----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 08:59:34]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) Number of symmetry operations in supercell: 18 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.973178609985738 2.293915740013725 3.120846843333330 b -3.973178609985731 2.293915740013725 3.120846843333330 c 0.000000000000004 -4.587831480027456 3.120846843333330 Atomic positions (fractional): *1 H 0.29771019098174 0.09019464880586 0.95170221608662 1.008 2 H 0.70228980901826 0.90980535119414 0.04829778391338 1.008 *3 H 0.57196568576682 0.20340758517848 0.42375842208082 1.008 4 H 0.42375842208082 0.57196568576682 0.20340758517848 1.008 5 H 0.20340758517848 0.42375842208083 0.57196568576682 1.008 6 H 0.42803431423318 0.79659241482152 0.57624157791918 1.008 7 H 0.57624157791918 0.42803431423318 0.79659241482152 1.008 8 H 0.79659241482152 0.57624157791918 0.42803431423318 1.008 9 H 0.04829778391338 0.70228980901826 0.90980535119414 1.008 10 H 0.09019464880586 0.95170221608662 0.29771019098174 1.008 11 H 0.95170221608662 0.29771019098174 0.09019464880586 1.008 12 H 0.90980535119414 0.04829778391339 0.70228980901826 1.008 *13 Li 0.06201594762283 0.74924315762047 0.56810512709098 6.941 14 Li 0.56810512709098 0.06201594762283 0.74924315762047 6.941 15 Li 0.93798405237717 0.25075684237954 0.43189487290902 6.941 16 Li 0.43189487290902 0.93798405237717 0.25075684237953 6.941 17 Li 0.74924315762047 0.56810512709098 0.06201594762283 6.941 18 Li 0.25075684237953 0.43189487290902 0.93798405237717 6.941 *19 Al 0.50000000000000 0.50000000000000 0.50000000000000 26.982 *20 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 -------------------------------- unit cell --------------------------------- Lattice vectors: a 7.946357219971469 0.000000000000000 0.000000000000000 b -3.973178609985735 6.881747220041181 0.000000000000000 c 0.000000000000000 0.000000000000000 9.362540529999999 Atomic positions (fractional): *1 H 0.85117450569034 0.49483346920479 0.44653568529141 1.008 > 1 2 H 0.14882549430966 0.50516653079521 0.55346431470859 1.008 > 2 *3 H 0.17225512142478 0.97595214226122 0.39971056434204 1.008 > 3 4 H 0.02404785773878 0.19630297916356 0.39971056434204 1.008 > 4 5 H 0.80369702083644 0.82774487857522 0.39971056434204 1.008 > 5 6 H 0.82774487857522 0.02404785773878 0.60028943565796 1.008 > 6 7 H 0.97595214226122 0.80369702083644 0.60028943565796 1.008 > 7 8 H 0.19630297916356 0.17225512142478 0.60028943565796 1.008 > 8 9 H 0.49483346920479 0.64365896351445 0.55346431470859 1.008 > 9 10 H 0.64365896351445 0.14882549430966 0.44653568529141 1.008 > 10 11 H 0.50516653079521 0.35634103648554 0.44653568529141 1.008 > 11 12 H 0.35634103648554 0.85117450569034 0.55346431470859 1.008 > 12 13 H 0.51784117235700 0.82816680253812 0.77986901862474 1.008 > 1 14 H 0.81549216097633 0.83849986412854 0.88679764804193 1.008 > 2 15 H 0.83892178809145 0.30928547559455 0.73304389767537 1.008 > 3 16 H 0.69071452440545 0.52963631249689 0.73304389767537 1.008 > 4 17 H 0.47036368750311 0.16107821190856 0.73304389767537 1.008 > 5 18 H 0.49441154524189 0.35738119107212 0.93362276899129 1.008 > 6 19 H 0.64261880892788 0.13703035416977 0.93362276899129 1.008 > 7 20 H 0.86296964583023 0.50558845475811 0.93362276899129 1.008 > 8 21 H 0.16150013587146 0.97699229684779 0.88679764804193 1.008 > 9 22 H 0.31032563018112 0.48215882764300 0.77986901862474 1.008 > 10 23 H 0.17183319746188 0.68967436981888 0.77986901862474 1.008 > 11 24 H 0.02300770315221 0.18450783902367 0.88679764804193 1.008 > 12 25 H 0.18450783902367 0.16150013587146 0.11320235195807 1.008 > 1 26 H 0.48215882764300 0.17183319746188 0.22013098137526 1.008 > 2 27 H 0.50558845475811 0.64261880892788 0.06637723100871 1.008 > 3 28 H 0.35738119107212 0.86296964583023 0.06637723100871 1.008 > 4 29 H 0.13703035416977 0.49441154524189 0.06637723100871 1.008 > 5 30 H 0.16107821190856 0.69071452440545 0.26695610232463 1.008 > 6 31 H 0.30928547559455 0.47036368750311 0.26695610232463 1.008 > 7 32 H 0.52963631249689 0.83892178809145 0.26695610232463 1.008 > 8 33 H 0.82816680253812 0.31032563018112 0.22013098137526 1.008 > 9 34 H 0.97699229684779 0.81549216097633 0.11320235195807 1.008 > 10 35 H 0.83849986412854 0.02300770315221 0.11320235195807 1.008 > 11 36 H 0.68967436981888 0.51784117235700 0.22013098137526 1.008 > 12 *37 Li 0.60222787017807 0.89168295035378 0.45978807744476 6.941 > 13 38 Li 0.10831704964622 0.71054491982429 0.45978807744476 6.941 > 14 39 Li 0.39777212982193 0.10831704964622 0.54021192255524 6.941 > 15 40 Li 0.89168295035378 0.28945508017571 0.54021192255524 6.941 > 16 41 Li 0.28945508017571 0.39777212982193 0.45978807744476 6.941 > 17 42 Li 0.71054491982429 0.60222787017807 0.54021192255524 6.941 > 18 43 Li 0.26889453684474 0.22501628368711 0.79312141077809 6.941 > 13 44 Li 0.77498371631289 0.04387825315763 0.79312141077809 6.941 > 14 45 Li 0.06443879648860 0.44165038297955 0.87354525588858 6.941 > 15 46 Li 0.55834961702045 0.62278841350904 0.87354525588858 6.941 > 16 47 Li 0.95612174684237 0.73110546315526 0.79312141077809 6.941 > 17 48 Li 0.37721158649096 0.93556120351141 0.87354525588858 6.941 > 18 49 Li 0.93556120351141 0.55834961702045 0.12645474411142 6.941 > 13 50 Li 0.44165038297955 0.37721158649096 0.12645474411142 6.941 > 14 51 Li 0.73110546315526 0.77498371631289 0.20687858922191 6.941 > 15 52 Li 0.22501628368711 0.95612174684237 0.20687858922191 6.941 > 16 53 Li 0.62278841350904 0.06443879648860 0.12645474411142 6.941 > 17 54 Li 0.04387825315763 0.26889453684474 0.20687858922191 6.941 > 18 *55 Al 0.00000000000000 0.00000000000000 0.50000000000000 26.982 > 19 *56 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 > 20 57 Al 0.66666666666667 0.33333333333333 0.83333333333333 26.982 > 19 58 Al 0.66666666666667 0.33333333333333 0.33333333333333 26.982 > 20 59 Al 0.33333333333333 0.66666666666667 0.16666666666667 26.982 > 19 60 Al 0.33333333333333 0.66666666666667 0.66666666666667 26.982 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 7.946357219971469 0.000000000000000 0.000000000000000 b -3.973178609985735 6.881747220041181 0.000000000000000 c 0.000000000000000 0.000000000000000 9.362540529999999 Atomic positions (fractional): *1 H 0.85117450569034 0.49483346920479 0.44653568529141 1.008 > 1 2 H 0.14882549430966 0.50516653079521 0.55346431470859 1.008 > 2 *3 H 0.17225512142478 0.97595214226122 0.39971056434204 1.008 > 3 4 H 0.02404785773878 0.19630297916356 0.39971056434204 1.008 > 4 5 H 0.80369702083644 0.82774487857522 0.39971056434204 1.008 > 5 6 H 0.82774487857522 0.02404785773878 0.60028943565796 1.008 > 6 7 H 0.97595214226122 0.80369702083644 0.60028943565796 1.008 > 7 8 H 0.19630297916356 0.17225512142478 0.60028943565796 1.008 > 8 9 H 0.49483346920479 0.64365896351445 0.55346431470859 1.008 > 9 10 H 0.64365896351445 0.14882549430966 0.44653568529141 1.008 > 10 11 H 0.50516653079521 0.35634103648554 0.44653568529141 1.008 > 11 12 H 0.35634103648554 0.85117450569034 0.55346431470859 1.008 > 12 13 H 0.51784117235700 0.82816680253812 0.77986901862474 1.008 > 1 14 H 0.81549216097633 0.83849986412854 0.88679764804193 1.008 > 2 15 H 0.83892178809145 0.30928547559455 0.73304389767537 1.008 > 3 16 H 0.69071452440545 0.52963631249689 0.73304389767537 1.008 > 4 17 H 0.47036368750311 0.16107821190856 0.73304389767537 1.008 > 5 18 H 0.49441154524189 0.35738119107212 0.93362276899129 1.008 > 6 19 H 0.64261880892788 0.13703035416977 0.93362276899129 1.008 > 7 20 H 0.86296964583023 0.50558845475811 0.93362276899129 1.008 > 8 21 H 0.16150013587146 0.97699229684779 0.88679764804193 1.008 > 9 22 H 0.31032563018112 0.48215882764300 0.77986901862474 1.008 > 10 23 H 0.17183319746188 0.68967436981888 0.77986901862474 1.008 > 11 24 H 0.02300770315221 0.18450783902367 0.88679764804193 1.008 > 12 25 H 0.18450783902367 0.16150013587146 0.11320235195807 1.008 > 1 26 H 0.48215882764300 0.17183319746188 0.22013098137526 1.008 > 2 27 H 0.50558845475811 0.64261880892788 0.06637723100871 1.008 > 3 28 H 0.35738119107212 0.86296964583023 0.06637723100871 1.008 > 4 29 H 0.13703035416977 0.49441154524189 0.06637723100871 1.008 > 5 30 H 0.16107821190856 0.69071452440545 0.26695610232463 1.008 > 6 31 H 0.30928547559455 0.47036368750311 0.26695610232463 1.008 > 7 32 H 0.52963631249689 0.83892178809145 0.26695610232463 1.008 > 8 33 H 0.82816680253812 0.31032563018112 0.22013098137526 1.008 > 9 34 H 0.97699229684779 0.81549216097633 0.11320235195807 1.008 > 10 35 H 0.83849986412854 0.02300770315221 0.11320235195807 1.008 > 11 36 H 0.68967436981888 0.51784117235700 0.22013098137526 1.008 > 12 *37 Li 0.60222787017807 0.89168295035378 0.45978807744476 6.941 > 13 38 Li 0.10831704964622 0.71054491982429 0.45978807744476 6.941 > 14 39 Li 0.39777212982193 0.10831704964622 0.54021192255524 6.941 > 15 40 Li 0.89168295035378 0.28945508017571 0.54021192255524 6.941 > 16 41 Li 0.28945508017571 0.39777212982193 0.45978807744476 6.941 > 17 42 Li 0.71054491982429 0.60222787017807 0.54021192255524 6.941 > 18 43 Li 0.26889453684474 0.22501628368711 0.79312141077809 6.941 > 13 44 