543 ( -0.000 0.000 0.000) 0.000 2.562 ( -0.000 0.000 -0.000) 0.000 2.648 ( -0.000 0.000 0.000) 0.000 2.780 ( 0.000 0.000 0.000) 0.000 2.831 ( -0.000 0.000 -0.000) 0.000 2.901 ( -0.000 0.000 0.000) 0.000 3.113 ( -0.000 0.000 -0.000) 0.000 3.149 ( -0.000 0.000 -0.000) 0.000 3.477 ( 0.000 0.000 -0.000) 0.000 3.630 ( -0.000 0.000 -0.000) 0.000 3.665 ( -0.000 0.000 -0.000) 0.000 3.950 ( -0.000 0.000 -0.000) 0.000 3.976 ( -0.000 0.000 0.000) 0.000 4.011 ( -0.000 0.000 0.000) 0.000 4.137 ( -0.000 0.000 0.000) 0.000 4.150 ( -0.000 0.000 -0.000) 0.000 4.453 ( -0.000 0.000 0.000) 0.000 4.610 ( -0.000 0.000 -0.000) 0.000 4.654 ( -0.000 0.000 -0.000) 0.000 4.725 ( -0.000 0.000 0.000) 0.000 5.163 ( -0.000 0.000 0.000) 0.000 5.192 ( -0.000 0.000 0.000) 0.000 5.239 ( 0.000 0.000 -0.000) 0.000 5.872 ( -0.000 0.000 -0.000) 0.000 5.994 ( -0.000 0.000 -0.000) 0.000 6.245 ( -0.000 0.000 -0.000) 0.000 6.265 ( -0.000 0.000 0.000) 0.000 6.480 ( -0.000 0.000 -0.000) 0.000 6.774 ( -0.000 0.000 0.000) 0.000 6.900 ( -0.000 0.000 -0.000) 0.000 7.383 ( -0.000 0.000 0.000) 0.000 7.522 ( -0.000 0.000 -0.000) 0.000 7.788 ( -0.000 0.000 0.000) 0.000 7.894 ( -0.000 0.000 0.000) 0.000 7.930 ( -0.000 0.000 -0.000) 0.000 8.007 ( -0.000 0.000 0.000) 0.000 8.163 ( -0.000 0.000 0.000) 0.000 8.478 ( -0.000 0.000 -0.000) 0.000 8.892 ( -0.000 0.000 0.000) 0.000 9.401 ( -0.000 0.000 -0.000) 0.000 9.791 ( -0.000 0.000 0.000) 0.000 9.861 ( -0.000 0.000 0.000) 0.000 9.966 ( -0.000 0.000 0.000) 0.000 10.054 ( -0.000 0.000 -0.000) 0.000 10.096 ( -0.000 0.000 -0.000) 0.000 12.060 ( -0.000 0.000 0.000) 0.000 12.898 ( -0.000 0.000 0.000) 0.000 13.703 ( -0.000 0.000 -0.000) 0.000 14.654 ( -0.000 0.000 0.000) 0.000 16.877 ( -0.000 0.000 -0.000) 0.000 17.067 ( 0.000 0.000 0.000) 0.000 17.166 ( -0.000 0.000 0.000) 0.000 17.647 ( -0.000 0.000 0.000) 0.000 21.783 ( -0.000 0.000 -0.000) 0.000 22.830 ( -0.000 0.000 -0.000) 0.000 22.955 ( -0.000 0.000 0.000) 0.000 23.252 ( -0.000 0.000 -0.000) 0.000 23.304 ( -0.000 0.000 -0.000) 0.000 24.069 ( -0.000 0.000 -0.000) 0.000 24.841 ( -0.000 0.000 -0.000) 0.000 25.404 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 241 (122/136) ======================= q-point: ( 0.00 0.17 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.433 ( 0.000 0.305 -0.000) 0.305 1.461 ( -0.000 3.515 0.000) 3.515 1.587 ( 0.000 0.096 0.000) 0.096 1.841 ( 0.000 3.703 0.000) 3.703 2.035 ( -0.000 -1.089 0.000) 1.089 2.238 ( 0.000 -2.151 0.000) 2.151 2.423 ( 0.000 6.321 0.000) 6.321 2.572 ( 0.000 -7.495 0.000) 7.495 2.614 ( -0.000 -4.581 0.000) 4.581 2.695 ( -0.000 -3.428 0.000) 3.428 2.776 ( -0.000 0.946 0.000) 0.946 2.926 ( 0.000 3.486 0.000) 3.486 3.406 ( -0.000 3.503 0.000) 3.503 3.515 ( 0.000 1.128 -0.000) 1.128 3.518 ( -0.000 2.330 -0.000) 2.330 3.585 ( -0.000 -2.157 0.000) 2.157 3.807 ( -0.000 3.427 0.000) 3.427 3.953 ( -0.000 0.210 0.000) 0.210 3.999 ( 0.000 -1.471 -0.000) 1.471 4.209 ( 0.000 2.716 0.000) 2.716 4.241 ( -0.000 3.785 0.000) 3.785 4.594 ( 0.000 -1.082 -0.000) 1.082 4.598 ( -0.000 -0.648 0.000) 0.648 4.642 ( 0.000 -3.543 0.000) 3.543 5.031 ( 0.000 -0.081 0.000) 0.081 5.091 ( 0.000 -3.985 -0.000) 3.985 5.356 ( 0.000 -3.600 0.000) 3.600 5.363 ( -0.000 -5.379 -0.000) 5.379 5.634 ( 0.000 7.978 0.000) 7.978 5.826 ( 0.000 -13.614 0.000) 13.614 6.011 ( 0.000 -7.678 -0.000) 7.678 6.632 ( -0.000 -3.158 0.000) 3.158 6.766 ( -0.000 -2.433 0.000) 2.433 7.037 ( 0.000 -2.572 0.000) 2.572 7.149 ( 0.000 -12.763 0.000) 12.763 7.369 ( 0.000 15.208 0.000) 15.208 7.429 ( 0.000 0.559 0.000) 0.559 7.470 ( 0.000 7.463 0.000) 7.463 7.629 ( 0.000 4.322 0.000) 4.322 7.832 ( 0.000 -9.148 0.000) 9.148 8.022 ( 0.000 -7.446 0.000) 7.446 8.241 ( 0.000 5.621 0.000) 5.621 8.611 ( 0.000 9.607 0.000) 9.607 8.795 ( 0.000 -4.457 0.000) 4.457 9.497 ( 0.000 1.186 0.000) 1.186 9.633 ( -0.000 -2.441 0.000) 2.441 9.875 ( 0.000 -0.218 0.000) 0.218 9.964 ( 0.000 -1.472 0.000) 1.472 10.295 ( 0.000 15.256 0.000) 15.256 10.400 ( 0.000 14.391 0.000) 14.391 12.184 ( 0.000 7.670 0.000) 7.670 13.174 ( 0.000 20.252 0.000) 20.252 13.966 ( 0.000 -22.858 0.000) 22.858 15.013 ( 0.000 23.740 0.000) 23.740 16.633 ( 0.000 -37.056 0.000) 37.056 17.696 ( 0.000 -19.391 0.000) 19.391 18.389 ( 0.000 17.443 0.000) 17.443 18.571 ( -0.000 5.673 -0.000) 5.673 22.080 ( -0.000 3.561 0.000) 3.561 22.576 ( 0.000 4.365 0.000) 4.365 22.581 ( -0.000 -5.302 -0.000) 5.302 23.033 ( 0.000 3.062 0.000) 3.062 23.261 ( 0.000 -3.873 0.000) 3.873 23.378 ( -0.000 -2.646 0.000) 2.646 24.123 ( -0.000 1.554 0.000) 1.554 24.483 ( 0.000 -3.572 0.000) 3.572 ======================= Grid point 243 (123/136) ======================= q-point: ( 0.12 0.17 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.313 ( -12.141 1.125 12.581) 17.520 1.507 ( 5.746 1.795 -14.262) 15.480 1.565 ( -1.203 -3.308 -0.429) 3.546 1.870 ( -4.197 3.159 7.867) 9.460 1.942 ( 1.429 0.788 -5.089) 5.344 2.364 ( 0.593 12.554 5.357) 13.662 2.443 ( 7.262 -7.059 2.401) 10.408 2.544 ( -0.484 -7.490 -1.373) 7.631 2.656 ( 2.410 -4.628 0.273) 5.225 2.703 ( 0.739 -5.615 -0.130) 5.665 2.875 ( 7.416 2.425 0.877) 7.851 2.953 ( 2.557 3.077 0.557) 4.039 3.369 ( -3.338 3.690 0.051) 4.976 3.474 ( -0.864 0.090 -3.597) 3.700 3.563 ( 3.955 3.725 -2.648) 6.044 3.630 ( 4.471 -2.201 -1.052) 5.093 3.802 ( -3.332 4.456 7.369) 9.233 3.940 ( -2.460 -0.386 4.148) 4.838 4.009 ( 1.299 -1.377 -2.168) 2.878 4.192 ( 0.390 3.730 -4.295) 5.702 4.259 ( 2.134 2.964 -0.959) 3.776 4.548 ( -1.036 -1.040 -4.460) 4.695 4.612 ( -2.625 -1.140 5.652) 6.335 4.648 ( 1.308 -1.570 -1.548) 2.564 4.980 ( -2.294 -2.025 -6.815) 7.471 5.075 ( -3.130 -1.284 3.251) 4.692 