Li 0.77498371631289 0.04387825315763 0.79312141077809 6.941 > 14 45 Li 0.06443879648860 0.44165038297955 0.87354525588858 6.941 > 15 46 Li 0.55834961702045 0.62278841350904 0.87354525588858 6.941 > 16 47 Li 0.95612174684237 0.73110546315526 0.79312141077809 6.941 > 17 48 Li 0.37721158649096 0.93556120351141 0.87354525588858 6.941 > 18 49 Li 0.93556120351141 0.55834961702045 0.12645474411142 6.941 > 13 50 Li 0.44165038297955 0.37721158649096 0.12645474411142 6.941 > 14 51 Li 0.73110546315526 0.77498371631289 0.20687858922191 6.941 > 15 52 Li 0.22501628368711 0.95612174684237 0.20687858922191 6.941 > 16 53 Li 0.62278841350904 0.06443879648860 0.12645474411142 6.941 > 17 54 Li 0.04387825315763 0.26889453684474 0.20687858922191 6.941 > 18 *55 Al 0.00000000000000 0.00000000000000 0.50000000000000 26.982 > 19 *56 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 > 20 57 Al 0.66666666666667 0.33333333333333 0.83333333333333 26.982 > 19 58 Al 0.66666666666667 0.33333333333333 0.33333333333333 26.982 > 20 59 Al 0.33333333333333 0.66666666666667 0.16666666666667 26.982 > 19 60 Al 0.33333333333333 0.66666666666667 0.66666666666667 26.982 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.0320510 0.0000030 0.0000000 -0.0000030 4.0320510 0.0000000 0.0000000 0.0000000 3.8737062 -------------------------- Born effective charges -------------------------- 1 H -0.8251554 -0.0860661 -0.1092872 -0.1129250 -0.9092560 -0.2016347 -0.1290844 -0.1561369 -0.8031962 2 H -0.8251554 -0.0860661 -0.1092872 -0.1129250 -0.9092560 -0.2016347 -0.1290844 -0.1561369 -0.8031962 3 H -1.0150838 0.0538886 0.1747212 0.0824610 -0.7236956 -0.0238094 0.1722846 -0.0644539 -0.8209271 4 H -0.7375015 0.0778012 -0.0667411 0.1063736 -1.0012778 0.1632177 -0.0303236 0.1814298 -0.8209271 5 H -0.8555837 -0.1745483 -0.1079801 -0.1459760 -0.8831956 -0.1394083 -0.1419611 -0.1169759 -0.8209271 6 H -1.0150838 0.0538886 0.1747212 0.0824610 -0.7236956 -0.0238094 0.1722846 -0.0644539 -0.8209271 7 H -0.7375015 0.0778012 -0.0667411 0.1063736 -1.0012778 0.1632177 -0.0303236 0.1814298 -0.8209271 8 H -0.8555837 -0.1745483 -0.1079801 -0.1459760 -0.8831956 -0.1394083 -0.1419611 -0.1169759 -0.8209271 9 H -0.9743965 0.0267606 0.2292643 -0.0000983 -0.7600148 0.0061719 0.1997607 -0.0337219 -0.8031962 10 H -0.8020651 0.0995939 -0.1199772 0.0727350 -0.9323462 0.1954628 -0.0706763 0.1898588 -0.8031962 11 H -0.9743965 0.0267606 0.2292643 -0.0000983 -0.7600148 0.0061719 0.1997607 -0.0337219 -0.8031962 12 H -0.8020651 0.0995939 -0.1199772 0.0727350 -0.9323462 0.1954628 -0.0706763 0.1898588 -0.8031962 13 Li 1.0928244 0.0647753 0.0217186 0.0830535 0.9723842 -0.0110394 0.0134704 -0.1101675 0.9701604 14 Li 1.0665060 -0.0982484 -0.0012989 -0.0799702 0.9987026 0.0243285 0.0886727 0.0667494 0.9701604 15 Li 1.0928244 0.0647753 0.0217186 0.0830535 0.9723842 -0.0110394 0.0134704 -0.1101675 0.9701604 16 Li 1.0665060 -0.0982484 -0.0012989 -0.0799702 0.9987026 0.0243285 0.0886727 0.0667494 0.9701604 17 Li 0.9384825 0.0060558 -0.0204197 0.0243340 1.1267261 -0.0132892 -0.1021430 0.0434181 0.9701604 18 Li 0.9384825 0.0060558 -0.0204197 0.0243340 1.1267261 -0.0132892 -0.1021430 0.0434181 0.9701604 19 Al 2.2198260 0.0328453 -0.0000000 -0.0328453 2.2198260 0.0000000 -0.0000000 0.0000000 1.6871573 20 Al 2.0041204 0.0271297 -0.0000000 -0.0271297 2.0041204 0.0000000 -0.0000000 0.0000000 2.2366201 ---------------------------------------------------------------------------- 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: 180/180 Permutation basis: 7026/7026 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 923 Number of blocks in projector: 432 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 416 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 396 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 111 Use standard eigh solver. Tree of FC basis block matrices: - (923, 891), data: False |-- (111, 106), data: True |-- (396, 384), data: True |-- (416, 401), data: True ----- Solver_atoms: 1 -- 60 / 60 Time (Solver_compr_matrix_reshape): 0.007 Solver_block: 100 / 400 - Time: 0.545 Solver_block: 200 / 400 - Time: 0.539 Solver_block: 300 / 400 - Time: 0.534 Solver_block: 400 / 400 - Time: 0.555 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 2.288 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 180/180 Permutation basis: 7026/7026 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 923 Number of blocks in projector: 432 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 416 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 396 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 111 Use standard eigh solver. Tree of FC basis block matrices: - (923, 891), data: False |-- (111, 106), data: True |-- (396, 384), data: True |-- (416, 401), data: True Max drift after symmetrization by symfc projector: -0.00000000 (zz) -0.00000000 (zz) 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 08:59:52]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 08:59:53]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.973178609985738 2.293915740013725 3.120846843333330 b -3.973178609985731 2.293915740013725 3.120846843333330 c 0.000000000000004 -4.587831480027456 3.120846843333330 Atomic positions (fractional): 1 H 0.29771019098174 0.09019464880586 0.95170221608662 1.008 2 H 0.70228980901826 0.90980535119414 0.04829778391338 1.008 3 H 0.57196568576682 0.20340758517848 0.42375842208082 1.008 4 H 0.42375842208082 0.57196568576682 0.20340758517848 1.008 5 H 0.20340758517848 0.42375842208083 0.57196568576682 1.008 6 H 0.42803431423318 0.79659241482152 0.57624157791918 1.008 7 H 0.57624157791918 0.42803431423318 0.79659241482152 1.008 8 H 0.79659241482152 0.57624157791918 0.42803431423318 1.008 9 H 0.04829778391338 0.70228980901826 0.90980535119414 1.008 10 H 0.09019464880586 0.95170221608662 0.29771019098174 1.008 11 H 0.95170221608662 0.29771019098174 0.09019464880586 1.008 12 H 0.90980535119414 0.04829778391339 0.70228980901826 1.008 13 Li 0.06201594762283 0.74924315762047 0.56810512709098 6.941 14 Li 0.56810512709098 0.06201594762283 0.74924315762047 6.941 15 Li 0.93798405237717 0.25075684237954 0.43189487290902 6.941 16 Li 0.43189487290902 0.93798405237717 0.25075684237953 6.941 17 Li 0.74924315762047 0.56810512709098 0.06201594762283 6.941 18 Li 0.25075684237953 0.43189487290902 0.93798405237717 6.941 19 Al 0.50000000000000 0.50000000000000 0.50000000000000 26.982 20 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 -------------------------------- supercell --------------------------------- Lattice vectors: a 7.946357219971469 0.000000000000000 0.000000000000000 b -3.973178609985735 6.881747220041181 0.000000000000000 c 0.000000000000000 0.000000000000000 9.362540529999999 Atomic positions (fractional): 1 H 0.85117450569034 0.49483346920479 0.44653568529141 1.008 > 1 2 H 0.14882549430966 0.50516653079521 0.55346431470859 1.008 > 2 3 H 0.17225512142478 0.97595214226122 0.39971056434204 1.008 > 3 4 H 0.02404785773878 0.19630297916356 0.39971056434204 1.008 > 4 5 H 0.80369702083644 0.82774487857522 0.39971056434204 1.008 > 5 6 H 0.82774487857522 0.02404785773878 0.60028943565796 1.008 > 6 7 H 0.97595214226122 0.80369702083644 0.60028943565796 1.008 > 7 8 H 0.19630297916356 0.17225512142478 0.60028943565796 1.008 > 8 9 H 0.49483346920479 0.64365896351445 0.55346431470859 1.008 > 9 10 H 0.64365896351445 0.14882549430966 0.44653568529141 1.008 > 10 11 H 0.50516653079521 0.35634103648554 0.44653568529141 1.008 > 11 12 H 0.35634103648554 0.85117450569034 0.55346431470859 1.008 > 12 13 H 0.51784117235700 0.82816680253812 0.77986901862474 1.008 > 1 14 H 0.81549216097633 0.83849986412854 0.88679764804193 1.008 > 2 15 H 0.83892178809145 0.30928547559455 0.73304389767537 1.008 > 3 16 H 0.69071452440545 0.52963631249689 0.73304389767537 1.008 > 4 17 H 0.47036368750311 0.16107821190856 0.73304389767537 1.008 > 5 18 H 0.49441154524189 0.35738119107212 0.93362276899129 1.008 > 6 19 H 0.64261880892788 0.13703035416977 0.93362276899129 1.008 > 7 20 H 0.86296964583023 0.50558845475811 0.93362276899129 1.008 > 8 21 H 0.16150013587146 0.97699229684779 0.88679764804193 1.008 > 9 22 H 0.31032563018112 0.48215882764300 0.77986901862474 1.008 > 10 23 H 0.17183319746188 0.68967436981888 0.77986901862474 1.008 > 11 24 H 0.02300770315221 0.18450783902367 0.88679764804193 1.008 > 12 25 H 0.18450783902367 0.16150013587146 0.11320235195807 1.008 > 1 26 H 0.48215882764300 0.17183319746188 0.22013098137526 1.008 > 2 27 H 0.50558845475811 0.64261880892788 0.06637723100871 1.008 > 3 28 H 0.35738119107212 0.86296964583023 0.06637723100871 1.008 > 4 29 H 0.13703035416977 0.49441154524189 0.06637723100871 1.008 > 5 30 H 0.16107821190856 0.69071452440545 0.26695610232463 1.008 > 6 31 H 0.30928547559455 0.47036368750311 0.26695610232463 1.008 > 7 32 H 0.52963631249689 0.83892178809145 0.26695610232463 1.008 > 8 33 H 0.82816680253812 0.31032563018112 0.22013098137526 1.008 > 9 34 H 0.97699229684779 0.81549216097633 0.11320235195807 1.008 > 10 35 H 0.83849986412854 0.02300770315221 0.11320235195807 1.008 > 11 36 H 0.68967436981888 0.51784117235700 0.22013098137526 1.008 > 12 37 Li 0.60222787017807 0.89168295035378 0.45978807744476 6.941 > 37 38 Li 0.10831704964622 0.71054491982429 0.45978807744476 6.941 > 38 39 Li 0.39777212982193 0.10831704964622 0.54021192255524 6.941 > 39 40 Li 0.89168295035378 0.28945508017571 0.54021192255524 6.941 > 40 41 Li 0.28945508017571 0.39777212982193 0.45978807744476 6.941 > 41 42 Li 0.71054491982429 0.60222787017807 0.54021192255524 6.941 > 42 43 Li 0.26889453684474 0.22501628368711 0.79312141077809 6.941 > 37 44 Li 0.77498371631289 0.04387825315763 0.79312141077809 6.941 > 38 45 Li 0.06443879648860 0.44165038297955 0.87354525588858 6.941 > 39 46 Li 0.55834961702045 0.62278841350904 0.87354525588858 6.941 > 40 47 Li 0.95612174684237 0.73110546315526 0.79312141077809 6.941 > 41 48 Li 0.37721158649096 0.93556120351141 0.87354525588858 6.941 > 42 49 Li 0.93556120351141 0.55834961702045 0.12645474411142 6.941 > 37 50 Li 0.44165038297955 0.37721158649096 0.12645474411142 6.941 > 38 51 Li 0.73110546315526 0.77498371631289 0.20687858922191 6.941 > 39 52 Li 0.22501628368711 0.95612174684237 0.20687858922191 6.941 > 40 53 Li 0.62278841350904 0.06443879648860 0.12645474411142 6.941 > 41 54 Li 0.04387825315763 0.26889453684474 0.20687858922191 6.941 > 42 55 Al 0.00000000000000 0.00000000000000 0.50000000000000 26.982 > 55 56 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 > 56 57 Al 0.66666666666667 0.33333333333333 0.83333333333333 26.982 > 55 58 Al 0.66666666666667 0.33333333333333 0.33333333333333 26.982 > 56 59 Al 0.33333333333333 0.66666666666667 0.16666666666667 26.982 > 55 60 Al 0.33333333333333 0.66666666666667 0.66666666666667 26.982 > 56 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.0320510 0.0000030 0.0000000 -0.0000030 4.0320510 0.0000000 0.0000000 0.0000000 3.8737062 -------------------------- Born effective charges -------------------------- 1 H -0.8251554 -0.0860661 -0.1092872 -0.1129250 -0.9092560 -0.2016347 -0.1290844 -0.1561369 -0.8031962 2 H -0.8251554 -0.0860661 -0.1092872 -0.1129250 -0.9092560 -0.2016347 -0.1290844 -0.1561369 -0.8031962 3 H -1.0150838 0.0538886 0.1747212 0.0824610 -0.7236956 -0.0238094 0.1722846 -0.0644539 -0.8209271 4 H -0.7375015 0.0778012 -0.0667411 0.1063736 -1.0012778 0.1632177 -0.0303236 0.1814298 -0.8209271 5 H -0.8555837 -0.1745483 -0.1079801 -0.1459760 -0.8831956 -0.1394083 -0.1419611 -0.1169759 -0.8209271 6 H -1.0150838 0.0538886 0.1747212 0.0824610 -0.7236956 -0.0238094 0.1722846 -0.0644539 -0.8209271 7 H -0.7375015 0.0778012 -0.0667411 0.1063736 -1.0012778 0.1632177 -0.0303236 0.1814298 -0.8209271 8 H -0.8555837 -0.1745483 -0.1079801 -0.1459760 -0.8831956 -0.1394083 -0.1419611 -0.1169759 -0.8209271 9 H -0.9743965 0.0267606 0.2292643 -0.0000983 -0.7600148 0.0061719 0.1997607 -0.0337219 -0.8031962 10 H -0.8020651 0.0995939 -0.1199772 0.0727350 -0.9323462 0.1954628 -0.0706763 0.1898588 -0.8031962 11 H -0.9743965 0.0267606 0.2292643 -0.0000983 -0.7600148 0.0061719 0.1997607 -0.0337219 -0.8031962 12 H -0.8020651 0.0995939 -0.1199772 0.0727350 -0.9323462 0.1954628 -0.0706763 0.1898588 -0.8031962 13 Li 1.0928244 0.0647753 0.0217186 0.0830535 0.9723842 -0.0110394 0.0134704 -0.1101675 0.9701604 14 Li 1.0665060 -0.0982484 -0.0012989 -0.0799702 0.9987026 0.0243285 0.0886727 0.0667494 0.9701604 15 Li 1.0928244 0.0647753 0.0217186 0.0830535 0.9723842 -0.0110394 0.0134704 -0.1101675 0.9701604 16 Li 1.0665060 -0.0982484 -0.0012989 -0.0799702 0.9987026 0.0243285 0.0886727 0.0667494 0.9701604 17 Li 0.9384825 0.0060558 -0.0204197 0.0243340 1.1267261 -0.0132892 -0.1021430 0.0434181 0.9701604 18 Li 0.9384825 0.0060558 -0.0204197 0.0243340 1.1267261 -0.0132892 -0.1021430 0.0434181 0.9701604 19 Al 2.2198260 0.0328453 -0.0000000 -0.0328453 2.2198260 0.0000000 -0.0000000 0.0000000 1.6871573 20 Al 2.0041204 0.0271297 -0.0000000 -0.0271297 2.0041204 0.0000000 -0.0000000 0.0000000 2.2366201 ---------------------------------------------------------------------------- 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] [-0.0050 0.0087 0.0000] [ 0.0050 -0.0087 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 3, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [-0.0050 0.0087 0.0000] [ 0.0050 -0.0087 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 37, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [-0.0050 0.0087 0.0000] [ 0.0050 -0.0087 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 55, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 56, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (yyy) 0.00000000 (yyy) 0.00000000 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (zz) 0.00000000 (zz) 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 09:00:01]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 09:00:01]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.973178609985738 2.293915740013725 3.120846843333330 b -3.973178609985731 2.293915740013725 3.120846843333330 c 0.000000000000004 -4.587831480027456 3.120846843333330 Atomic positions (fractional): 1 H 0.29771019098174 0.09019464880586 0.95170221608662 1.008 2 H 0.70228980901826 0.90980535119414 0.04829778391338 1.008 3 H 0.57196568576682 0.20340758517848 0.42375842208082 1.008 4 H 0.42375842208082 0.57196568576682 0.20340758517848 1.008 5 H 0.20340758517848 0.42375842208083 0.57196568576682 1.008 6 H 0.42803431423318 0.79659241482152 0.57624157791918 1.008 7 H 0.57624157791918 0.42803431423318 0.79659241482152 1.008 8 H 0.79659241482152 0.57624157791918 0.42803431423318 1.008 9 H 0.04829778391338 0.70228980901826 0.90980535119414 1.008 10 H 0.09019464880586 0.95170221608662 0.29771019098174 1.008 11 H 0.95170221608662 0.29771019098174 0.09019464880586 1.008 12 H 0.90980535119414 0.04829778391339 0.70228980901826 1.008 13 Li 0.06201594762283 0.74924315762047 0.56810512709098 6.941 14 Li 0.56810512709098 0.06201594762283 0.74924315762047 6.941 15 Li 0.93798405237717 0.25075684237954 0.43189487290902 6.941 16 Li 0.43189487290902 0.93798405237717 0.25075684237953 6.941 17 Li 0.74924315762047 0.56810512709098 0.06201594762283 6.941 18 Li 0.25075684237953 0.43189487290902 0.93798405237717 6.941 19 Al 0.50000000000000 0.50000000000000 0.50000000000000 26.982 20 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 -------------------------------- supercell --------------------------------- Lattice vectors: a 7.946357219971469 0.000000000000000 0.000000000000000 b -3.973178609985735 6.881747220041181 0.000000000000000 c 0.000000000000000 0.000000000000000 9.362540529999999 Atomic positions (fractional): 1 H 0.85117450569034 0.49483346920479 0.44653568529141 1.008 > 1 2 H 0.14882549430966 0.50516653079521 0.55346431470859 1.008 > 2 3 H 0.17225512142478 0.97595214226122 0.39971056434204 1.008 > 3 4 H 0.02404785773878 0.19630297916356 0.39971056434204 1.008 > 4 5 H 0.80369702083644 0.82774487857522 0.39971056434204 1.008 > 5 6 H 0.82774487857522 0.02404785773878 0.60028943565796 1.008 > 6 7 H 0.97595214226122 0.80369702083644 0.60028943565796 1.008 > 7 8 H 0.19630297916356 0.17225512142478 0.60028943565796 1.008 > 8 9 H 0.49483346920479 0.64365896351445 0.55346431470859 1.008 > 9 10 H 0.64365896351445 0.14882549430966 0.44653568529141 1.008 > 10 11 H 0.50516653079521 0.35634103648554 0.44653568529141 1.008 > 11 12 H 0.35634103648554 0.85117450569034 0.55346431470859 1.008 > 12 13 H 0.51784117235700 0.82816680253812 0.77986901862474 1.008 > 1 14 H 0.81549216097633 0.83849986412854 0.88679764804193 1.008 > 2 15 H 0.83892178809145 0.30928547559455 0.73304389767537 1.008 > 3 16 H 0.69071452440545 0.52963631249689 0.73304389767537 1.008 > 4 17 H 0.47036368750311 0.16107821190856 0.73304389767537 1.008 > 5 18 H 0.49441154524189 0.35738119107212 0.93362276899129 1.008 > 6 19 H 0.64261880892788 0.13703035416977 0.93362276899129 1.008 > 7 20 H 0.86296964583023 0.50558845475811 0.93362276899129 1.008 > 8 21 H 0.16150013587146 0.97699229684779 0.88679764804193 1.008 > 9 22 H 0.31032563018112 0.48215882764300 0.77986901862474 1.008 > 10 23 H 0.17183319746188 0.68967436981888 0.77986901862474 1.008 > 11 24 H 0.02300770315221 0.18450783902367 0.88679764804193 1.008 > 12 25 H 0.18450783902367 0.16150013587146 0.11320235195807 1.008 > 1 26 H 0.48215882764300 0.17183319746188 0.22013098137526 1.008 > 2 27 H 0.50558845475811 0.64261880892788 0.06637723100871 1.008 > 3 28 H 0.35738119107212 0.86296964583023 0.06637723100871 1.008 > 4 29 H 0.13703035416977 0.49441154524189 0.06637723100871 1.008 > 5 30 H 0.16107821190856 0.69071452440545 0.26695610232463 1.008 > 6 31 H 0.30928547559455 0.47036368750311 0.26695610232463 1.008 > 7 32 H 0.52963631249689 0.83892178809145 0.26695610232463 1.008 > 8 33 H 0.82816680253812 0.31032563018112 0.22013098137526 1.008 > 9 34 H 0.97699229684779 0.81549216097633 0.11320235195807 1.008 > 10 35 H 0.83849986412854 0.02300770315221 0.11320235195807 1.008 > 11 36 H 0.68967436981888 0.51784117235700 0.22013098137526 1.008 > 12 37 Li 0.60222787017807 0.89168295035378 0.45978807744476 6.941 > 37 38 Li 0.10831704964622 0.71054491982429 0.45978807744476 