5.333 ( -0.476 -7.426 -2.011) 7.708 5.441 ( 5.763 -2.463 2.796) 6.863 5.598 ( -1.424 8.980 -5.205) 10.476 5.807 ( -0.661 -14.361 -1.895) 14.501 6.050 ( 0.576 -8.844 6.129) 10.776 6.584 ( -5.495 -0.557 2.799) 6.192 6.694 ( -3.696 -3.815 -8.437) 9.970 7.026 ( -1.493 -2.899 1.778) 3.714 7.123 ( -1.543 -11.071 -2.155) 11.383 7.302 ( -2.154 15.091 -5.636) 16.252 7.474 ( 1.605 2.840 4.488) 5.548 7.539 ( 3.287 5.425 4.465) 7.757 7.687 ( 5.157 2.725 1.283) 5.972 7.833 ( -0.102 -8.548 0.389) 8.557 8.032 ( 1.098 -6.969 -0.133) 7.057 8.204 ( -3.474 4.645 -0.387) 5.813 8.593 ( -1.598 8.349 -0.086) 8.500 8.802 ( 1.406 -4.507 -1.949) 5.108 9.485 ( -1.308 1.164 0.633) 1.862 9.658 ( 1.833 -1.531 1.394) 2.765 9.900 ( 1.551 0.959 0.547) 1.904 9.964 ( -0.088 -2.208 1.336) 2.582 10.272 ( -2.385 14.740 0.310) 14.935 10.381 ( -1.516 14.481 -1.050) 14.598 12.183 ( 0.050 7.775 -0.352) 7.783 13.107 ( -5.081 18.124 -2.342) 18.968 13.923 ( -7.765 -19.733 9.157) 23.098 14.975 ( -4.435 22.541 2.835) 23.148 16.565 ( -6.354 -36.278 -1.477) 36.860 17.369 ( -18.018 -8.048 -4.327) 20.203 18.398 ( -12.308 5.279 1.522) 13.478 18.704 ( 3.501 4.455 14.770) 15.819 22.067 ( -3.851 4.719 1.275) 6.223 22.628 ( 10.036 -2.273 -0.519) 10.303 22.721 ( 11.160 0.049 2.834) 11.514 22.950 ( -5.594 -0.275 -6.823) 8.827 23.149 ( -10.206 -0.469 -4.953) 11.354 23.284 ( 1.205 -1.869 0.025) 2.224 24.161 ( 8.715 4.393 -0.530) 9.774 24.862 ( 26.495 -5.843 -2.781) 27.274 ======================= Grid point 244 (124/136) ======================= q-point: ( 0.25 0.17 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.180 ( -7.627 1.058 4.549) 8.944 1.447 ( -1.194 4.442 -12.557) 13.373 1.600 ( 2.551 -9.273 7.534) 12.217 1.819 ( -1.393 2.661 1.782) 3.493 2.009 ( 2.929 0.162 2.142) 3.632 2.413 ( 2.328 10.034 4.413) 11.206 2.533 ( 0.256 -3.804 -0.463) 3.841 2.618 ( 5.814 -6.507 2.410) 9.053 2.699 ( 1.631 -4.306 0.747) 4.665 2.726 ( 1.715 -8.354 0.075) 8.528 2.994 ( 3.578 3.806 -0.501) 5.248 3.025 ( 4.018 1.652 0.919) 4.441 3.293 ( -4.345 4.287 0.286) 6.110 3.434 ( 0.279 -1.449 -5.642) 5.832 3.637 ( 5.455 5.168 -2.531) 7.929 3.719 ( 7.257 -1.970 -8.562) 11.396 3.798 ( -5.458 6.521 17.025) 19.030 3.933 ( -0.990 -0.686 3.804) 3.990 4.009 ( 0.157 -0.472 -1.101) 1.208 4.173 ( 1.101 2.860 -4.953) 5.824 4.310 ( 3.648 2.395 -0.804) 4.437 4.479 ( -2.768 -0.408 -5.815) 6.454 4.588 ( -2.907 -0.043 2.516) 3.845 4.662 ( -0.004 1.653 1.632) 2.323 4.877 ( -2.193 -4.538 -7.004) 8.629 5.027 ( -3.106 0.205 2.719) 4.133 5.305 ( -1.391 -7.759 -0.781) 7.922 5.500 ( -2.588 9.463 -7.025) 12.067 5.619 ( 9.307 -2.422 -0.243) 9.620 5.784 ( -0.493 -14.976 -0.989) 15.016 6.084 ( -3.074 -10.242 8.589) 13.716 6.489 ( -5.853 2.754 2.972) 7.119 6.536 ( -4.311 -4.231 -11.006) 12.555 7.013 ( -1.060 -0.786 1.546) 2.033 7.075 ( -0.858 -11.346 -3.672) 11.956 7.231 ( -2.568 16.072 -1.371) 16.333 7.522 ( 0.607 4.755 4.204) 6.376 7.655 ( 5.745 1.590 1.501) 6.147 7.807 ( 4.507 0.811 3.218) 5.597 7.832 ( -0.097 -7.089 0.391) 7.100 8.057 ( 1.569 -5.379 -0.793) 5.659 8.119 ( -4.619 2.298 0.230) 5.164 8.559 ( -1.758 5.744 0.330) 6.016 8.817 ( 1.946 -4.818 -3.011) 6.005 9.462 ( -1.573 1.646 1.000) 2.487 9.714 ( 2.538 -0.393 1.852) 3.167 9.908 ( -0.918 0.927 0.241) 1.326 10.002 ( 2.137 -1.423 2.337) 3.472 10.216 ( -3.346 13.999 0.367) 14.398 10.330 ( -2.692 14.645 -1.516) 14.968 12.181 ( 0.068 8.080 -0.494) 8.096 13.001 ( -3.510 14.781 0.055) 15.192 13.806 ( -12.230 -14.397 12.107) 22.437 14.909 ( -4.180 19.736 3.084) 20.408 16.400 ( -8.087 -31.760 -0.689) 32.781 17.107 ( -8.271 -10.034 -0.047) 13.004 18.092 ( -18.086 5.003 0.407) 18.769 18.509 ( -27.543 2.828 -1.532) 27.730 21.953 ( -6.125 5.410 -0.530) 8.189 22.746 ( -0.508 -7.325 -3.987) 8.355 22.939 ( 12.247 1.570 -1.955) 12.501 23.030 ( -0.357 2.212 -1.605) 2.756 23.176 ( 25.776 -1.553 14.444) 29.588 23.311 ( 1.644 -0.554 0.213) 1.748 24.393 ( 13.841 5.448 -0.325) 14.878 25.256 ( 17.286 -6.833 -9.377) 20.819 ======================= Grid point 245 (125/136) ======================= q-point: ( 0.38 0.17 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.096 ( -1.500 3.578 -3.127) 4.983 1.316 ( -5.001 3.707 -3.919) 7.356 1.713 ( 3.554 2.383 0.566) 4.317 1.898 ( 5.582 -9.370 10.912) 15.428 2.058 ( 0.743 -1.752 1.578) 2.472 2.436 ( -1.742 -10.539 -5.330) 11.938 2.569 ( 2.334 5.425 2.830) 6.549 2.698 ( 1.564 3.644 2.950) 4.943 2.736 ( 1.829 -8.080 0.529) 8.301 2.766 ( 1.555 -6.100 1.148) 6.399 3.015 ( 0.112 4.786 -1.680) 5.074 3.092 ( 2.201 1.815 -0.106) 2.855 3.221 ( -2.828 4.231 0.227) 5.094 3.403 ( 0.091 -3.003 -3.826) 4.865 3.705 ( 3.998 5.970 -6.662) 9.798 3.755 ( 0.365 5.132 2.385) 5.671 3.871 ( 1.494 -0.824 10.571) 10.707 3.952 ( -0.001 0.050 1.434) 1.435 4.023 ( 2.248 2.391 0.590) 3.335 4.148 ( -1.150 1.145 -3.065) 3.469 4.329 ( -5.248 3.725 -5.058) 8.185 4.396 ( 4.597 0.122 -5.057) 6.835 4.558 ( -1.814 -1.253 3.453) 4.097 4.671 ( -1.068 3.140 3.245) 4.640 4.792 ( -2.683 -2.360 -3.921) 5.305 5.041 ( 3.263 -1.492 1.332) 3.827 5.269 ( -2.005 -5.806 0.436) 6.158 5.378 ( -4.193 7.013 -6.817) 10.641 5.744 ( 1.376 -9.193 -0.867) 9.335 5.815 ( 6.462 -8.032 -2.115) 10.523 6.063 ( -5.067 -10.307 8.623) 14.362 6.396 ( -2.965 -2.442 -6.285) 7.366 6.416 ( -2.700 3.457 -0.117) 4.388 7.002 ( -0.928 6.541 0.415) 6.620 7.049 ( 0.738 -19.205 -2.696) 19.408 7.181 ( -2.358 18.500 0.732) 18.664 7.574 ( 2.108 3.937 2.519) 5.128 7.759 ( 3.706 0.863 0.777) 3.883 7.818 ( -1.211 -6.753 0.216) 6.864 7.902 ( 2.547 0.520 2.165) 3.383 8.033 ( -2.494 0.169 -0.556) 2.561 8.090 ( 0.758 -4.099 0.386) 4.186 8.536 ( -0.910 3.462 0.589) 3.628 8.831 ( 1.451 -4.966 -2.417) 