6.941 > 38 39 Li 0.39777212982193 0.10831704964622 0.54021192255524 6.941 > 39 40 Li 0.89168295035378 0.28945508017571 0.54021192255524 6.941 > 40 41 Li 0.28945508017571 0.39777212982193 0.45978807744476 6.941 > 41 42 Li 0.71054491982429 0.60222787017807 0.54021192255524 6.941 > 42 43 Li 0.26889453684474 0.22501628368711 0.79312141077809 6.941 > 37 44 Li 0.77498371631289 0.04387825315763 0.79312141077809 6.941 > 38 45 Li 0.06443879648860 0.44165038297955 0.87354525588858 6.941 > 39 46 Li 0.55834961702045 0.62278841350904 0.87354525588858 6.941 > 40 47 Li 0.95612174684237 0.73110546315526 0.79312141077809 6.941 > 41 48 Li 0.37721158649096 0.93556120351141 0.87354525588858 6.941 > 42 49 Li 0.93556120351141 0.55834961702045 0.12645474411142 6.941 > 37 50 Li 0.44165038297955 0.37721158649096 0.12645474411142 6.941 > 38 51 Li 0.73110546315526 0.77498371631289 0.20687858922191 6.941 > 39 52 Li 0.22501628368711 0.95612174684237 0.20687858922191 6.941 > 40 53 Li 0.62278841350904 0.06443879648860 0.12645474411142 6.941 > 41 54 Li 0.04387825315763 0.26889453684474 0.20687858922191 6.941 > 42 55 Al 0.00000000000000 0.00000000000000 0.50000000000000 26.982 > 55 56 Al 0.00000000000000 0.00000000000000 0.00000000000000 26.982 > 56 57 Al 0.66666666666667 0.33333333333333 0.83333333333333 26.982 > 55 58 Al 0.66666666666667 0.33333333333333 0.33333333333333 26.982 > 56 59 Al 0.33333333333333 0.66666666666667 0.16666666666667 26.982 > 55 60 Al 0.33333333333333 0.66666666666667 0.66666666666667 26.982 > 56 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.0320510 0.0000030 0.0000000 -0.0000030 4.0320510 0.0000000 0.0000000 0.0000000 3.8737062 -------------------------- Born effective charges -------------------------- 1 H -0.8251554 -0.0860661 -0.1092872 -0.1129250 -0.9092560 -0.2016347 -0.1290844 -0.1561369 -0.8031962 2 H -0.8251554 -0.0860661 -0.1092872 -0.1129250 -0.9092560 -0.2016347 -0.1290844 -0.1561369 -0.8031962 3 H -1.0150838 0.0538886 0.1747212 0.0824610 -0.7236956 -0.0238094 0.1722846 -0.0644539 -0.8209271 4 H -0.7375015 0.0778012 -0.0667411 0.1063736 -1.0012778 0.1632177 -0.0303236 0.1814298 -0.8209271 5 H -0.8555837 -0.1745483 -0.1079801 -0.1459760 -0.8831956 -0.1394083 -0.1419611 -0.1169759 -0.8209271 6 H -1.0150838 0.0538886 0.1747212 0.0824610 -0.7236956 -0.0238094 0.1722846 -0.0644539 -0.8209271 7 H -0.7375015 0.0778012 -0.0667411 0.1063736 -1.0012778 0.1632177 -0.0303236 0.1814298 -0.8209271 8 H -0.8555837 -0.1745483 -0.1079801 -0.1459760 -0.8831956 -0.1394083 -0.1419611 -0.1169759 -0.8209271 9 H -0.9743965 0.0267606 0.2292643 -0.0000983 -0.7600148 0.0061719 0.1997607 -0.0337219 -0.8031962 10 H -0.8020651 0.0995939 -0.1199772 0.0727350 -0.9323462 0.1954628 -0.0706763 0.1898588 -0.8031962 11 H -0.9743965 0.0267606 0.2292643 -0.0000983 -0.7600148 0.0061719 0.1997607 -0.0337219 -0.8031962 12 H -0.8020651 0.0995939 -0.1199772 0.0727350 -0.9323462 0.1954628 -0.0706763 0.1898588 -0.8031962 13 Li 1.0928244 0.0647753 0.0217186 0.0830535 0.9723842 -0.0110394 0.0134704 -0.1101675 0.9701604 14 Li 1.0665060 -0.0982484 -0.0012989 -0.0799702 0.9987026 0.0243285 0.0886727 0.0667494 0.9701604 15 Li 1.0928244 0.0647753 0.0217186 0.0830535 0.9723842 -0.0110394 0.0134704 -0.1101675 0.9701604 16 Li 1.0665060 -0.0982484 -0.0012989 -0.0799702 0.9987026 0.0243285 0.0886727 0.0667494 0.9701604 17 Li 0.9384825 0.0060558 -0.0204197 0.0243340 1.1267261 -0.0132892 -0.1021430 0.0434181 0.9701604 18 Li 0.9384825 0.0060558 -0.0204197 0.0243340 1.1267261 -0.0132892 -0.1021430 0.0434181 0.9701604 19 Al 2.2198260 0.0328453 -0.0000000 -0.0328453 2.2198260 0.0000000 -0.0000000 0.0000000 1.6871573 20 Al 2.0041204 0.0271297 -0.0000000 -0.0271297 2.0041204 0.0000000 -0.0000000 0.0000000 2.2366201 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (yyy) 0.00000000 (yyy) 0.00000000 (yyy) Max drift of fc2: -0.00000000 (zz) -0.00000000 (zz) --------------------------- 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 ... [ 9 9 9 ] 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: 0.75, Number of G-points: 299, Lambda: 0.16 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/125) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 125 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 5.599 ( 0.000 0.000 0.000) 0.000 5.638 ( 0.000 0.000 0.000) 0.000 5.638 ( 0.000 0.000 0.000) 0.000 7.356 ( 0.000 0.000 0.000) 0.000 7.356 ( 0.000 0.000 0.000) 0.000 7.862 ( 0.000 0.000 0.000) 0.000 7.862 ( 0.000 0.000 0.000) 0.000 8.335 ( 0.000 0.000 0.000) 0.000 8.365 ( 0.000 0.000 0.000) 0.000 8.476 ( 0.000 0.000 0.000) 0.000 8.854 ( 0.000 0.000 0.000) 0.000 9.870 ( 0.000 0.000 0.000) 0.000 9.870 ( 0.000 0.000 0.000) 0.000 9.953 ( 0.000 0.000 0.000) 0.000 9.953 ( 0.000 0.000 0.000) 0.000 10.928 ( 0.000 0.000 0.000) 0.000 10.928 ( 0.000 0.000 0.000) 0.000 11.193 ( 0.000 0.000 0.000) 0.000 11.214 ( 0.000 0.000 0.000) 0.000 11.214 ( 0.000 0.000 0.000) 0.000 11.670 ( 0.000 0.000 0.000) 0.000 16.166 ( 0.000 0.000 0.000) 0.000 16.166 ( 0.000 0.000 0.000) 0.000 16.675 ( 0.000 0.000 0.000) 0.000 18.075 ( 0.000 0.000 0.000) 0.000 18.075 ( 0.000 0.000 0.000) 0.000 19.845 ( 0.000 0.000 0.000) 0.000 22.721 ( 0.000 0.000 0.000) 0.000 22.721 ( 0.000 0.000 0.000) 0.000 23.002 ( 0.000 0.000 0.000) 0.000 24.479 ( 0.000 0.000 0.000) 0.000 24.479 ( 0.000 0.000 0.000) 0.000 24.599 ( 0.000 0.000 0.000) 0.000 25.249 ( 0.000 0.000 0.000) 0.000 25.413 ( 0.000 0.000 0.000) 0.000 25.413 ( 0.000 0.000 0.000) 0.000 28.147 ( 0.000 0.000 0.000) 0.000 28.147 ( 0.000 0.000 0.000) 0.000 28.408 ( 0.000 0.000 0.000) 0.000 28.408 ( 0.000 0.000 0.000) 0.000 28.486 ( 0.000 0.000 0.000) 0.000 29.137 ( 0.000 0.000 0.000) 0.000 29.264 ( 0.000 0.000 0.000) 0.000 30.422 ( 0.000 0.000 0.000) 0.000 30.422 ( 0.000 0.000 0.000) 0.000 39.892 ( 0.000 0.000 0.000) 0.000 40.991 ( 0.000 0.000 0.000) 0.000 40.991 ( 0.000 0.000 0.000) 0.000 41.866 ( 0.000 0.000 0.000) 0.000 41.866 ( 0.000 0.000 0.000) 0.000 42.677 ( 0.000 0.000 0.000) 0.000 42.677 ( 0.000 0.000 0.000) 0.000 42.873 ( 0.000 0.000 0.000) 0.000 42.873 ( 0.000 0.000 0.000) 0.000 43.492 ( 0.000 0.000 0.000) 0.000 48.068 ( 0.000 0.000 0.000) 0.000 48.298 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/125) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.894 ( 32.491 34.557 13.212) 49.238 0.966 ( 11.070 43.690 37.740) 58.785 1.583 ( 67.529 7.402 46.898) 82.550 5.541 ( -6.355 -2.054 -3.764) 7.667 5.575 ( -2.821 -7.051 -2.503) 7.996 5.740 ( 4.778 6.219 5.314) 9.473 7.290 ( -6.652 -0.465 -2.256) 7.040 7.348 ( -0.130 -3.033 0.446) 3.068 7.755 ( -8.586 -8.582 -0.896) 12.173 7.791 ( -7.398 -2.187 -1.717) 7.903 8.195 ( 2.730 3.241 -15.199) 15.778 8.367 ( 2.608 1.259 -2.985) 4.159 8.583 ( -2.992 -2.038 6.244) 7.217 8.982 ( -1.603 -3.775 20.253) 20.665 9.746 ( -10.048 0.387 -11.614) 15.362 9.899 ( 9.066 -5.301 -8.515) 13.520 9.978 ( -2.367 1.048 4.710) 5.375 10.160 ( -3.476 9.935 -14.707) 18.085 10.901 ( -2.918 -1.946 -19.640) 19.951 10.948 ( 10.329 -16.944 -0.040) 19.845 11.232 ( 1.504 3.775 -1.691) 4.402 11.265 ( 4.996 4.732 1.578) 7.060 11.493 ( 9.725 17.357 -1.260) 19.936 12.104 ( -10.552 -5.976 17.284) 21.114 16.191 ( 2.338 1.631 -0.223) 2.859 16.240 ( 7.262 3.969 0.610) 8.298 16.571 ( -5.894 -3.303 -7.353) 9.986 17.982 ( -5.516 -3.086 -6.027) 8.734 18.020 ( -3.016 -1.815 -4.158) 5.448 19.667 ( -12.026 -6.931 -8.489) 16.271 22.826 ( 4.263 8.735 5.072) 10.964 23.008 ( 13.112 4.251 -3.297) 14.172 23.694 ( -2.571 -3.039 9.026) 9.865 24.520 ( 2.379 1.393 2.684) 3.848 24.660 ( 4.116 3.010 3.406) 6.132 24.970 ( 19.147 9.366 -23.368) 31.630 25.352 ( -5.209 0.204 -2.093) 5.617 25.386 ( -0.476 -0.355 1.956) 2.045 27.789 ( -13.768 -18.758 -7.273) 24.379 27.874 ( -24.181 -8.576 3.303) 25.869 28.201 ( -2.135 14.693 -2.805) 15.110 28.459 ( 2.630 -6.070 0.773) 6.660 28.705 ( 12.316 0.914 12.812) 17.795 29.166 ( 14.890 11.550 -8.562) 20.698 29.284 ( 3.237 1.634 -1.308) 3.855 30.401 ( -1.276 -0.765 -1.408) 2.048 30.424 ( -0.768 0.058 1.216) 1.440 30.961 ( 11.516 3.894 -20.671) 23.980 40.066 ( -20.450 -18.242 25.235) 37.253 40.857 ( -21.968 18.988 -6.359) 29.725 41.012 ( 3.194 -5.361 3.099) 6.968 41.914 ( 5.195 -3.014 -3.278) 6.843 42.311 ( 2.065 -14.240 -15.574) 21.204 42.609 ( 0.540 3.540 -12.046) 12.566 42.734 ( 7.609 21.834 -20.585) 30.957 42.961 ( 10.086 -14.008 5.402) 18.087 43.428 ( 21.833 19.258 3.455) 29.317 45.538 ( -16.366 -13.099 26.356) 33.676 48.064 ( 0.053 0.033 -0.762) 0.764 48.294 ( -0.187 -0.106 -0.229) 0.314 ======================= Grid point 2 (3/125) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.776 ( 31.894 31.444 14.432) 47.055 1.901 ( 11.667 42.983 33.712) 55.858 3.096 ( 62.835 6.828 43.646) 76.810 5.291 ( -15.089 -7.430 -6.128) 17.901 5.382 ( -5.388 -13.153 -7.427) 16.037 5.977 ( 6.758 9.905 7.681) 14.240 7.155 ( -8.803 3.316 -2.240) 9.670 7.316 ( -0.347 -5.003 -0.609) 5.052 7.535 ( -6.145 -12.748 -1.122) 14.196 7.608 ( -10.583 -3.553 -1.592) 11.276 8.128 ( 1.977 4.263 -8.263) 9.505 8.365 ( -1.273 0.413 -3.281) 3.543 8.509 ( -3.911 -5.172 -0.219) 6.488 9.134 ( -6.287 -8.137 12.678) 16.325 9.469 ( -6.245 -2.621 -8.466) 10.842 9.850 ( -16.164 8.037 -4.417) 18.584 9.867 ( 2.487 4.434 -15.883) 16.677 10.103 ( 3.924 -2.309 0.856) 4.633 10.599 ( 1.839 -13.629 -13.224) 19.079 11.013 ( 4.484 -5.876 5.650) 9.303 11.260 ( 2.106 3.804 -3.664) 5.686 11.411 ( 3.543 7.194 3.583) 8.784 11.722 ( 5.134 8.882 3.250) 10.762 12.124 ( -0.885 0.482 3.727) 3.861 16.185 ( -4.351 -1.738 -6.860) 8.307 16.361 ( -1.105 0.960 -5.251) 5.451 16.435 ( 10.886 4.480 0.898) 11.806 17.762 ( -8.347 -3.984 -8.549) 12.595 17.877 ( -4.582 -3.378 -6.497) 8.638 19.284 ( -14.924 -8.623 -10.142) 19.998 23.055 ( 4.594 12.531 7.139) 15.136 23.229 ( 12.887 0.822 4.346) 13.625 23.757 ( 0.335 -1.640 7.041) 7.237 24.605 ( 1.899 -0.768 3.836) 4.348 24.823 ( 6.205 6.815 3.367) 9.812 25.034 ( 9.970 3.393 -8.964) 13.829 25.233 ( -3.242 -1.090 -4.635) 5.761 25.442 ( 2.555 6.056 1.154) 6.674 27.340 ( -19.766 -13.622 -6.338) 24.828 27.454 ( -17.546 -15.666 -6.179) 24.320 28.272 ( -3.639 17.511 0.216) 17.887 28.470 ( 2.477 -6.170 3.234) 7.393 28.979 ( 8.726 -1.989 8.277) 12.190 29.345 ( 8.778 2.367 -1.859) 9.280 29.369 ( 7.980 7.092 -2.202) 10.901 30.349 ( -2.287 1.120 -2.681) 3.697 30.432 ( -0.842 0.161 1.923) 2.105 30.888 ( 3.008 -3.589 -8.675) 9.858 39.893 ( -11.413 -16.064 7.721) 21.165 40.608 ( -26.513 23.525 -5.246) 35.832 41.057 ( 5.592 -10.355 4.394) 12.562 41.733 ( -5.888 -0.470 -17.464) 18.435 42.248 ( 10.320 -7.018 -3.006) 12.837 42.507 ( 1.315 -1.766 -7.194) 7.523 42.783 ( 2.212 14.494 -7.244) 16.353 43.037 ( 5.511 -11.163 5.989) 13.815 43.957 ( 17.153 14.988 14.274) 26.881 45.499 ( -6.107 -10.030 8.931) 14.753 48.052 ( -0.028 -0.002 -1.161) 1.161 48.286 ( -0.283 -0.156 -0.396) 0.511 ======================= Grid point 3 (4/125) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.627 ( 29.782 26.296 16.417) 42.988 2.774 ( 13.108 40.877 26.463) 50.429 4.424 ( 46.830 2.453 34.372) 58.142 4.864 ( -20.017 -10.824 -9.675) 24.728 5.059 ( -1.855 -20.519 -8.367) 22.237 6.198 ( 0.132 12.322 2.820) 12.641 7.077 ( -6.300 9.483 -1.095) 11.438 7.217 ( -2.690 -4.127 -5.050) 7.055 7.385 ( -2.745 -15.189 4.448) 16.063 7.471 ( -2.372 -6.558 1.739) 7.187 8.087 ( -0.628 1.774 -6.904) 7.156 8.233 ( -12.777 -2.783 4.254) 13.751 8.422 ( -0.941 -0.615 -9.874) 9.938 8.960 ( -5.456 -8.026 -3.535) 10.329 9.291 ( -10.607 0.070 -5.207) 11.817 9.621 ( -13.077 1.967 -10.448) 16.854 9.772 ( -1.080 2.653 -2.054) 3.525 10.153 ( 7.658 -4.705 -0.679) 9.013 10.499 ( 4.692 -3.804 -1.153) 6.149 11.091 ( 3.266 -3.035 3.928) 5.942 11.261 ( 0.764 2.504 -3.672) 4.510 11.550 ( 0.879 6.245 5.072) 8.093 11.828 ( 1.726 0.977 -0.419) 2.027 12.187 ( 3.008 4.004 1.043) 5.115 15.921 ( -8.315 -3.968 -10.464) 13.943 16.373 ( 1.575 3.367 -1.678) 4.078 16.669 ( 12.965 4.219 2.841) 13.927 17.498 ( -10.420 -3.335 -8.782) 14.029 17.720 ( -2.574 -3.233 -5.265) 6.693 18.933 ( -10.794 -6.337 -6.780) 14.235 23.302 ( 3.561 12.837 6.703) 14.913 23.445 ( 10.590 -3.228 4.751) 12.048 23.835 ( 0.956 -0.609 5.725) 5.836 24.581 ( -4.410 -5.349 -1.284) 7.050 24.972 ( 3.229 9.368 -1.540) 10.028 25.099 ( 4.347 -0.704 -1.609) 4.688 25.221 ( 6.208 3.571 0.778) 7.204 25.587 ( 7.321 8.596 2.380) 11.539 26.861 ( -25.963 -10.185 -3.910) 28.163 27.044 ( -7.246 -17.044 -9.563) 20.844 28.386 ( -3.388 17.596 2.492) 18.092 28.498 ( 2.154 -6.417 4.191) 7.961 29.129 ( 6.313 1.231 1.638) 6.637 29.450 ( 4.329 2.459 -1.060) 5.090 29.467 ( 6.137 -4.747 -0.225) 7.762 30.315 ( -1.719 6.405 -2.475) 7.078 30.447 ( -0.254 0.362 1.411) 1.479 30.790 ( -0.045 -6.944 -3.704) 7.870 39.702 ( -6.923 -11.423 1.708) 13.466 40.399 ( -20.099 17.736 -2.381) 26.911 41.101 ( 7.358 -13.532 3.845) 15.875 41.463 ( -6.957 3.288 -12.954) 15.067 42.272 ( 3.797 5.851 -9.445) 11.742 42.466 ( 3.185 -8.676 1.714) 9.399 42.851 ( 0.776 8.862 -1.160) 8.971 43.077 ( 3.075 -8.338 3.925) 9.715 44.459 ( 13.577 13.437 13.775) 23.551 45.408 ( -3.891 -10.153 0.794) 10.902 48.037 ( -0.127 -0.046 -1.005) 1.014 48.276 ( -0.255 -0.136 -0.403) 0.496 ======================= Grid point 4 (5/125) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.380 ( 19.245 16.348 17.337) 30.630 3.520 ( 16.534 32.156 11.438) 37.924 4.262 ( -24.536 -19.312 -7.942) 32.219 4.525 ( -6.719 -17.204 -12.350) 22.218 5.615 ( 39.095 -1.692 25.361) 46.631 6.167 ( -15.480 10.559 -9.187) 20.869 7.108 ( 3.808 8.920 -3.034) 10.162 7.120 ( -3.430 2.300 -1.088) 4.271 7.269 ( -4.848 -16.845 3.325) 17.842 7.430 ( -0.416 -4.703 1.350) 4.911 7.939 ( -6.566 -0.067 -3.711) 7.542 8.170 ( -8.294 -0.874 11.205) 13.968 8.248 ( 2.844 1.157 -16.105) 16.396 8.939 ( 3.573 -2.560 7.437) 8.638 9.099 ( -2.040 0.169 -11.825) 12.001 9.321 ( -12.264 0.109 -4.637) 13.111 9.783 ( 0.164 -0.136 0.872) 0.898 10.217 ( 4.364 -2.170 0.175) 4.877 10.545 ( 1.711 0.603 0.703) 1.946 11.139 ( 1.256 -0.933 1.337) 2.058 11.245 ( -0.098 0.845 -1.481) 1.708 11.650 ( -0.245 3.259 3.881) 5.074 11.810 ( 0.504 -1.450 -2.742) 3.143 12.262 ( 1.656 2.017 0.532) 2.663 15.722 ( -3.240 -1.497 -4.216) 5.524 16.383 ( -0.082 1.282 -1.025) 1.643 16.927 ( 12.687 2.975 5.136) 14.007 17.216 ( -11.954 -2.794 -7.468) 14.370 17.646 ( -0.026 -1.008 -1.717) 1.991 18.739 ( -3.912 -2.333 -2.244) 5.078 23.493 ( 0.685 9.752 3.353) 10.335 23.561 ( 5.357 -6.054 1.698) 8.260 23.898 ( 0.740 -0.054 2.631) 2.734 24.442 ( -3.834 -3.010 -2.338) 5.406 25.016 ( 0.265 2.767 -1.712) 3.264 25.139 ( 1.857 0.311 0.438) 1.933 25.360 ( 4.092 3.041 1.125) 5.220 25.849 ( 12.261 8.270 4.456) 15.446 26.395 ( -19.557 -8.502 -4.488) 21.793 26.783 ( -2.527 -7.720 -4.178) 9.134 28.490 ( -2.792 12.923 0.300) 13.224 28.517 ( 2.267 -8.035 3.241) 8.955 29.253 ( 5.841 6.622 0.175) 8.832 29.400 ( -3.242 -7.662 -1.176) 8.402 29.520 ( 3.052 -1.543 0.092) 3.421 30.341 ( -0.224 5.457 -0.578) 5.492 30.459 ( 0.158 0.308 0.123) 0.367 30.704 ( -0.611 -4.672 -0.862) 4.790 39.581 ( -2.421 -4.049 0.096) 4.718 40.286 ( -7.393 6.428 -0.574) 9.814 41.134 ( 5.605 -9.465 1.971) 11.176 41.302 ( -5.263 5.342 -5.092) 9.065 42.252 ( 0.684 3.509 -4.482) 5.733 42.471 ( 1.438 -3.778 1.366) 4.267 42.904 ( 0.174 3.162 0.230) 3.175 43.087 ( 1.074 -3.421 1.279) 3.807 44.853 ( 7.954 10.081 8.860) 15.601 45.247 ( -4.172 -8.921 -3.859) 10.577 48.027 ( -0.075 -0.027 -0.391) 0.399 48.269 ( -0.104 -0.055 -0.175) 0.211 ======================= Grid point 10 (6/125) ======================= q-point: ( 0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.092 ( 13.046 22.297 30.021) 39.606 1.446 ( 16.787 17.689 47.646) 53.525 2.292 ( -16.713 50.299 59.350) 79.572 5.513 ( -0.241 -0.538 -7.106) 7.131 5.604 ( -6.551 -6.631 0.427) 9.331 5.731 ( 6.143 0.274 6.084) 8.650 7.249 ( 2.652 -7.507 -3.786) 8.816 7.353 ( -1.874 -0.333 0.384) 1.942 7.686 ( -3.456 -14.235 -4.427) 15.303 7.855 ( 2.638 -3.588 0.941) 4.552 8.004 ( 0.340 3.875 -12.251) 12.854 8.322 ( -0.605 0.125 -2.892) 2.957 8.635 ( -1.018 -4.931 1.171) 5.169 9.239 ( -2.411 -2.851 23.866) 24.156 9.506 ( 3.089 -3.219 -17.807) 18.357 9.827 ( -4.720 12.931 -19.499) 23.869 9.950 ( 6.691 -9.934 1.331) 12.051 10.121 ( 6.688 3.343 -3.585) 8.292 10.614 ( -11.129 -4.956 -9.188) 15.259 11.020 ( -3.652 13.184 -8.359) 16.032 11.217 ( -1.116 -5.003 3.884) 6.431 11.317 ( 0.588 8.446 1.424) 8.585 11.538 ( 7.877 14.701 6.259) 17.814 12.184 ( 0.154 -14.971 4.269) 15.568 16.209 ( 0.682 3.376 0.668) 3.508 16.226 ( -0.667 7.240 0.032) 7.271 16.441 ( 0.212 -6.398 -13.446) 14.892 17.886 ( 0.401 -5.450 -11.168) 12.433 17.939 ( -0.419 -2.739 -7.988) 8.455 19.511 ( 0.060 -13.316 -16.077) 20.876 22.862 ( 5.510 3.216 6.149) 8.861 23.075 ( -3.777 17.871 9.712) 20.687 23.827 ( -1.190 -4.342 9.643) 10.642 24.498 ( 0.189 -0.845 0.930) 1.271 24.686 ( 1.376 6.018 1.642) 6.388 24.835 ( -1.368 17.035 -1.349) 17.143 25.304 ( 0.010 -4.500 -4.387) 6.285 25.400 ( 1.973 1.931 -0.959) 2.923 27.582 ( -4.331 -23.268 -11.105) 26.143 28.038 ( -1.663 5.744 -12.047) 13.450 28.146 ( 12.610 -12.119 -3.790) 17.896 28.548 ( -3.936 -4.006 10.469) 11.880 28.680 ( -5.702 2.305 12.274) 13.729 29.156 ( 3.372 19.180 -0.292) 19.477 29.248 ( -1.138 2.405 -2.877) 3.919 30.406 ( -0.866 -1.371 0.245) 1.640 30.439 ( 1.626 0.114 1.514) 2.225 30.824 ( -2.305 14.418 -8.767) 17.031 40.239 ( -12.536 -35.174 8.773) 38.358 40.672 ( 26.578 -12.426 -10.915) 31.304 41.108 ( -1.129 5.769 3.368) 6.774 41.758 ( 4.046 -4.980 -15.506) 16.781 42.184 ( -24.277 19.179 -18.314) 35.953 42.356 ( 5.903 2.089 -13.258) 14.663 42.647 ( 5.304 17.967 1.502) 18.794 43.190 ( -4.672 -0.030 12.767) 13.595 43.577 ( 3.704 15.484 23.357) 28.267 45.720 ( -2.628 -17.260 7.213) 18.891 48.051 ( -0.007 0.091 -1.325) 1.329 48.291 ( 0.001 -0.167 -0.364) 0.401 ======================= Grid point 11 (7/125) ======================= q-point: ( 0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.848 ( 20.821 30.807 19.663) 42.063 2.495 ( 24.861 25.391 38.784) 52.602 3.286 ( 9.645 33.784 58.581) 68.309 5.310 ( -11.418 -5.222 -11.362) 16.934 5.354 ( -12.480 -14.777 -2.174) 19.464 5.983 ( 12.743 3.529 7.696) 15.299 7.151 ( 0.529 -7.502 -5.476) 9.303 7.338 ( -2.835 1.341 2.348) 3.918 7.433 ( -4.510 -16.384 -4.260) 17.519 7.753 ( -12.161 -3.879 0.031) 12.765 7.957 ( 7.122 -0.916 -9.764) 12.120 8.323 ( 3.507 1.263 -0.176) 3.731 8.521 ( -6.058 -4.578 -3.767) 8.476 9.215 ( -8.069 -7.298 -9.397) 14.376 9.509 ( 0.836 1.249 9.300) 9.420 9.675 ( 3.040 8.688 -16.085) 18.532 10.000 ( 4.202 -11.454 0.139) 12.201 10.061 ( -7.954 4.909 -8.188) 12.426 10.352 ( -3.133 -4.735 -3.490) 6.665 11.011 ( -0.204 8.782 -3.089) 9.311 11.229 ( 1.573 -3.430 1.998) 4.270 11.437 ( 4.699 6.639 1.990) 8.374 11.816 ( 2.924 11.928 5.383) 13.409 12.101 ( 1.890 -8.522 -1.018) 8.789 16.112 ( -4.581 -6.508 -14.102) 16.193 16.307 ( 2.113 5.447 -1.967) 6.164 16.371 ( 7.205 7.381 1.596) 10.437 17.676 ( -1.900 -5.568 -13.129) 14.386 17.788 ( -2.652 -3.120 -9.479) 10.325 19.152 ( -4.295 -13.880 -17.518) 22.760 23.092 ( 12.290 0.526 6.326) 13.832 23.316 ( -3.539 17.845 12.241) 21.927 23.876 ( -3.192 -1.226 9.385) 9.989 24.532 ( 5.543 -6.164 -0.558) 8.308 24.801 ( 5.703 5.475 -0.027) 7.906 24.994 ( 3.023 11.529 5.182) 12.996 25.179 ( -3.157 -3.288 -5.535) 7.170 25.485 ( 3.873 7.779 1.476) 8.815 27.194 ( -5.875 -22.919 -9.112) 25.354 27.638 ( -24.966 -4.530 -11.372) 27.805 28.267 ( 14.548 0.049 -5.632) 15.600 28.577 ( -8.310 2.261 12.868) 15.484 28.882 ( 11.203 -2.841 5.110) 12.637 29.231 ( 4.567 -1.518 -3.222) 5.792 29.344 ( 3.509 11.101 0.857) 11.674 30.382 ( -2.653 2.508 -0.145) 3.654 30.484 ( -0.044 0.431 3.464) 3.491 30.798 ( -1.673 4.787 -5.191) 7.256 39.908 ( -7.746 -21.375 -0.370) 22.738 40.639 ( 8.315 -21.654 -13.437) 26.807 41.086 ( -6.615 14.412 -5.720) 16.858 41.786 ( 22.556 -10.589 -6.288) 25.699 41.861 ( -19.918 21.946 -12.917) 32.330 42.299 ( 5.582 -4.025 -7.518) 10.192 42.848 ( -0.181 10.458 5.895) 12.006 43.238 ( -8.475 -0.638 13.129) 15.640 44.089 ( 11.308 15.780 20.320) 28.103 45.571 ( -7.181 -13.118 2.962) 15.245 48.035 ( 0.113 0.236 -1.672) 1.693 48.284 ( -0.197 -0.133 -0.378) 0.447 ======================= Grid point 12 (8/125) ======================= q-point: ( 0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.620 ( 24.962 29.372 14.769) 41.279 3.379 ( 7.766 31.678 32.745) 46.217 4.428 ( 28.540 17.670 47.827) 58.431 4.862 ( -16.562 -13.479 -15.315) 26.278 4.973 ( -17.567 -17.858 -3.890) 25.350 6.256 ( 8.124 5.719 4.183) 10.780 7.026 ( 0.674 -7.372 -6.568) 9.896 7.200 ( -1.195 -18.232 -3.290) 18.565 7.376 ( -1.891 5.000 3.660) 6.478 7.539 ( -11.006 -5.600 1.008) 12.390 7.926 ( 6.419 -3.053 -8.402) 11.005 8.324 ( -4.695 -1.413 -10.866) 11.921 8.425 ( -1.021 4.595 6.413) 7.955 8.903 ( -8.569 -8.636 -8.126) 14.630 9.373 ( -10.876 5.216 -17.330) 21.115 9.682 ( -9.043 1.871 -1.425) 9.344 9.899 ( -8.013 0.872 3.372) 8.737 9.920 ( 9.595 -10.369 -1.526) 14.209 10.428 ( 8.139 2.365 3.056) 9.010 11.051 ( 2.721 7.844 -5.797) 10.126 11.245 ( 0.693 -3.238 2.914) 4.411 11.585 ( 5.968 4.361 2.170) 7.703 11.847 ( -5.126 -6.059 1.282) 8.039 12.163 ( 6.647 6.837 -0.704) 9.562 15.820 ( -3.320 -5.889 -13.550) 15.143 16.370 ( 1.061 5.850 -0.994) 6.028 16.588 ( 10.358 6.801 3.542) 12.888 17.460 ( -2.764 -2.904 -11.689) 12.357 17.616 ( -1.490 -3.189 -8.301) 9.017 18.814 ( -1.480 -10.824 -14.164) 17.888 23.323 ( 11.277 -2.520 4.803) 12.514 23.527 ( -3.753 14.406 10.011) 17.940 23.939 ( -3.244 1.012 8.047) 8.735 24.495 ( 1.834 -9.953 -3.364) 10.665 24.890 ( 5.855 -1.141 -4.783) 7.646 25.101 ( 3.005 1.229 -0.364) 3.267 25.210 ( 1.323 12.135 6.706) 13.928 25.654 ( 4.212 11.744 3.902) 13.072 26.865 ( -3.674 -17.800 -6.256) 19.222 27.092 ( -27.112 -7.638 -9.199) 29.631 28.382 ( 9.783 -4.222 -1.905) 10.824 28.629 ( -7.320 7.310 6.065) 11.991 29.027 ( 9.608 -0.098 -0.834) 9.644 29.288 ( 9.385 -6.874 0.960) 11.673 29.439 ( 0.945 5.179 -0.771) 5.320 30.377 ( -2.884 6.275 -0.361) 6.915 30.525 ( -2.189 1.302 4.862) 5.489 30.737 ( -2.161 -0.747 -2.515) 3.399 39.668 ( -3.655 -14.565 -1.954) 15.143 40.333 ( 3.361 -21.620 -17.588) 28.073 41.098 ( -0.627 12.706 -2.960) 13.062 41.641 ( -17.822 25.723 -11.698) 33.409 41.950 ( 19.875 -9.222 -5.341) 22.552 42.276 ( 6.176 -13.067 1.428) 14.524 42.955 ( -3.497 3.817 7.063) 8.757 43.269 ( -8.889 5.341 9.507) 14.068 44.588 ( 10.100 14.027 16.976) 24.227 45.393 ( -6.291 -11.136 -0.755) 12.812 48.021 ( 0.350 0.333 -1.596) 1.667 48.276 ( -0.291 -0.026 -0.210) 0.360 ======================= Grid point 13 (9/125) ======================= q-point: ( 0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.332 ( 22.579 20.420 9.994) 32.042 3.875 ( -12.023 12.649 7.732) 19.088 4.368 ( -21.316 -11.992 -7.938) 25.714 4.511 ( -9.192 -7.074 6.768) 13.429 5.460 ( 29.050 5.921 30.573) 42.587 6.326 ( -7.913 6.801 -4.883) 11.520 6.919 ( 5.093 -5.121 -6.696) 9.849 7.016 ( 4.550 -22.616 -3.380) 23.316 7.410 ( -9.385 1.339 4.581) 10.528 7.455 ( 1.002 5.199 1.245) 5.439 7.896 ( 3.147 -4.383 -3.367) 6.360 8.071 ( -5.450 5.034 -18.834) 20.243 8.461 ( -11.628 1.561 10.812) 15.954 8.816 ( 10.431 -4.237 0.492) 11.269 9.060 ( -7.101 1.294 -11.994) 13.999 9.473 ( -13.593 -1.179 -0.638) 13.659 9.853 ( -4.643 2.451 2.433) 5.786 10.068 ( 12.046 -4.028 1.643) 12.808 10.576 ( 2.300 4.935 2.927) 6.182 11.066 ( 4.306 4.036 -7.736) 9.730 11.266 ( -0.632 -0.620 2.982) 3.111 11.704 ( -3.318 -7.568 1.725) 8.441 11.724 ( 5.541 -0.046 -1.585) 5.763 12.275 ( 1.491 5.480 0.176) 5.682 15.650 ( 1.865 -2.461 -6.569) 7.258 16.389 ( -0.669 2.495 -1.388) 2.932 16.849 ( 12.063 5.184 5.607) 14.277 17.256 ( -7.784 -0.360 -8.445) 11.491 17.546 ( 5.197 -0.977 -4.938) 7.235 18.618 ( 4.216 -6.880 -9.776) 12.676 23.453 ( 5.486 -5.226 1.779) 7.783 23.678 ( -3.530 11.302 5.522) 13.065 23.969 ( -4.507 0.725 4.032) 6.091 24.388 ( 0.143 -7.757 -1.646) 7.931 24.867 ( 7.099 -7.002 -5.234) 11.262 25.205 ( 2.002 3.561 3.246) 5.218 25.365 ( 0.065 8.471 2.968) 8.976 25.876 ( 6.245 12.622 4.050) 14.653 26.532 ( -21.443 -6.046 -11.416) 25.033 26.735 ( -1.382 -9.119 4.852) 10.421 28.403 ( 4.827 -10.581 -2.609) 11.919 28.619 ( -5.218 4.732 -0.022) 7.044 29.171 ( 10.960 3.154 -2.247) 11.624 29.339 ( 2.288 -8.250 2.370) 8.883 29.491 ( 2.430 7.192 -0.154) 7.593 30.364 ( -3.295 1.311 -1.033) 3.693 30.558 ( -4.142 -0.000 6.583) 7.778 30.698 ( -0.428 3.372 -0.973) 3.536 39.535 ( 0.852 -7.907 -1.557) 8.103 40.032 ( 8.515 -22.122 -15.822) 28.500 41.187 ( 2.373 10.802 -0.732) 11.084 41.492 ( -15.437 27.650 -10.343) 33.314 42.061 ( 14.203 -8.999 -3.256) 17.126 42.289 ( 7.289 -19.029 6.393) 21.356 42.987 ( -5.093 0.456 5.994) 7.879 43.304 ( -9.549 11.697 6.478) 16.431 44.948 ( 2.797 5.654 8.197) 10.344 45.218 ( -3.782 -4.418 -0.668) 5.854 48.014 ( 0.691 0.379 -1.098) 1.351 48.272 ( -0.240 0.106 0.122) 0.289 ======================= Grid point 14 (10/125) ======================= q-point: (-0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.226 ( -23.945 -16.061 -19.347) 34.722 3.632 ( -31.410 -24.031 -2.637) 39.637 4.192 ( 19.696 16.208 7.858) 26.690 4.833 ( 1.660 21.262 19.241) 28.723 5.908 ( -34.462 3.383 -17.694) 38.886 5.977 ( 11.480 -11.058 7.700) 17.702 6.860 ( 6.883 -18.209 -2.405) 19.614 7.059 ( 16.398 1.160 -1.585) 16.515 7.380 ( -5.434 5.808 4.405) 9.092 7.498 ( -2.009 9.686 -5.125) 11.141 7.842 ( 5.161 0.651 -3.159) 6.086 7.991 ( 5.512 1.252 -2.972) 6.386 8.472 ( -5.156 -2.520 11.371) 12.737 8.825 ( 3.785 3.546 -9.155) 10.522 9.154 ( 13.738 -2.352 10.375) 17.375 9.331 ( -7.818 1.022 4.664) 9.161 9.849 ( -4.253 3.433 3.170) 6.318 10.181 ( 6.512 -0.634 -1.756) 6.775 10.626 ( -4.176 4.579 1.678) 6.420 11.061 ( 4.861 1.973 -8.239) 9.768 11.289 ( -0.995 0.639 3.322) 3.526 11.569 ( -1.327 -9.784 -2.103) 10.095 11.820 ( 3.545 0.559 1.691) 3.968 12.284 ( -3.379 0.910 -0.841) 3.599 15.685 ( 8.074 0.628 1.661) 8.267 16.384 ( 0.152 -0.164 0.141) 0.264 17.017 ( -8.813 -0.987 -3.743) 9.626 17.163 ( 10.757 5.312 5.618) 13.247 17.594 ( 6.677 0.601 -1.964) 6.986 18.598 ( 11.771 -2.667 -5.608) 13.308 23.427 ( -2.501 -8.113 -0.311) 8.496 23.709 ( -8.094 7.854 -0.426) 11.286 23.916 ( -4.707 0.064 -1.593) 4.969 24.392 ( 5.896 -1.683 1.463) 6.304 24.875 ( 8.027 -10.253 0.120) 13.022 25.248 ( -3.234 2.875 2.050) 4.788 25.383 ( -5.949 2.270 -1.651) 6.578 26.002 ( -16.453 1.495 -1.561) 16.594 26.241 ( 11.957 3.103 -0.191) 12.355 26.855 ( 6.514 5.866 8.471) 12.190 28.290 ( 3.425 -15.441 -6.656) 17.160 28.585 ( -4.347 3.750 0.051) 5.741 29.241 ( 1.146 -7.387 0.096) 7.476 29.358 ( 6.248 4.410 -3.513) 8.416 29.593 ( -0.763 8.464 1.908) 8.710 30.291 ( -1.727 -6.629 0.357) 6.860 30.550 ( -5.931 -1.626 5.511) 8.258 30.767 ( 1.506 9.801 1.131) 9.980 39.525 ( 5.726 0.414 -3.560) 6.755 39.865 ( 15.800 -24.253 -8.114) 30.061 41.269 ( 0.609 13.724 -10.293) 17.166 41.459 ( -8.915 21.651 4.201) 23.789 42.139 ( 11.449 -12.121 0.931) 16.699 42.313 ( 7.268 -17.300 4.767) 19.360 42.973 ( -6.494 0.320 5.261) 8.364 43.340 ( -10.529 15.550 4.519) 19.315 44.807 ( -10.974 -10.754 -6.683) 16.756 45.325 ( 2.572 9.054 4.566) 10.461 48.021 ( 1.010 0.378 -0.322) 1.125 48.274 ( -0.102 0.193 0.428) 0.481 ======================= Grid point 15 (11/125) ======================= q-point: (-0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.455 ( -30.522 -13.237 -22.125) 39.954 2.872 ( -39.633 -32.630 1.156) 51.350 4.694 ( 2.822 13.202 -2.212) 13.680 4.849 ( -30.934 0.350 -12.449) 33.347 5.350 ( -6.432 15.545 8.194) 18.712 6.009 ( 