5.711 9.441 ( -1.103 2.198 0.634) 2.540 9.771 ( 1.874 -0.134 1.294) 2.281 9.884 ( -1.512 -0.271 0.348) 1.575 10.056 ( 1.749 -0.211 1.503) 2.316 10.161 ( -2.244 14.277 0.399) 14.458 10.266 ( -2.457 14.926 -1.309) 15.183 12.179 ( 0.031 8.456 -0.350) 8.463 13.002 ( 2.505 14.199 2.048) 14.563 13.639 ( -12.048 -12.608 8.229) 19.283 14.866 ( -2.119 17.346 1.830) 17.570 16.308 ( -1.315 -30.460 2.300) 30.575 16.987 ( -5.726 -15.093 0.444) 16.149 17.744 ( -17.599 6.605 -5.007) 19.453 17.897 ( -21.445 7.777 -7.530) 24.022 21.863 ( -2.895 5.031 -0.175) 5.807 22.721 ( 0.075 -9.169 -1.386) 9.273 22.996 ( -0.117 2.860 -1.150) 3.084 23.180 ( 8.802 2.437 0.112) 9.134 23.338 ( 1.804 1.891 0.474) 2.656 23.788 ( 20.014 -2.982 14.866) 25.109 24.661 ( 12.407 3.112 3.180) 13.181 25.381 ( 4.575 -6.472 -12.377) 14.698 ======================= Grid point 246 (126/136) ======================= q-point: ( 0.50 0.17 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.073 ( -0.000 6.779 -0.000) 6.779 1.243 ( -0.000 1.813 0.000) 1.813 1.744 ( -0.000 7.466 -0.000) 7.466 2.064 ( -0.000 -13.716 -0.000) 13.716 2.065 ( 0.000 -1.686 0.000) 1.686 2.346 ( -0.000 -17.559 -0.000) 17.559 2.602 ( -0.000 5.244 0.000) 5.244 2.727 ( -0.000 -1.567 -0.000) 1.567 2.764 ( -0.000 -9.569 0.000) 9.569 2.794 ( -0.000 4.208 0.000) 4.208 3.002 ( -0.000 6.901 0.000) 6.901 3.110 ( -0.000 1.517 -0.000) 1.517 3.194 ( -0.000 3.901 -0.000) 3.901 3.388 ( -0.000 -3.820 -0.000) 3.820 3.710 ( 0.000 7.891 -0.000) 7.891 3.773 ( -0.000 4.234 0.000) 4.234 3.948 ( -0.000 -0.663 -0.000) 0.663 3.959 ( -0.000 -1.412 0.000) 1.412 4.071 ( -0.000 6.547 0.000) 6.547 4.099 ( -0.000 -3.063 -0.000) 3.063 4.224 ( -0.000 6.320 -0.000) 6.320 4.442 ( -0.000 -0.666 0.000) 0.666 4.563 ( -0.000 -2.984 -0.000) 2.984 4.658 ( -0.000 1.803 -0.000) 1.803 4.749 ( -0.000 1.505 0.000) 1.505 5.111 ( -0.000 -2.508 0.000) 2.508 5.242 ( 0.000 0.097 0.000) 0.097 5.289 ( -0.000 1.324 -0.000) 1.324 5.745 ( -0.000 -12.649 -0.000) 12.649 5.885 ( -0.000 -3.910 0.000) 3.910 6.040 ( -0.000 -10.926 0.000) 10.926 6.342 ( -0.000 -1.340 0.000) 1.340 6.389 ( -0.000 3.721 -0.000) 3.721 6.992 ( -0.000 8.035 -0.000) 8.035 7.050 ( -0.000 -23.329 -0.000) 23.329 7.158 ( -0.000 21.713 0.000) 21.713 7.613 ( -0.000 3.755 -0.000) 3.755 7.794 ( -0.000 -1.581 0.000) 1.581 7.805 ( -0.000 -4.069 0.000) 4.069 7.935 ( -0.000 0.333 0.000) 0.333 8.007 ( -0.000 -0.997 -0.000) 0.997 8.101 ( -0.000 -3.683 -0.000) 3.683 8.530 ( -0.000 2.544 -0.000) 2.544 8.836 ( -0.000 -4.902 0.000) 4.902 9.432 ( -0.000 2.395 -0.000) 2.395 9.796 ( -0.000 -0.255 0.000) 0.255 9.867 ( -0.000 -0.659 0.000) 0.659 10.081 ( -0.000 -1.250 -0.000) 1.250 10.141 ( -0.000 15.914 0.000) 15.914 10.233 ( -0.000 15.127 -0.000) 15.127 12.178 ( -0.000 8.625 0.000) 8.625 13.060 ( -0.000 16.711 0.000) 16.711 13.528 ( -0.000 -14.846 -0.000) 14.846 14.853 ( -0.000 16.498 0.000) 16.498 16.334 ( -0.000 -34.437 -0.000) 34.437 16.901 ( -0.000 -14.231 0.000) 14.231 17.486 ( -0.000 14.654 0.000) 14.654 17.703 ( -0.000 3.998 0.000) 3.998 21.835 ( -0.000 4.714 -0.000) 4.714 22.718 ( -0.000 -9.594 -0.000) 9.594 22.990 ( -0.000 3.138 0.000) 3.138 23.259 ( -0.000 0.078 -0.000) 0.078 23.370 ( -0.000 5.930 -0.000) 5.930 24.045 ( -0.000 -2.543 -0.000) 2.543 24.837 ( -0.000 0.125 -0.000) 0.125 25.340 ( -0.000 -5.708 0.000) 5.708 ======================= Grid point 251 (127/136) ======================= q-point: ( 0.00 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( 0.000 0.909 -0.000) 0.909 1.492 ( -0.000 -0.366 0.000) 0.366 1.676 ( -0.000 7.513 0.000) 7.513 1.890 ( 0.000 0.202 -0.000) 0.202 2.092 ( -0.000 5.423 0.000) 5.423 2.164 ( 0.000 -4.070 0.000) 4.070 2.325 ( 0.000 -10.696 0.000) 10.696 2.408 ( 0.000 -9.709 0.000) 9.709 2.606 ( 0.000 7.023 0.000) 7.023 2.744 ( -0.000 4.401 0.000) 4.401 2.800 ( 0.000 0.913 0.000) 0.913 2.957 ( 0.000 -1.244 0.000) 1.244 3.418 ( -0.000 0.446 0.000) 0.446 3.530 ( 0.000 -2.732 -0.000) 2.732 3.546 ( 0.000 1.407 -0.000) 1.407 3.567 ( -0.000 1.173 0.000) 1.173 3.933 ( -0.000 4.974 0.000) 4.974 3.997 ( 0.000 0.922 0.000) 0.922 4.056 ( -0.000 10.031 0.000) 10.031 4.249 ( 0.000 1.183 0.000) 1.183 4.311 ( -0.000 2.115 0.000) 2.115 4.531 ( -0.000 -4.562 0.000) 4.562 4.537 ( 0.000 -3.817 -0.000) 3.817 4.573 ( -0.000 -6.040 0.000) 6.040 5.057 ( 0.000 -0.547 0.000) 0.547 5.074 ( -0.000 4.225 0.000) 4.225 5.252 ( -0.000 -5.914 -0.000) 5.914 5.259 ( 0.000 2.396 0.000) 2.396 5.499 ( 0.000 -11.059 0.000) 11.059 5.763 ( 0.000 -14.221 -0.000) 14.221 5.885 ( 0.000 10.366 0.000) 10.366 6.519 ( -0.000 -14.130 0.000) 14.130 6.716 ( -0.000 -6.865 0.000) 6.865 6.734 ( 0.000 -1.199 -0.000) 1.199 7.209 ( 0.000 6.140 0.000) 6.140 7.415 ( 0.000 -2.338 0.000) 2.338 7.612 ( 0.000 5.302 -0.000) 5.302 7.634 ( 0.000 7.684 0.000) 7.684 7.704 ( 0.000 -1.744 0.000) 1.744 7.737 ( 0.000 3.254 0.000) 3.254 7.969 ( 0.000 3.294 0.000) 3.294 8.279 ( 0.000 -2.810 0.000) 2.810 8.705 ( 0.000 -2.358 0.000) 2.358 8.721 ( 0.000 1.418 0.000) 1.418 9.515 ( 0.000 0.802 0.000) 0.802 9.586 ( -0.000 -2.019 0.000) 2.019 9.870 ( 0.000 -0.139 0.000) 0.139 9.915 ( 0.000 -2.470 0.000) 2.470 10.649 ( 0.000 15.350 0.000) 15.350 10.745 ( 0.000 13.951 0.000) 13.951 12.382 ( -0.000 12.581 0.000) 12.581 13.404 ( 0.000 -28.781 0.000) 28.781 13.814 ( 0.000 37.188 0.000) 37.188 15.381 ( 0.000 -8.969 0.000) 8.969 15.993 ( 0.000 -2.092 0.000) 2.092 17.165 ( 0.000 -29.076 0.000) 29.076 18.661 ( 0.000 7.591 0.000) 7.591 18.682 ( -0.000 4.185 -0.000) 4.185 22.173 ( -0.000 4.955 0.000) 4.955 22.440 ( 0.000 -7.227 0.000) 7.227 22.722 ( 0.000 8.993 0.000) 8.993 23.116 ( -0.000 4.388 -0.000) 4.388 23.137 ( 0.000 -7.767 0.000) 7.767 23.302 ( -0.000 -4.094 0.000) 4.094 24.178 ( -0.000 3.513 0.000) 3.513 24.384 ( 0.000 -5.276 0.000) 5.276 ======================= Grid point 253 (128/136) ======================= q-point: ( 0.12 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( -12.130 1.381 10.895) 16.363 1.427 ( -8.572 -3.838 8.297) 12.532 1.667 ( 3.210 8.384 -12.487) 15.379 1.931 ( 2.883 -0.979 0.249) 3.055 2.017 ( -1.090 6.179 -6.309) 8.898 2.275 ( 4.687 -6.654 4.360) 9.234 2.312 ( 0.939 -11.368 -5.263) 12.562 2.446 ( 1.654 -9.374 3.485) 10.137 2.631 ( 3.388 10.791 2.648) 11.616 2.752 ( 0.383 5.561 0.536) 5.600 2.898 ( 6.224 -0.703 4.228) 7.557 2.974 ( 1.433 -1.710 0.507) 2.287 3.396 ( -1.601 0.877 -0.792) 1.990 3.489 ( -3.836 -0.239 2.643) 4.664 3.576 ( 3.661 -0.324 0.473) 3.705 3.643 ( 8.083 1.702 -7.354) 11.060 3.929 ( -1.366 3.256 2.599) 4.384 3.990 ( -2.358 1.819 4.445) 5.350 4.045 ( -0.796 9.388 -0.345) 9.428 4.240 ( 0.013 1.523 -1.812) 2.367 4.327 ( 2.199 2.375 -1.841) 3.724 4.489 ( -3.184 -3.699 2.285) 5.390 4.557 ( -0.440 -4.593 2.398) 5.200 4.618 ( 5.676 -3.884 -4.017) 7.965 4.976 ( -3.745 0.554 -4.740) 6.066 5.109 ( -3.255 2.730 -0.424) 4.270 5.135 ( -0.769 -3.944 -3.163) 5.114 5.388 ( 5.391 -1.215 5.306) 7.661 5.495 ( 0.426 -9.933 -1.914) 10.124 5.780 ( -1.077 -10.497 5.788) 12.035 5.861 ( -0.293 7.170 -4.628) 8.539 6.503 ( -0.976 -14.423 -1.804) 14.568 6.646 ( -3.163 -1.971 -8.450) 9.235 6.686 ( -6.204 -6.172 5.243) 10.201 7.219 ( 0.426 7.543 0.646) 7.583 7.461 ( 3.732 -1.766 0.882) 4.222 7.591 ( 0.212 7.931 -2.763) 8.401 7.667 ( -0.837 3.255 5.594) 6.526 7.719 ( 1.048 0.094 2.038) 2.294 7.762 ( 2.737 2.551 0.155) 3.745 7.970 ( 0.617 1.975 -1.087) 2.337 8.233 ( -3.824 -2.418 -1.630) 4.809 8.686 ( -2.447 0.853 -0.445) 2.629 8.706 ( 0.628 -2.880 -3.050) 4.241 9.509 ( -0.668 1.476 0.913) 1.860 9.618 ( 2.568 -2.409 0.585) 3.569 9.901 ( 1.887 -0.423 1.370) 2.370 9.916 ( -0.118 -1.848 1.646) 2.478 10.623 ( -2.664 15.428 0.343) 15.660 10.723 ( -1.862 13.706 -0.688) 13.849 12.379 ( -0.353 12.082 -0.020) 12.087 13.310 ( -7.900 -20.702 -0.761) 22.172 13.821 ( -1.810 30.343 4.679) 30.755 15.338 ( -4.284 -7.732 0.734) 8.870 15.924 ( -7.086 -4.122 1.634) 8.359 16.990 ( -13.944 -24.772 -0.348) 28.429 18.544 ( -11.651 7.142 0.722) 13.684 18.747 ( -3.227 -0.810 7.887) 8.560 22.206 ( -1.157 7.823 1.752) 8.100 22.538 ( 9.190 -6.018 1.757) 11.125 22.748 ( 6.790 2.500 -0.794) 7.279 22.911 ( -9.986 -3.482 -6.102) 12.210 23.156 ( -2.927 1.360 -2.983) 4.395 23.242 ( 1.483 -1.973 -0.270) 2.483 24.295 ( 12.580 7.844 -0.437) 14.832 24.695 ( 22.790 -9.263 -1.371) 24.638 ======================= Grid point 254 (129/136) ======================= q-point: ( 0.25 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.208 ( -7.791 1.546 8.328) 11.509 1.374 ( -3.729 -8.263 14.087) 16.752 1.601 ( -1.061 9.581 -11.483) 14.992 1.970 ( 2.612 2.342 -6.454) 7.346 1.979 ( 0.016 0.643 0.503) 0.817 2.273 ( -0.959 -10.845 -6.255) 12.556 2.383 ( 3.862 -8.935 3.347) 10.293 2.504 ( 1.257 -8.852 4.040) 9.811 2.749 ( 3.304 10.534 2.138) 11.245 2.780 ( 3.252 7.798 3.504) 9.147 3.010 ( 1.756 -2.435 0.102) 3.004 3.038 ( 4.567 -0.768 3.662) 5.904 3.353 ( -2.424 2.132 -0.137) 3.231 3.438 ( -1.805 0.737 -1.540) 2.485 3.674 ( 5.407 -0.074 1.787) 5.695 3.748 ( 7.740 2.603 -7.965) 11.408 3.920 ( -1.720 -0.130 3.407) 3.819 3.990 ( -0.927 2.131 5.845) 6.290 4.021 ( -1.893 9.030 0.653) 9.249 4.230 ( 0.545 2.608 -2.256) 3.492 4.363 ( 2.931 1.805 -2.118) 4.042 4.446 ( -2.553 -2.117 1.145) 3.508 4.562 ( -1.119 -3.124 3.004) 4.476 4.713 ( 6.165 -0.069 -2.336) 6.593 4.853 ( -3.781 1.256 -6.761) 7.848 4.999 ( -4.130 -6.271 -3.088) 8.119 5.124 ( -2.253 0.774 2.654) 3.566 5.451 ( -1.169 -9.843 -3.892) 10.649 5.571 ( 7.783 -0.954 2.648) 8.276 5.761 ( -3.077 6.418 0.374) 7.127 5.847 ( 0.032 -7.995 1.709) 8.176 6.455 ( -0.668 -12.318 -7.154) 14.261 6.515 ( -5.423 0.546 -1.930) 5.782 6.604 ( -4.458 -11.412 2.208) 12.450 7.225 ( -0.493 9.923 1.116) 9.998 7.536 ( 3.101 5.951 -1.467) 6.869 7.588 ( 0.099 1.678 2.275) 2.828 7.679 ( -0.851 1.179 3.193) 3.508 7.761 ( 2.138 2.318 0.585) 3.208 7.838 ( 3.252 0.927 2.854) 4.425 7.982 ( 1.473 -0.792 -1.121) 2.013 8.127 ( -5.367 -1.849 -1.493) 5.869 8.625 ( -2.432 1.015 -1.975) 3.293 8.700 ( 1.105 -5.000 -3.116) 5.994 9.505 ( -0.692 2.628 1.243) 2.989 9.676 ( 2.597 -3.506 0.506) 4.393 9.908 ( -0.848 0.385 1.557) 1.814 9.972 ( 2.440 -1.589 2.493) 3.833 10.565 ( -3.303 15.625 0.753) 15.988 10.670 ( -2.830 13.481 -0.898) 13.805 12.371 ( -0.398 10.991 0.075) 10.998 13.159 ( -6.882 -14.088 2.602) 15.894 13.790 ( -5.029 26.088 4.696) 26.980 15.252 ( -4.780 -5.856 1.562) 7.719 15.781 ( -8.211 -7.190 2.594) 11.218 16.739 ( -11.661 -22.709 2.025) 25.609 18.238 ( -18.394 7.683 -1.424) 19.985 18.509 ( -22.859 -3.039 -2.237) 23.168 22.114 ( -6.207 9.219 -1.019) 11.161 22.557 ( -4.534 -9.998 -3.559) 11.541 22.971 ( 14.316 1.624 0.425) 14.414 23.058 ( 11.465 -0.826 1.650) 11.613 23.165 ( 13.187 1.753 8.062) 15.556 23.286 ( 3.245 -1.882 0.869) 3.850 24.561 ( 13.953 9.907 -2.039) 17.233 25.057 ( 16.055 -11.164 -6.930) 20.746 ======================= Grid point 255 (130/136) ======================= q-point: ( 0.38 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 192 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.184 ( 0.908 4.317 3.764) 5.800 1.442 ( -3.854 3.851 -3.538) 6.496 1.519 ( 2.996 -6.242 9.608) 11.843 1.963 ( -2.113 -6.006 -0.596) 6.394 1.993 ( 4.030 3.756 -4.468) 7.093 2.182 ( -4.131 -7.071 -4.329) 9.263 2.470 ( 3.023 -9.872 1.153) 10.389 2.540 ( -0.509 -9.165 3.321) 9.761 2.780 ( 0.833 8.525 0.234) 8.569 2.902 ( 4.122 8.965 3.765) 10.561 3.034 ( 0.706 -1.609 -0.370) 1.796 3.122 ( 2.080 -0.785 2.093) 3.053 3.306 ( -2.281 3.656 0.263) 4.317 3.400 ( -0.236 1.780 -3.213) 3.681 3.793 ( 1.816 1.025 3.447) 4.028 3.814 ( 8.471 0.765 -8.554) 12.063 3.915 ( -1.965 -0.779 4.731) 5.181 3.984 ( -2.391 8.972 1.420) 9.393 4.031 ( 0.131 -1.420 3.331) 3.624 4.226 ( 0.264 4.461 -0.856) 4.550 4.393 ( 0.542 0.138 -3.281) 3.328 4.414 ( 0.500 1.506 -0.637) 1.710 4.550 ( -2.183 0.966 2.777) 3.662 4.755 ( -0.341 5.231 -0.741) 5.295 4.812 ( 2.440 1.767 -3.945) 4.963 4.920 ( -1.608 -12.155 -1.191) 12.319 5.114 ( 0.044 -1.622 3.656) 4.000 5.355 ( -5.039 -6.982 -4.889) 9.901 5.681 ( 0.476 2.479 -2.553) 3.590 5.753 ( 4.787 1.241 0.208) 4.950 5.855 ( -1.860 -6.842 4.462) 8.378 6.389 ( 1.225 -3.403 -9.833) 10.477 6.427 ( -4.761 -3.349 4.277) 7.223 6.555 ( -1.844 -16.366 0.895) 16.494 7.220 ( -0.690 11.361 0.871) 11.415 7.550 ( 0.277 12.580 -1.121) 12.633 7.627 ( 1.627 -3.186 1.844) 4.024 7.686 ( -0.573 -0.373 2.097) 2.206 7.806 ( 1.964 2.595 0.140) 3.258 7.908 ( 1.813 -0.349 2.120) 2.811 7.997 ( -0.161 -2.142 -1.530) 2.638 8.035 ( -2.272 -1.914 0.469) 3.007 8.576 ( -1.150 0.809 -1.535) 2.081 8.703 ( 1.092 -6.097 -2.224) 6.581 9.499 ( -0.628 3.436 0.779) 3.578 9.715 ( 1.074 -4.994 0.103) 5.109 9.903 ( -0.708 2.403 1.342) 2.842 10.024 ( 1.247 -2.277 1.417) 2.958 10.521 ( -1.714 15.807 0.980) 15.930 10.612 ( -2.177 13.860 -0.747) 14.050 12.366 ( -0.184 10.118 0.128) 10.121 13.108 ( -1.306 -16.312 4.196) 16.893 13.703 ( -5.964 29.996 2.263) 30.667 15.193 ( -2.506 -3.871 1.698) 4.915 15.676 ( -4.162 -10.872 2.173) 11.842 16.572 ( -7.291 -22.824 2.205) 24.061 17.886 ( -14.215 5.981 -3.482) 15.811 18.004 ( -20.066 1.823 -7.420) 21.471 22.012 ( -3.239 8.625 -0.876) 9.255 22.482 ( -1.411 -12.201 -1.455) 12.368 23.076 ( 0.728 4.289 -1.213) 4.516 23.208 ( 4.464 -0.467 0.096) 4.489 23.413 ( 9.471 5.278 3.776) 11.481 23.692 ( 19.461 -5.867 12.517) 23.871 24.773 ( 9.046 7.361 -0.993) 11.705 25.195 ( 4.934 -10.257 -9.308) 14.704 ======================= Grid point 256 (131/136) ======================= q-point: ( 0.50 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.275 ( -0.000 11.342 0.000) 11.342 1.299 ( -0.000 3.593 -0.000) 3.593 1.653 ( -0.000 -11.392 0.000) 11.392 1.907 ( -0.000 -15.409 -0.000) 15.409 2.051 ( -0.000 6.945 -0.000) 6.945 2.088 ( -0.000 -2.333 0.000) 2.333 2.505 ( -0.000 -10.534 -0.000) 10.534 2.544 ( -0.000 -9.342 0.000) 9.342 2.790 ( -0.000 8.894 0.000) 8.894 2.963 ( -0.000 7.883 -0.000) 7.883 3.036 ( -0.000 -1.237 0.000) 1.237 3.151 ( -0.000 -0.966 -0.000) 0.966 3.282 ( -0.000 4.268 0.000) 4.268 3.385 ( -0.000 2.519 0.000) 2.519 3.807 ( -0.000 0.538 -0.000) 0.538 3.901 ( 0.000 -0.542 -0.000) 0.542 3.933 ( -0.000 -0.650 0.000) 0.650 3.951 ( 0.000 9.914 -0.000) 9.914 4.020 ( -0.000 -3.857 -0.000) 3.857 4.230 ( 0.000 5.464 0.000) 5.464 4.371 ( -0.000 4.797 -0.000) 4.797 4.428 ( -0.000 -1.162 0.000) 1.162 4.538 ( -0.000 2.079 -0.000) 2.079 4.765 ( -0.000 7.813 -0.000) 7.813 4.794 ( -0.000 3.539 0.000) 3.539 4.911 ( -0.000 -16.464 -0.000) 16.464 5.193 ( -0.000 -5.125 0.000) 5.125 5.222 ( -0.000 -2.742 -0.000) 2.742 5.666 ( -0.000 3.854 -0.000) 3.854 5.822 ( -0.000 -8.287 0.000) 8.287 5.843 ( -0.000 0.558 -0.000) 0.558 6.368 ( 0.000 2.193 -0.000) 2.193 6.394 ( -0.000 -6.988 0.000) 6.988 6.541 ( -0.000 -18.078 0.000) 18.078 7.216 ( -0.000 11.804 -0.000) 11.804 7.547 ( -0.000 12.322 0.000) 12.322 7.660 ( -0.000 -5.714 0.000) 5.714 7.682 ( -0.000 2.794 -0.000) 2.794 7.826 ( -0.000 1.923 -0.000) 1.923 7.935 ( -0.000 -0.759 -0.000) 0.759 7.972 ( -0.000 -1.472 0.000) 1.472 8.032 ( -0.000 -2.842 -0.000) 2.842 8.559 ( -0.000 0.742 0.000) 0.742 8.706 ( -0.000 -6.423 0.000) 6.423 9.495 ( -0.000 3.681 -0.000) 3.681 9.724 ( -0.000 -5.591 0.000) 5.591 9.901 ( -0.000 3.194 -0.000) 3.194 10.041 ( -0.000 -2.535 -0.000) 2.535 10.510 ( -0.000 15.751 -0.000) 15.751 10.586 ( -0.000 14.298 0.000) 14.298 12.365 ( -0.000 9.844 0.000) 9.844 13.125 ( -0.000 -21.572 -0.000) 21.572 13.641 ( -0.000 35.821 -0.000) 35.821 15.176 ( -0.000 -2.458 0.000) 2.458 15.647 ( -0.000 -13.804 0.000) 13.804 16.503 ( -0.000 -22.159 0.000) 22.159 17.712 ( -0.000 6.716 0.000) 6.716 17.777 ( -0.000 2.414 0.000) 2.414 21.978 ( -0.000 8.483 -0.000) 8.483 22.465 ( -0.000 -12.968 -0.000) 12.968 23.078 ( -0.000 4.646 0.000) 4.646 23.239 ( -0.000 -2.010 -0.000) 2.010 23.542 ( -0.000 9.610 -0.000) 9.610 23.945 ( -0.000 -6.889 -0.000) 6.889 24.874 ( -0.000 3.782 -0.000) 3.782 25.181 ( -0.000 -8.555 0.000) 8.555 ======================= Grid point 261 (132/136) ======================= q-point: ( 0.00 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.471 ( 0.000 -1.344 -0.000) 1.344 1.471 ( 0.000 1.344 -0.000) 1.344 1.835 ( -0.000 -5.814 0.000) 5.814 1.835 ( -0.000 5.814 0.000) 5.814 2.140 ( -0.000 -3.781 -0.000) 3.781 2.140 ( 0.000 3.781 0.000) 3.781 2.236 ( 0.000 -6.785 0.000) 6.785 2.236 ( 0.000 6.785 -0.000) 6.785 2.741 ( -0.000 -4.532 0.000) 4.532 2.741 ( 0.000 4.532 0.000) 4.532 2.879 ( 0.000 -5.205 0.000) 5.205 2.879 ( 0.000 5.205 0.000) 5.205 3.464 ( 0.000 -3.242 0.000) 3.242 3.464 ( 0.000 3.242 0.000) 3.242 3.569 ( -0.000 -0.706 0.000) 0.706 3.569 ( -0.000 0.706 0.000) 0.706 4.010 ( -0.000 -1.111 0.000) 1.111 4.010 ( 0.000 1.111 0.000) 1.111 4.260 ( -0.000 -3.266 0.000) 3.266 4.260 ( 0.000 3.266 0.000) 3.266 4.348 ( -0.000 -7.872 0.000) 7.872 4.348 ( 0.000 7.872 0.000) 7.872 4.481 ( 0.000 -1.037 0.000) 1.037 4.481 ( 0.000 1.037 0.000) 1.037 5.115 ( -0.000 -6.076 0.000) 6.076 5.115 ( -0.000 6.076 0.000) 6.076 5.257 ( 0.000 -11.096 0.000) 11.096 5.257 ( 0.000 11.096 0.000) 11.096 5.459 ( 0.000 -12.982 0.000) 12.982 5.459 ( -0.000 12.982 0.000) 12.982 6.156 ( 0.000 -15.361 0.000) 15.361 6.156 ( -0.000 15.361 0.000) 15.361 6.705 ( -0.000 -1.412 0.000) 1.412 6.705 ( -0.000 1.412 -0.000) 1.412 7.331 ( 0.000 -5.067 0.000) 5.067 7.331 ( 0.000 5.067 0.000) 5.067 7.678 ( 0.000 -0.404 0.000) 0.404 7.678 ( -0.000 0.404 0.000) 0.404 7.742 ( 0.000 -1.356 0.000) 1.356 7.742 ( 0.000 1.356 0.000) 1.356 8.132 ( 0.000 -9.303 0.000) 9.303 8.132 ( 0.000 9.303 0.000) 9.303 8.709 ( 0.000 -1.568 0.000) 1.568 8.709 ( 0.000 1.568 0.000) 1.568 9.543 ( 0.000 -1.848 0.000) 1.848 9.543 ( -0.000 1.848 0.000) 1.848 9.877 ( 0.000 -0.950 0.000) 0.950 9.877 ( 0.000 0.950 0.000) 0.950 10.868 ( 0.000 -3.275 0.000) 3.275 10.868 ( 0.000 3.275 0.000) 3.275 12.796 ( -0.000 -25.754 0.000) 25.754 12.796 ( 0.000 25.754 0.000) 25.754 14.670 ( 0.000 -40.871 0.000) 40.871 14.670 ( 0.000 40.871 0.000) 40.871 16.496 ( 0.000 -31.936 0.000) 31.936 16.496 ( 0.000 31.936 0.000) 31.936 18.734 ( 0.000 -0.153 0.000) 0.153 18.734 ( 0.000 0.153 0.000) 0.153 22.293 ( -0.000 -6.261 0.000) 6.261 22.293 ( 0.000 6.261 0.000) 6.261 22.937 ( 0.000 -10.380 0.000) 10.380 22.937 ( -0.000 10.380 0.000) 10.380 23.211 ( 0.000 -4.360 0.000) 4.360 23.211 ( -0.000 4.360 0.000) 4.360 24.271 ( 0.000 -5.021 0.000) 5.021 24.271 ( 0.000 5.021 0.000) 5.021 ======================= Grid point 265 (133/136) ======================= q-point: ( 0.12 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.373 ( -11.739 -1.767 10.186) 15.642 1.373 ( -11.739 1.767 10.186) 15.642 1.851 ( 3.367 -7.260 -7.197) 10.763 1.851 ( 3.367 7.260 -7.197) 10.763 2.109 ( -0.005 -5.468 -5.845) 8.004 2.109 ( -0.005 5.468 -5.845) 8.004 2.282 ( 2.072 -5.711 4.087) 7.322 2.282 ( 2.072 5.711 4.087) 7.322 2.819 ( 5.620 -5.521 3.542) 8.638 2.819 ( 5.620 5.521 3.542) 8.638 2.890 ( 0.616 -5.089 1.362) 5.304 2.890 ( 0.616 5.089 1.362) 5.304 3.443 ( -1.245 -3.014 -0.971) 3.403 3.443 ( -1.245 3.014 -0.971) 3.403 3.620 ( 4.439 -3.034 0.298) 5.385 3.620 ( 4.439 3.034 0.298) 5.385 3.991 ( -2.323 -1.666 1.605) 3.278 3.991 ( -2.323 1.666 1.605) 3.278 4.254 ( -0.117 -3.927 -0.872) 4.024 4.254 ( -0.117 3.927 -0.872) 4.024 4.367 ( 1.047 -6.268 0.216) 6.359 4.367 ( 1.047 6.268 0.216) 6.359 4.495 ( 1.874 -1.879 0.072) 2.655 4.495 ( 1.874 1.879 0.072) 2.655 5.051 ( -3.344 -4.913 -5.518) 8.110 5.051 ( -3.344 4.913 -5.518) 8.110 5.268 ( 0.607 -9.119 -0.935) 9.187 5.268 ( 0.607 9.119 -0.935) 9.187 5.510 ( 2.515 -10.594 6.127) 12.494 5.510 ( 2.515 10.594 6.127) 12.494 6.127 ( -1.549 -15.730 -3.147) 16.117 6.127 ( -1.549 15.730 -3.147) 16.117 6.647 ( -4.691 -0.917 -1.492) 5.008 6.647 ( -4.691 0.917 -1.492) 5.008 7.368 ( 2.555 -6.002 1.747) 6.753 7.368 ( 2.555 6.002 1.747) 6.753 7.683 ( 0.236 -1.104 -0.063) 1.131 7.683 ( 0.236 1.104 -0.063) 1.131 7.763 ( 1.401 -1.570 2.381) 3.178 7.763 ( 1.401 1.570 2.381) 3.178 8.106 ( -1.826 -8.201 -2.026) 8.643 8.106 ( -1.826 8.201 -2.026) 8.643 8.684 ( -1.544 -0.832 -1.937) 2.614 8.684 ( -1.544 0.832 -1.937) 2.614 9.557 ( 1.061 -2.897 0.521) 3.129 9.557 ( 1.061 2.897 0.521) 3.129 9.895 ( 1.061 -0.143 1.762) 2.061 9.895 ( 1.061 0.143 1.762) 2.061 10.843 ( -2.362 -3.352 -0.053) 4.101 10.843 ( -2.362 3.352 -0.053) 4.101 12.770 ( -2.775 -24.124 0.837) 24.298 12.770 ( -2.775 24.124 0.837) 24.298 14.637 ( -3.174 -40.517 0.143) 40.642 14.637 ( -3.174 40.517 0.143) 40.642 16.387 ( -10.518 -29.756 2.201) 31.637 16.387 ( -10.518 29.756 2.201) 31.637 18.679 ( -8.578 -5.121 2.778) 10.369 18.679 ( -8.578 5.121 2.778) 10.369 22.382 ( 4.595 -8.144 2.514) 9.682 22.382 ( 4.595 8.144 2.514) 9.682 22.822 ( -3.079 -4.209 -4.165) 6.674 22.822 ( -3.079 4.209 -4.165) 6.674 23.197 ( 0.308 -2.184 -1.262) 2.541 23.197 ( 0.308 2.184 -1.262) 2.541 24.487 ( 17.744 -9.722 -0.546) 20.240 24.487 ( 17.744 9.722 -0.546) 20.240 ======================= Grid point 267 (134/136) ======================= q-point: ( 0.25 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.256 ( -7.182 -3.338 12.168) 14.519 1.256 ( -7.182 3.338 12.168) 14.519 1.828 ( -0.299 -10.479 -8.463) 13.474 1.828 ( -0.299 10.479 -8.463) 13.474 2.078 ( 1.155 -6.678 -4.321) 8.038 2.078 ( 1.155 6.678 -4.321) 8.038 2.351 ( 1.575 -4.877 4.135) 6.585 2.351 ( 1.575 4.877 4.135) 6.585 2.914 ( 1.312 -6.100 1.124) 6.340 2.914 ( 1.312 6.100 1.124) 6.340 2.965 ( 5.116 -6.357 4.016) 9.095 2.965 ( 5.116 6.357 4.016) 9.095 3.413 ( -0.795 -2.917 -1.599) 3.420 3.413 ( -0.795 2.917 -1.599) 3.420 3.722 ( 5.181 -3.650 0.763) 6.383 3.722 ( 5.181 3.650 0.763) 6.383 3.956 ( -2.092 -2.861 1.332) 3.786 3.956 ( -2.092 2.861 1.332) 3.786 4.242 ( -1.040 -5.598 0.442) 5.711 4.242 ( -1.040 5.598 0.442) 5.711 4.378 ( 0.319 -2.439 0.068) 2.461 4.378 ( 0.319 2.439 0.068) 2.461 4.559 ( 4.065 -5.448 0.238) 6.802 4.559 ( 4.065 5.448 0.238) 6.802 4.941 ( -2.666 -3.177 -6.702) 7.882 4.941 ( -2.666 3.177 -6.702) 7.882 5.249 ( -2.279 -8.496 -0.189) 8.798 5.249 ( -2.279 8.496 -0.189) 8.798 5.619 ( 3.607 -6.363 5.497) 9.150 5.619 ( 3.607 6.363 5.497) 9.150 6.066 ( -1.512 -16.694 -4.061) 17.247 6.066 ( -1.512 16.694 -4.061) 17.247 6.536 ( -4.812 -1.257 -1.986) 5.355 6.536 ( -4.812 1.257 -1.986) 5.355 7.427 ( 1.444 -8.392 2.545) 8.887 7.427 ( 1.444 8.392 2.545) 8.887 7.688 ( 0.579 -2.272 0.047) 2.345 7.688 ( 0.579 2.272 0.047) 2.345 7.821 ( 2.176 -2.339 2.688) 4.175 7.821 ( 2.176 2.339 2.688) 4.175 8.044 ( -2.577 -5.112 -2.098) 6.097 8.044 ( -2.577 5.112 -2.098) 6.097 8.636 ( -1.168 -0.994 -2.909) 3.288 8.636 ( -1.168 0.994 -2.909) 3.288 9.582 ( 0.861 -4.481 0.654) 4.610 9.582 ( 0.861 4.481 0.654) 4.610 9.934 ( 1.175 -1.784 2.251) 3.104 9.934 ( 1.175 1.784 2.251) 3.104 10.788 ( -3.059 -3.351 0.190) 4.541 10.788 ( -3.059 3.351 0.190) 4.541 12.716 ( -3.291 -20.999 1.747) 21.327 12.716 ( -3.291 20.999 1.747) 21.327 14.567 ( -3.968 -39.996 0.769) 40.200 14.567 ( -3.968 39.996 0.769) 40.200 16.189 ( -11.129 -27.138 4.031) 29.607 16.189 ( -11.129 27.138 4.031) 29.607 18.397 ( -19.771 -6.762 -2.415) 21.035 18.397 ( -19.771 6.762 -2.415) 21.035 22.332 ( -6.288 -10.693 -2.292) 12.615 22.332 ( -6.288 10.693 -2.292) 12.615 23.014 ( 16.748 -2.361 3.300) 17.232 23.014 ( 16.748 2.361 3.300) 17.232 23.230 ( 4.906 -3.254 2.191) 6.282 23.230 ( 4.906 3.254 2.191) 6.282 24.801 ( 14.751 -12.090 -4.295) 19.550 24.801 ( 14.751 12.090 -4.295) 19.550 ======================= Grid point 269 (135/136) ======================= q-point: ( 0.38 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.296 ( 2.475 -6.703 9.561) 11.936 1.296 ( 2.475 6.703 9.561) 11.936 1.712 ( -5.198 -12.803 -7.410) 15.679 1.712 ( -5.198 12.803 -7.410) 15.679 2.092 ( 2.143 -4.932 -1.873) 5.695 2.092 ( 2.143 4.932 -1.873) 5.695 2.392 ( -0.024 -3.528 2.864) 4.545 2.392 ( -0.024 3.528 2.864) 4.545 2.945 ( 1.312 -6.043 0.199) 6.187 2.945 ( 1.312 6.043 0.199) 6.187 3.063 ( 2.268 -4.710 2.664) 5.868 3.063 ( 2.268 4.710 2.664) 5.868 3.390 ( -0.328 -3.310 -1.535) 3.664 3.390 ( -0.328 3.310 -1.535) 3.664 3.812 ( 3.331 -1.104 -0.087) 3.510 3.812 ( 3.331 1.104 -0.087) 3.510 3.939 ( -0.530 -4.136 1.524) 4.439 3.939 ( -0.530 4.136 1.524) 4.439 4.217 ( -1.904 -7.790 0.768) 8.056 4.217 ( -1.904 7.790 0.768) 8.056 4.389 ( 0.542 -0.657 0.479) 0.977 4.389 ( 0.542 0.657 0.479) 0.977 4.626 ( 2.157 -6.864 -0.336) 7.203 4.626 ( 2.157 6.864 -0.336) 7.203 4.879 ( 1.075 -3.519 -4.446) 5.772 4.879 ( 1.075 3.519 -4.446) 5.772 5.183 ( -4.191 -7.532 0.536) 8.636 5.183 ( -4.191 7.532 0.536) 8.636 5.701 ( 1.685 -2.618 1.934) 3.665 5.701 ( 1.685 2.618 1.934) 3.665 6.028 ( 0.074 -17.094 -2.028) 17.214 6.028 ( 0.074 17.094 -2.028) 17.214 6.449 ( -2.638 -2.096 -1.361) 3.634 6.449 ( -2.638 2.096 -1.361) 3.634 7.455 ( -0.009 -9.940 1.747) 10.092 7.455 ( -0.009 9.940 1.747) 10.092 7.705 ( 0.870 -1.797 0.140) 2.001 7.705 ( 0.870 1.797 0.140) 2.001 7.872 ( 1.266 -2.971 1.435) 3.534 7.872 ( 1.266 2.971 1.435) 3.534 7.992 ( -1.459 -1.670 -0.674) 2.318 7.992 ( -1.459 1.670 -0.674) 2.318 8.605 ( -0.157 -2.642 -2.221) 3.456 8.605 ( -0.157 2.642 -2.221) 3.456 9.595 ( 0.094 -5.438 0.405) 5.454 9.595 ( 0.094 5.438 0.405) 5.454 9.965 ( 0.538 -3.053 1.413) 3.407 9.965 ( 0.538 3.053 1.413) 3.407 10.741 ( -1.827 -2.922 0.361) 3.466 10.741 ( -1.827 2.922 0.361) 3.466 12.679 ( -1.757 -19.234 1.686) 19.387 12.679 ( -1.757 19.234 1.686) 19.387 14.510 ( -2.343 -40.540 1.005) 40.620 14.510 ( -2.343 40.540 1.005) 40.620 16.040 ( -6.797 -25.743 3.325) 26.832 16.040 ( -6.797 25.743 3.325) 26.832 17.986 ( -16.430 -3.087 -5.286) 17.533 17.986 ( -16.430 3.087 -5.286) 17.533 22.226 ( -2.816 -11.233 -1.457) 11.671 22.226 ( -2.816 11.233 -1.457) 11.671 23.163 ( 1.722 -3.401 -0.659) 3.868 23.163 ( 1.722 3.401 -0.659) 3.868 23.550 ( 16.141 -6.996 8.495) 19.535 23.550 ( 16.141 6.996 8.495) 19.535 24.968 ( 6.327 -10.381 -5.327) 13.273 24.968 ( 6.327 10.381 -5.327) 13.273 ======================= Grid point 271 (136/136) ======================= q-point: ( 0.50 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.16e-06 1.16e-06 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 68 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.408 ( -0.000 -5.687 -0.000) 5.687 1.408 ( 0.000 5.687 0.000) 5.687 1.586 ( -0.000 -12.303 0.000) 12.303 1.586 ( -0.000 12.303 -0.000) 12.303 2.110 ( -0.000 -1.990 0.000) 1.990 2.110 ( -0.000 1.990 0.000) 1.990 2.400 ( -0.000 -2.656 0.000) 2.656 2.400 ( -0.000 2.656 0.000) 2.656 2.960 ( -0.000 -6.103 0.000) 6.103 2.960 ( -0.000 6.103 -0.000) 6.103 3.094 ( -0.000 -3.996 0.000) 3.996 3.094 ( -0.000 3.996 0.000) 3.996 3.381 ( -0.000 -3.746 0.000) 3.746 3.381 ( -0.000 3.746 -0.000) 3.746 3.841 ( 0.000 -2.804 -0.000) 2.804 3.841 ( -0.000 2.804 -0.000) 2.804 3.948 ( -0.000 -2.239 -0.000) 2.239 3.948 ( -0.000 2.239 0.000) 2.239 4.196 ( -0.000 -9.590 0.000) 9.590 4.196 ( -0.000 9.590 -0.000) 9.590 4.398 ( -0.000 -0.053 0.000) 0.053 4.398 ( -0.000 0.053 0.000) 0.053 4.639 ( -0.000 -6.833 -0.000) 6.833 4.639 ( -0.000 6.833 -0.000) 6.833 4.890 ( -0.000 -1.360 0.000) 1.360 4.890 ( -0.000 1.360 0.000) 1.360 5.132 ( -0.000 -2.503 -0.000) 2.503 5.132 ( -0.000 2.503 0.000) 2.503 5.720 ( -0.000 -1.575 -0.000) 1.575 5.720 ( -0.000 1.575 0.000) 1.575 6.026 ( -0.000 -16.470 0.000) 16.470 6.026 ( -0.000 16.470 0.000) 16.470 6.418 ( -0.000 -2.455 0.000) 2.455 6.418 ( -0.000 2.455 0.000) 2.455 7.460 ( -0.000 -10.258 -0.000) 10.258 7.460 ( -0.000 10.258 -0.000) 10.258 7.715 ( -0.000 -0.860 0.000) 0.860 7.715 ( -0.000 0.860 -0.000) 0.860 7.889 ( -0.000 -3.398 -0.000) 3.398 7.889 ( -0.000 3.398 -0.000) 3.398 7.977 ( -0.000 -1.993 0.000) 1.993 7.977 ( -0.000 1.993 0.000) 1.993 8.596 ( -0.000 -3.313 0.000) 3.313 8.596 ( -0.000 3.313 0.000) 3.313 9.597 ( -0.000 -5.679 0.000) 5.679 9.597 ( -0.000 5.679 0.000) 5.679 9.975 ( -0.000 -3.445 0.000) 3.445 9.975 ( -0.000 3.445 -0.000) 3.445 10.725 ( -0.000 -2.496 -0.000) 2.496 10.725 ( -0.000 2.496 -0.000) 2.496 12.670 ( -0.000 -18.979 0.000) 18.979 12.670 ( -0.000 18.979 0.000) 18.979 14.492 ( -0.000 -41.306 -0.000) 41.306 14.492 ( -0.000 41.306 0.000) 41.306 15.984 ( -0.000 -25.068 0.000) 25.068 15.984 ( -0.000 25.068 0.000) 25.068 17.793 ( -0.000 -1.205 0.000) 1.205 17.793 ( -0.000 1.205 0.000) 1.205 22.195 ( -0.000 -11.686 0.000) 11.686 22.195 ( -0.000 11.686 -0.000) 11.686 23.174 ( -0.000 -3.976 -0.000) 3.976 23.174 ( -0.000 3.976 0.000) 3.976 23.759 ( -0.000 -10.001 -0.000) 10.001 23.759 ( -0.000 10.001 -0.000) 10.001 25.000 ( -0.000 -7.678 0.000) 7.678 25.000 ( -0.000 7.678 0.000) 7.678 =================== 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 3/25344 10.0 166.347 158.861 169.481 0.000 -63.277 0.000 3/25344 20.0 25.135 24.407 34.587 0.000 -14.026 0.000 3/25344 30.0 8.960 9.441 13.808 0.000 -5.477 0.000 3/25344 40.0 4.767 5.357 7.871 0.000 -3.026 0.000 3/25344 50.0 3.120 3.677 5.379 0.000 -2.017 0.000 3/25344 60.0 2.295 2.807 4.070 0.000 -1.499 0.000 3/25344 70.0 1.815 2.289 3.282 0.000 -1.193 0.000 3/25344 80.0 1.506 1.951 2.762 0.000 -0.994 0.000 3/25344 90.0 1.294 1.716 2.398 0.000 -0.856 0.000 3/25344 100.0 1.141 1.546 2.130 0.000 -0.754 0.000 3/25344 110.0 1.027 1.419 1.924 0.000 -0.676 0.000 3/25344 120.0 0.942 1.322 1.762 0.000 -0.614 0.000 3/25344 130.0 0.876 1.246 1.630 0.000 -0.563 0.000 3/25344 140.0 0.825 1.184 1.522 0.000 -0.519 0.000 3/25344 150.0 0.786 1.133 1.430 0.000 -0.482 0.000 3/25344 160.0 0.756 1.091 1.351 0.000 -0.450 0.000 3/25344 170.0 0.733 1.054 1.283 0.000 -0.421 0.000 3/25344 180.0 0.715 1.022 1.223 0.000 -0.395 0.000 3/25344 190.0 0.702 0.993 1.170 0.000 -0.371 0.000 3/25344 200.0 0.691 0.967 1.122 0.000 -0.350 0.000 3/25344 210.0 0.683 0.943 1.079 0.000 -0.330 0.000 3/25344 220.0 0.676 0.921 1.040 0.000 -0.312 0.000 3/25344 230.0 0.670 0.900 1.004 0.000 -0.296 0.000 3/25344 240.0 0.666 0.881 0.971 0.000 -0.281 0.000 3/25344 250.0 0.661 0.862 0.940 0.000 -0.267 0.000 3/25344 260.0 0.658 0.844 0.912 0.000 -0.254 0.000 3/25344 270.0 0.654 0.827 0.885 0.000 -0.242 0.000 3/25344 280.0 0.650 0.811 0.861 0.000 -0.230 0.000 3/25344 290.0 0.647 0.795 0.837 0.000 -0.220 0.000 3/25344 300.0 0.643 0.780 0.815 0.000 -0.210 0.000 3/25344 310.0 0.639 0.766 0.795 0.000 -0.201 0.000 3/25344 320.0 0.635 0.751 0.775 0.000 -0.193 0.000 3/25344 330.0 0.631 0.738 0.756 0.000 -0.185 0.000 3/25344 340.0 0.626 0.724 0.739 0.000 -0.178 0.000 3/25344 350.0 0.621 0.711 0.722 0.000 -0.171 0.000 3/25344 360.0 0.617 0.699 0.706 0.000 -0.165 0.000 3/25344 370.0 0.612 0.687 0.690 0.000 -0.159 0.000 3/25344 380.0 0.607 0.675 0.675 0.000 -0.153 0.000 3/25344 390.0 0.601 0.663 0.661 0.000 -0.148 0.000 3/25344 400.0 0.596 0.652 0.648 0.000 -0.143 0.000 3/25344 410.0 0.591 0.641 0.635 0.000 -0.138 0.000 3/25344 420.0 0.585 0.631 0.622 0.000 -0.133 0.000 3/25344 430.0 0.580 0.620 0.610 0.000 -0.129 0.000 3/25344 440.0 0.574 0.610 0.598 0.000 -0.125 0.000 3/25344 450.0 0.568 0.600 0.587 0.000 -0.122 0.000 3/25344 460.0 0.563 0.591 0.577 0.000 -0.118 0.000 3/25344 470.0 0.557 0.582 0.566 0.000 -0.115 0.000 3/25344 480.0 0.551 0.573 0.556 0.000 -0.111 0.000 3/25344 490.0 0.546 0.564 0.546 0.000 -0.108 0.000 3/25344 500.0 0.540 0.555 0.537 0.000 -0.106 0.000 3/25344 510.0 0.534 0.547 0.528 0.000 -0.103 0.000 3/25344 520.0 0.529 0.539 0.519 0.000 -0.100 0.000 3/25344 530.0 0.523 0.531 0.511 0.000 -0.098 0.000 3/25344 540.0 0.518 0.523 0.502 0.000 -0.095 0.000 3/25344 550.0 0.512 0.516 0.494 0.000 -0.093 0.000 3/25344 560.0 0.507 0.508 0.487 0.000 -0.091 0.000 3/25344 570.0 0.501 0.501 0.479 0.000 -0.089 0.000 3/25344 580.0 0.496 0.494 0.472 0.000 -0.087 0.000 3/25344 590.0 0.491 0.488 0.465 0.000 -0.085 0.000 3/25344 600.0 0.486 0.481 0.458 0.000 -0.083 0.000 3/25344 610.0 0.480 0.474 0.451 0.000 -0.081 0.000 3/25344 620.0 0.475 0.468 0.445 0.000 -0.080 0.000 3/25344 630.0 0.470 0.462 0.438 0.000 -0.078 0.000 3/25344 640.0 0.465 0.456 0.432 0.000 -0.076 0.000 3/25344 650.0 0.461 0.450 0.426 0.000 -0.075 0.000 3/25344 660.0 0.456 0.444 0.420 0.000 -0.074 0.000 3/25344 670.0 0.451 0.439 0.415 0.000 -0.072 0.000 3/25344 680.0 0.446 0.433 0.409 0.000 -0.071 0.000 3/25344 690.0 0.442 0.428 0.404 0.000 -0.070 0.000 3/25344 700.0 0.437 0.423 0.398 0.000 -0.068 0.000 3/25344 710.0 0.433 0.417 0.393 0.000 -0.067 0.000 3/25344 720.0 0.428 0.412 0.388 0.000 -0.066 0.000 3/25344 730.0 0.424 0.408 0.383 0.000 -0.065 0.000 3/25344 740.0 0.420 0.403 0.379 0.000 -0.064 0.000 3/25344 750.0 0.416 0.398 0.374 0.000 -0.063 0.000 3/25344 760.0 0.411 0.393 0.369 0.000 -0.062 0.000 3/25344 770.0 0.407 0.389 0.365 0.000 -0.061 0.000 3/25344 780.0 0.403 0.385 0.361 0.000 -0.060 0.000 3/25344 790.0 0.400 0.380 0.356 0.000 -0.059 0.000 3/25344 800.0 0.396 0.376 0.352 0.000 -0.058 0.000 3/25344 810.0 0.392 0.372 0.348 0.000 -0.057 0.000 3/25344 820.0 0.388 0.368 0.344 0.000 -0.056 0.000 3/25344 830.0 0.384 0.364 0.340 0.000 -0.055 0.000 3/25344 840.0 0.381 0.360 0.337 0.000 -0.055 0.000 3/25344 850.0 0.377 0.356 0.333 0.000 -0.054 0.000 3/25344 860.0 0.374 0.352 0.329 0.000 -0.053 0.000 3/25344 870.0 0.370 0.349 0.326 0.000 -0.052 0.000 3/25344 880.0 0.367 0.345 0.322 0.000 -0.052 0.000 3/25344 890.0 0.363 0.342 0.319 0.000 -0.051 0.000 3/25344 900.0 0.360 0.338 0.316 0.000 -0.050 0.000 3/25344 910.0 0.357 0.335 0.312 0.000 -0.050 0.000 3/25344 920.0 0.354 0.332 0.309 0.000 -0.049 0.000 3/25344 930.0 0.351 0.328 0.306 0.000 -0.048 0.000 3/25344 940.0 0.347 0.325 0.303 0.000 -0.048 0.000 3/25344 950.0 0.344 0.322 0.300 0.000 -0.047 0.000 3/25344 960.0 0.341 0.319 0.297 0.000 -0.047 0.000 3/25344 970.0 0.338 0.316 0.294 0.000 -0.046 0.000 3/25344 980.0 0.336 0.313 0.291 0.000 -0.046 0.000 3/25344 990.0 0.333 0.310 0.288 0.000 -0.045 0.000 3/25344 1000.0 0.330 0.307 0.286 0.000 -0.044 0.000 3/25344 Thermal conductivity related properties were written into "kappa-m868.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 21:38:58]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|