4.726 -15.144 -3.804) 16.314 6.856 ( 11.473 -10.647 0.421) 15.658 7.231 ( 8.256 3.222 -1.880) 9.060 7.405 ( -1.740 7.073 -0.124) 7.285 7.488 ( 1.325 7.812 -6.001) 9.939 8.034 ( 14.779 -3.836 5.623) 16.271 8.079 ( 5.579 4.634 1.857) 7.487 8.524 ( -0.474 -1.830 5.238) 5.569 8.888 ( 8.728 5.208 -3.486) 10.745 9.315 ( 3.494 2.044 4.756) 6.245 9.500 ( 10.229 -3.671 10.083) 14.825 9.895 ( -3.249 5.189 10.102) 11.812 10.202 ( 0.605 2.529 -3.194) 4.119 10.612 ( -2.114 1.497 1.196) 2.853 11.023 ( 3.688 1.440 -10.665) 11.376 11.340 ( -0.979 2.744 4.956) 5.748 11.467 ( -2.460 -6.718 0.865) 7.207 11.850 ( -0.875 -1.508 -0.297) 1.769 12.188 ( -5.525 -3.411 -2.108) 6.826 15.905 ( 12.741 2.552 7.361) 14.934 16.382 ( -0.714 -1.661 0.411) 1.854 16.803 ( -13.110 -1.686 -2.361) 13.427 17.458 ( 12.705 4.613 6.623) 15.052 17.692 ( 7.901 1.021 0.647) 7.993 18.771 ( 19.681 0.940 -1.348) 19.749 23.270 ( -8.613 -9.320 0.318) 12.695 23.577 ( -12.454 3.950 -4.584) 13.846 23.829 ( -3.960 1.745 -3.504) 5.568 24.500 ( 8.414 -0.225 -2.146) 8.686 24.917 ( 3.513 -10.753 6.578) 13.086 25.223 ( -7.819 -0.342 -6.378) 10.096 25.244 ( -4.448 5.011 1.811) 6.941 25.724 ( -16.913 -5.507 3.751) 18.178 26.604 ( 25.209 10.442 -0.430) 27.289 27.146 ( 9.875 8.623 9.311) 16.080 28.142 ( 5.267 -14.104 -6.310) 16.325 28.561 ( -4.732 4.147 1.290) 6.423 29.159 ( -4.354 -3.185 -2.383) 5.897 29.427 ( 5.085 2.046 -4.128) 6.862 29.589 ( -7.476 0.386 0.579) 7.508 30.270 ( 2.572 -4.365 3.121) 5.951 30.506 ( -6.242 -0.378 3.074) 6.968 30.898 ( 1.995 8.992 3.358) 9.803 39.577 ( 11.387 3.075 -11.480) 16.459 39.927 ( 20.341 -20.007 6.641) 29.294 41.206 ( -4.132 15.501 -12.976) 20.633 41.659 ( 0.228 11.551 13.771) 17.976 42.211 ( 10.758 -14.079 2.844) 17.946 42.320 ( 6.365 -8.977 -1.895) 11.166 42.946 ( -7.971 -0.686 7.787) 11.165 43.364 ( -11.531 17.808 2.567) 21.370 44.432 ( -16.137 -11.889 -7.940) 21.559 45.424 ( 0.583 6.352 -2.621) 6.897 48.039 ( 1.023 0.298 0.378) 1.131 48.281 ( 0.035 0.186 0.484) 0.520 ======================= Grid point 16 (12/125) ======================= q-point: (-0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.701 ( -37.689 0.460 -12.672) 39.765 2.065 ( -43.933 -33.894 7.951) 56.055 3.585 ( -69.844 -2.379 -28.848) 75.605 5.167 ( 18.915 6.751 2.551) 20.245 5.565 ( -1.438 11.440 9.876) 15.182 5.832 ( -0.631 -13.273 -8.786) 15.930 7.007 ( 12.571 -1.776 3.594) 13.195 7.318 ( 4.470 1.239 -2.908) 5.475 7.432 ( 5.980 3.290 -3.154) 7.519 7.591 ( 8.162 5.304 1.108) 9.797 8.184 ( 3.885 -4.635 10.803) 12.381 8.303 ( 11.862 3.886 1.693) 12.596 8.515 ( -2.106 -0.566 -1.741) 2.791 8.940 ( 3.483 2.091 -11.944) 12.616 9.504 ( 12.978 2.007 3.234) 13.524 9.683 ( 4.640 -3.389 11.952) 13.262 10.008 ( -3.429 6.665 1.456) 7.636 10.256 ( -1.839 3.836 13.060) 13.735 10.630 ( 9.123 -7.002 -3.803) 12.113 10.958 ( 5.468 3.790 -12.806) 14.431 11.375 ( -1.746 -0.070 0.161) 1.755 11.456 ( -7.679 5.962 12.086) 15.511 11.741 ( -8.056 -4.942 -2.534) 9.785 12.054 ( -3.726 -5.346 -3.388) 7.344 16.203 ( 9.941 3.033 7.479) 12.804 16.347 ( 0.671 -2.259 -0.811) 2.492 16.575 ( -13.886 -2.040 -1.102) 14.078 17.731 ( 11.694 3.422 4.653) 13.043 17.839 ( 9.174 0.601 1.579) 9.328 19.110 ( 24.906 2.502 1.874) 25.101 23.078 ( -11.545 -6.675 3.248) 13.725 23.346 ( -13.378 1.055 -5.753) 14.601 23.751 ( -4.086 2.377 -3.275) 5.751 24.534 ( 3.681 -2.318 -3.920) 5.855 24.864 ( -9.598 -5.607 1.707) 11.246 25.146 ( 3.292 1.796 -0.310) 3.763 25.272 ( -0.688 4.005 2.634) 4.843 25.524 ( -13.146 -6.215 5.279) 15.470 27.050 ( 28.626 12.669 -4.820) 31.673 27.452 ( 13.648 -3.914 10.021) 17.379 28.102 ( 6.646 -1.583 -2.647) 7.327 28.556 ( -5.253 4.854 3.615) 8.014 28.984 ( -8.922 -3.824 -8.242) 12.734 29.410 ( -2.869 -0.204 -3.203) 4.305 29.472 ( -6.707 -4.633 3.050) 8.703 30.336 ( 3.180 -0.343 2.675) 4.170 30.453 ( -4.361 0.343 0.972) 4.481 31.038 ( 2.598 5.497 4.406) 7.509 39.627 ( 14.729 -0.468 -12.106) 19.072 40.239 ( 20.987 -8.076 14.474) 26.743 41.118 ( -3.962 9.024 -8.747) 13.177 41.924 ( 2.628 1.115 15.143) 15.410 42.280 ( 8.218 -9.523 3.563) 13.074 42.307 ( 7.952 3.624 -12.379) 15.153 42.934 ( -8.201 -4.913 13.357) 16.426 43.347 ( -11.450 17.612 -4.577) 21.500 44.018 ( -20.119 -10.689 -0.461) 22.787 45.381 ( -0.200 2.302 -10.619) 10.867 48.059 ( 0.621 0.132 0.549) 0.839 48.288 ( 0.159 0.107 0.283) 0.342 ======================= Grid point 17 (13/125) ======================= q-point: (-0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.217 ( -43.519 14.792 17.495) 49.181 1.345 ( -47.342 -15.094 19.877) 53.518 2.223 ( -77.537 1.018 -21.474) 80.462 5.439 ( 13.584 2.792 -1.419) 13.940 5.627 ( 0.767 -10.434 -6.763) 12.458 5.708 ( -4.307 7.545 7.425) 11.428 7.213 ( 9.132 1.107 3.793) 9.950 7.315 ( 2.277 -0.981 -3.037) 3.920 7.584 ( 14.808 1.776 -2.749) 15.166 7.739 ( 8.163 -2.190 0.659) 8.477 8.329 ( 1.432 -0.319 4.273) 4.518 8.431 ( -3.673 0.200 -1.267) 3.890 8.481 ( 6.729 0.852 0.135) 6.784 8.810 ( -0.510 -0.268 -4.400) 4.437 9.707 ( 12.973 -2.823 -2.162) 13.451 9.851 ( 1.079 -1.178 10.494) 10.615 9.996 ( -1.656 8.914 -5.324) 10.514 10.374 ( -4.099 -4.966 6.120) 8.884 10.685 ( 13.612 -4.587 -0.366) 14.368 10.954 ( 11.517 4.727 -14.883) 19.403 11.330 ( -5.323 -0.490 0.495) 5.369 11.457 ( -12.638 -1.966 -2.209) 12.979 11.681 ( -1.145 5.374 13.470) 14.547 11.891 ( -8.619 -3.092 -2.295) 9.440 16.239 ( -4.665 0.309 0.320) 4.686 16.353 ( -11.050 -0.346 -0.091) 11.055 16.504 ( 10.775 0.027 -0.001) 10.776 17.931 ( 9.616 -0.011 -0.023) 9.616 17.969 ( 7.265 0.033 0.071) 7.265 19.488 ( 22.964 0.016 -0.040) 22.964 22.930 ( -12.627 -0.447 4.745) 13.496 23.134 ( -9.293 0.381 -1.962) 9.506 23.673 ( -4.029 0.273 -1.500) 4.308 24.512 ( -0.481 0.005 -0.414) 0.634 24.713 ( -8.284 -0.688 0.968) 8.368 25.201 ( 2.704 1.110 -4.297) 5.197 25.339 ( 0.948 4.427 0.903) 4.617 25.392 ( -7.002 -5.245 5.093) 10.123 27.461 ( 26.366 11.323 -8.329) 29.879 27.691 ( 18.998 -19.938 8.797) 28.911 28.244 ( 5.548 13.679 2.462) 14.966 28.558 ( -9.015 2.968 0.340) 9.497 28.669 ( -10.333 -7.810 -4.805) 13.815 29.328 ( -4.111 -0.816 -0.272) 4.200 29.374 ( -9.753 0.711 0.835) 9.815 30.395 ( 1.787 -0.033 1.530) 2.353 30.419 ( -1.108 0.045 -0.641) 1.281 31.135 ( 4.123 0.054 -2.955) 5.073 39.711 ( 11.755 -0.344 -1.842) 11.904 40.686 ( 18.111 2.950 15.657) 24.122 41.036 ( -2.610 -2.280 -2.281) 4.149 41.977 ( -4.042 -2.813 -2.095) 5.352 42.313 ( 13.977 -2.316 -14.612) 20.353 42.476 ( 7.684 7.227 11.851) 15.866 42.937 ( -6.735 -7.021 10.424) 14.259 43.139 ( -12.034 4.976 -17.525) 21.834 43.770 ( -17.104 -0.253 5.585) 17.994 45.248 ( -1.144 -0.140 -4.667) 4.807 48.068 ( 0.120 0.000 0.015) 0.121 48.293 ( 0.240 -0.000 0.003) 0.240 ======================= Grid point 19 (14/125) ======================= q-point: ( 0.11 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.622 ( -14.922 14.569 30.583) 37.017 2.091 ( -8.680 10.915 43.774) 45.942 3.661 ( -24.329 50.119 50.347) 75.091 5.338 ( 10.708 -2.268 -9.093) 14.229 5.509 ( 10.322 -4.616 -1.020) 11.353 5.844 ( -11.915 -6.030 4.728) 14.166 7.066 ( 3.475 -12.126 -4.372) 13.350 7.355 ( 2.453 0.269 -1.150) 2.723 7.566 ( -1.118 -10.691 -2.155) 10.963 7.687 ( 7.937 0.184 -4.224) 8.993 8.007 ( -3.603 -0.784 0.501) 3.722 8.306 ( -1.420 -1.412 -3.008) 3.614 8.557 ( 5.409 -2.534 -3.996) 7.187 9.215 ( 3.515 -4.774 -16.834) 17.847 9.500 ( 6.835 -0.283 9.990) 12.108 9.626 ( 0.135 -3.569 -13.212) 13.686 9.746 ( 4.294 -7.616 -3.775) 9.523 10.110 ( -3.430 1.024 0.690) 3.645 10.601 ( -0.353 3.432 -8.075) 8.781 11.053 ( -1.322 15.416 -10.171) 18.516 11.264 ( -1.004 -6.094 6.727) 9.132 11.428 ( -3.081 5.526 4.353) 7.679 11.655 ( -2.316 6.440 4.549) 8.218 12.111 ( -0.736 -8.261 0.912) 8.343 16.105 ( 4.886 -7.073 -13.739) 16.207 16.299 ( -0.861 3.566 -1.795) 4.084 16.378 ( -8.513 9.311 1.220) 12.675 17.654 ( 3.126 -6.941 -13.694) 15.667 17.810 ( 1.542 -1.868 -8.910) 9.234 19.149 ( 4.293 -13.930 -17.632) 22.877 22.990 ( -6.696 0.054 8.958) 11.184 23.403 ( -1.432 17.803 12.957) 22.065 23.893 ( 2.935 -0.499 7.790) 8.339 24.572 ( -10.119 -3.318 1.279) 10.725 24.713 ( 0.152 -0.575 -2.495) 2.565 25.018 ( -3.394 13.513 2.400) 14.138 25.212 ( 1.943 -1.542 -2.109) 3.256 25.399 ( -1.115 2.218 1.098) 2.714 27.277 ( 3.873 -19.233 -11.670) 22.827 27.662 ( 24.674 -3.030 -7.754) 26.040 28.086 ( -7.655 -6.320 -0.851) 9.964 28.583 ( 3.405 0.693 5.355) 6.383 29.029 ( -12.391 -0.051 8.476) 15.013 29.187 ( -5.238 3.714 -5.001) 8.139 29.357 ( -3.903 9.942 1.864) 10.842 30.362 ( 5.166 -1.807 0.007) 5.473 30.452 ( 0.150 0.654 1.928) 2.041 30.873 ( -1.101 9.548 -5.611) 11.129 40.083 ( 5.409 -19.398 -16.905) 26.293 40.233 ( 4.085 -24.604 13.511) 28.366 41.208 ( -0.349 11.105 0.007) 11.111 41.447 ( 0.875 -2.220 -23.268) 23.390 42.169 ( 0.590 2.049 -10.960) 11.166 42.402 ( -12.425 3.402 -8.006) 15.168 42.798 ( 3.838 12.310 10.417) 16.576 43.304 ( 6.004 4.312 8.281) 11.100 44.022 ( -9.438 11.280 21.712) 26.224 45.650 ( 4.057 -7.604 1.431) 8.736 48.035 ( -0.120 0.248 -1.621) 1.644 48.284 ( 0.204 -0.143 -0.376) 0.452 ======================= Grid point 20 (15/125) ======================= q-point: ( 0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.129 ( 8.653 21.798 27.012) 35.772 2.805 ( 17.716 16.719 42.880) 49.317 4.357 ( -15.284 43.394 48.322) 66.721 5.268 ( -3.688 -1.239 -11.773) 12.399 5.364 ( -11.599 -17.254 -4.253) 21.221 5.898 ( 12.021 -2.749 9.340) 15.469 6.949 ( 4.267 -13.795 -6.811) 15.966 7.336 ( -7.193 -13.445 -4.524) 15.905 7.390 ( 0.731 -1.541 1.011) 1.983 7.681 ( 4.270 -4.808 -6.263) 8.976 7.957 ( -9.784 2.374 0.957) 10.114 8.286 ( 3.748 -1.117 0.680) 3.970 8.503 ( -2.627 -2.160 -5.031) 6.073 9.016 ( 4.433 1.825 -20.596) 21.147 9.457 ( 3.770 3.527 -19.661) 20.327 9.638 ( -2.318 -10.190 11.237) 15.346 9.846 ( 18.124 -5.735 2.518) 19.175 10.037 ( -8.962 -1.636 2.270) 9.388 10.476 ( -10.398 5.731 -4.840) 12.821 11.034 ( -0.656 12.716 -10.195) 16.311 11.240 ( -3.116 -5.966 5.176) 8.491 11.473 ( 0.148 4.940 2.930) 5.745 11.873 ( 12.045 7.899 1.274) 14.460 12.006 ( -4.909 -7.599 1.496) 9.169 15.871 ( 0.273 -9.110 -17.488) 19.721 16.382 ( 4.044 8.341 2.290) 9.549 16.388 ( -4.049 9.493 1.734) 10.465 17.443 ( 1.356 -7.025 -15.912) 17.447 17.693 ( -1.243 -0.770 -9.003) 9.121 18.831 ( 0.183 -14.165 -19.049) 23.739 23.077 ( 2.631 1.009 8.054) 8.533 23.675 ( -4.490 17.198 11.495) 21.168 23.998 ( 0.382 -1.118 8.576) 8.657 24.435 ( -2.129 -6.403 -1.083) 6.834 24.724 ( 5.792 -4.568 -2.493) 7.786 25.073 ( -2.039 3.283 -0.482) 3.894 25.264 ( -1.798 10.608 7.683) 13.221 25.498 ( 5.388 8.374 2.453) 10.256 26.983 ( -3.423 -19.207 -8.660) 21.346 27.778 ( -16.255 -1.905 -11.378) 19.933 27.904 ( 19.804 -5.066 -4.831) 21.005 28.734 ( 9.034 -3.030 5.374) 10.939 28.929 ( -13.962 2.257 6.741) 15.667 29.127 ( 2.041 -4.234 -1.427) 4.912 29.432 ( -1.027 8.211 2.047) 8.525 30.421 ( 2.049 1.120 1.217) 2.634 30.511 ( 2.217 1.965 3.295) 4.431 30.845 ( -4.373 7.291 -4.530) 9.634 39.745 ( -0.485 -20.270 -10.240) 22.715 40.194 ( 4.097 -25.998 -4.916) 26.774 41.107 ( -0.307 11.491 -17.837) 21.220 41.453 ( 10.881 2.340 -0.665) 11.149 42.070 ( -3.716 12.642 -13.652) 18.974 42.214 ( -7.606 -3.072 1.413) 8.324 43.029 ( -0.209 4.561 11.148) 12.047 43.442 ( -1.913 2.380 7.544) 8.138 44.364 ( 3.704 14.705 21.392) 26.222 45.563 ( -4.006 -10.044 -1.542) 10.923 48.016 ( -0.066 0.497 -1.908) 1.972 48.280 ( 0.005 -0.055 -0.269) 0.275 ======================= Grid point 21 (16/125) ======================= q-point: ( 0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.761 ( 14.879 24.546 19.181) 34.522 3.731 ( 23.209 17.600 35.846) 46.188 4.807 ( -19.920 -11.241 -7.719) 24.141 5.005 ( -9.834 -3.064 -1.492) 10.408 5.130 ( -10.470 20.547 33.302) 40.507 6.179 ( 13.231 -1.569 6.763) 14.942 6.796 ( 4.660 -16.895 -9.469) 19.920 7.051 ( -5.410 -16.784 -3.528) 17.984 7.408 ( 1.243 -2.397 -0.481) 2.743 7.616 ( 0.501 -3.133 -3.490) 4.717 7.847 ( -7.867 6.830 -0.557) 10.433 8.225 ( -3.492 -2.114 -13.118) 13.738 8.510 ( 4.337 2.768 7.533) 9.122 8.857 ( -3.693 -0.352 -9.681) 10.367 9.268 ( -2.856 3.376 -18.588) 19.107 9.702 ( 9.258 -7.132 3.943) 12.334 9.862 ( -11.241 1.260 -5.278) 12.482 10.019 ( -1.427 -8.377 9.631) 12.844 10.415 ( 1.233 7.887 2.164) 8.271 10.997 ( 0.662 6.896 -9.576) 11.819 11.236 ( 1.938 -1.651 0.492) 2.593 11.575 ( 2.899 4.359 3.001) 6.034 11.814 ( -2.228 -14.778 -2.678) 15.183 12.153 ( 6.060 11.545 3.265) 13.442 15.615 ( 0.705 -6.479 -14.066) 15.503 16.426 ( -2.544 7.184 -0.415) 7.632 16.571 ( 7.331 7.903 4.320) 11.613 17.249 ( 4.109 -3.881 -13.958) 15.059 17.561 ( -3.394 0.181 -6.565) 7.392 18.529 ( 1.810 -10.796 -15.888) 19.294 23.230 ( 7.175 -1.092 4.801) 8.702 23.796 ( -5.102 9.766 4.259) 11.812 24.085 ( -2.412 0.308 5.918) 6.398 24.375 ( 0.792 -6.934 1.315) 7.102 24.705 ( 4.985 -7.766 -4.533) 10.282 25.094 ( 1.541 2.296 2.782) 3.922 25.448 ( -3.548 15.333 8.717) 17.991 25.707 ( 7.267 10.842 3.452) 13.501 26.722 ( -2.957 -12.828 -4.057) 13.776 27.299 ( -25.806 -7.089 -8.355) 28.036 28.095 ( 18.368 -5.116 -5.061) 19.727 28.739 ( 0.887 -3.893 -10.527) 11.259 28.957 ( -1.141 2.207 10.487) 10.777 29.165 ( 6.034 -5.422 5.120) 9.593 29.489 ( -1.088 5.926 1.011) 6.110 30.466 ( -1.395 5.107 0.869) 5.365 30.602 ( 1.389 0.787 5.144) 5.386 30.768 ( -5.179 3.613 -3.544) 7.241 39.507 ( 2.442 -14.138 -8.970) 16.921 39.879 ( 0.829 -27.018 -12.582) 29.816 41.080 ( 5.585 15.312 -13.410) 21.107 41.594 ( 10.166 2.226 -5.881) 11.953 41.962 ( -9.492 18.237 -7.479) 21.877 42.159 ( 0.681 -15.453 8.467) 17.634 43.131 ( -4.162 -1.797 10.045) 11.021 43.512 ( -4.593 7.740 5.753) 10.682 44.791 ( 6.312 12.938 17.268) 22.481 45.384 ( -6.356 -9.154 -2.068) 11.335 47.999 ( 0.276 0.611 -1.886) 2.002 48.277 ( -0.118 0.071 -0.057) 0.149 ======================= Grid point 22 (17/125) ======================= q-point: ( 0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.364 ( 15.521 20.163 12.878) 28.518 4.180 ( -26.753 -4.798 -6.257) 27.890 4.494 ( -7.422 -1.616 4.540) 8.849 4.662 ( 0.701 -6.045 14.179) 15.430 5.709 ( 0.113 18.172 26.507) 32.138 6.350 ( 5.438 -0.392 1.387) 5.625 6.602 ( 9.714 -19.969 -9.770) 24.261 6.853 ( -4.859 -8.297 -4.263) 10.518 7.395 ( 3.352 -6.019 2.255) 7.249 7.565 ( -0.816 3.682 -6.760) 7.742 7.843 ( -3.743 3.907 -0.255) 5.417 8.001 ( -3.893 6.098 -10.773) 12.977 8.644 ( 0.776 -9.648 -1.899) 9.864 8.758 ( -3.121 7.396 9.860) 12.714 9.019 ( -6.232 1.417 -11.272) 12.957 9.629 ( -11.277 -1.334 -2.290) 11.584 9.874 ( 11.993 5.164 -1.811) 13.182 9.992 ( -5.249 -8.868 8.727) 13.504 10.607 ( 6.597 7.952 3.976) 11.071 10.939 ( 2.129 0.716 -8.143) 8.447 11.266 ( 3.691 2.041 -2.848) 5.089 11.589 ( -0.267 -10.121 -5.114) 11.343 11.722 ( 1.548 -1.816 5.304) 5.816 12.314 ( 1.677 7.057 1.452) 7.398 15.489 ( 5.489 -2.752 -7.278) 9.522 16.407 ( -2.242 2.098 -2.489) 3.952 16.808 ( 9.823 6.155 5.454) 12.811 17.169 ( 4.474 0.833 -9.827) 10.830 17.471 ( -1.571 1.318 -2.273) 3.061 18.344 ( 5.860 -7.118 -11.898) 15.052 23.349 ( 6.563 -3.724 1.698) 7.735 23.842 ( -1.670 6.983 0.697) 7.214 24.050 ( -2.891 -3.983 -1.329) 5.098 24.347 ( -1.921 -3.301 0.455) 3.846 24.686 ( 3.734 -6.587 2.810) 8.076 25.190 ( 4.410 0.217 2.496) 5.072 25.579 ( -7.030 14.111 5.287) 16.628 25.914 ( 5.678 8.189 1.695) 10.108 26.610 ( -6.208 4.378 -5.637) 9.460 26.832 ( -17.033 -13.743 4.522) 22.348 28.153 ( 8.395 -11.673 -7.513) 16.223 28.633 ( 4.634 -1.760 -6.432) 8.120 29.036 ( 2.483 0.530 0.409) 2.572 29.285 ( 4.446 -4.282 5.004) 7.947 29.560 ( 0.698 8.888 3.478) 9.569 30.443 ( -7.116 0.707 -0.158) 7.153 30.666 ( -1.351 -2.442 5.892) 6.520 30.731 ( 0.143 7.434 -1.902) 7.675 39.365 ( 6.614 -8.458 -11.323) 15.604 39.574 ( 4.021 -23.800 -6.817) 25.081 41.151 ( 7.011 17.747 -13.298) 23.258 41.617 ( 3.767 9.209 -12.597) 16.052 41.950 ( -4.281 5.835 4.306) 8.421 42.163 ( 3.332 -20.818 11.658) 24.092 43.149 ( -5.546 -2.010 7.944) 9.894 43.574 ( -5.905 11.691 3.583) 13.579 45.037 ( -3.782 -2.453 3.134) 5.490 45.276 ( -0.614 3.975 5.151) 6.535 47.991 ( 0.887 0.571 -1.448) 1.792 48.278 ( -0.108 0.182 0.218) 0.304 ======================= Grid point 23 (18/125) ======================= q-point: (-0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.395 ( -31.265 -3.499 -6.397) 32.104 3.884 ( -25.477 -13.375 2.492) 28.882 4.158 ( 7.922 6.917 4.032) 11.263 5.147 ( 9.587 9.744 19.234) 23.597 5.904 ( -3.562 -3.348 3.654) 6.103 6.186 ( -23.997 -0.722 -10.763) 26.310 6.567 ( 6.859 -14.248 -6.055) 16.933 6.828 ( 17.364 5.031 1.131) 18.114 7.456 ( -2.300 9.021 -17.013) 19.393 7.477 ( 3.804 -3.906 7.239) 9.063 7.751 ( 2.678 -5.883 -0.364) 6.474 8.046 ( -3.664 14.084 4.417) 15.208 8.532 ( -1.021 -9.122 -0.730) 9.208 8.781 ( -2.261 5.211 -2.751) 6.311 9.064 ( 8.643 -3.357 7.712) 12.060 9.514 ( -6.064 3.624 4.356) 8.299 9.967 ( -0.796 -8.490 7.108) 11.101 10.059 ( 7.829 11.707 -3.214) 14.446 10.706 ( -2.479 0.685 -0.937) 2.737 10.899 ( 4.314 -1.375 -6.131) 7.622 11.303 ( 3.725 4.874 -3.548) 7.086 11.478 ( 2.388 -10.465 1.795) 10.883 11.797 ( 1.923 0.859 1.851) 2.804 12.342 ( -3.737 1.903 -0.279) 4.203 15.555 ( 11.496 0.022 -0.275) 11.499 16.378 ( 0.241 0.399 -0.892) 1.006 17.025 ( 3.779 0.198 -0.275) 3.794 17.138 ( 5.037 5.505 -0.509) 7.479 17.494 ( 4.209 1.286 -0.114) 4.403 18.303 ( 12.103 -3.781 -8.198) 15.099 23.383 ( 1.687 -5.772 0.754) 6.061 23.857 ( -4.644 6.600 -2.225) 8.371 23.954 ( -3.486 -3.073 -1.204) 4.800 24.291 ( 3.050 -2.954 -4.859) 6.453 24.771 ( 3.481 -4.876 9.939) 11.605 25.246 ( 2.320 -2.199 0.097) 3.198 25.584 ( -12.809 10.689 0.612) 16.695 26.076 ( 11.058 6.700 -1.052) 12.973 26.287 ( -22.259 -3.614 -1.674) 22.613 26.903 ( 6.730 1.378 11.272) 13.201 28.003 ( 4.571 -13.257 -11.775) 18.311 28.668 ( 1.640 1.702 2.024) 3.111 29.079 ( 7.733 -2.420 -3.404) 8.789 29.311 ( 0.115 -0.329 -0.853) 0.921 29.705 ( 0.042 8.542 3.658) 9.293 30.311 ( -6.887 -5.731 1.151) 9.033 30.678 ( -4.155 -0.846 4.842) 6.436 30.811 ( 3.457 7.615 -0.850) 8.406 39.256 ( 11.030 -8.287 -15.241) 20.558 39.511 ( 9.452 -13.560 5.558) 17.439 41.213 ( 4.607 19.934 -17.181) 26.717 41.617 ( 4.730 5.720 -5.316) 9.130 42.006 ( -0.734 -2.848 8.463) 8.960 42.185 ( 3.934 -18.498 9.966) 21.377 43.146 ( -6.011 -0.192 6.996) 9.226 43.615 ( -6.560 13.703 0.400) 15.197 44.835 ( -12.353 -8.458 -2.826) 15.236 45.416 ( 0.470 6.697 3.143) 7.413 48.000 ( 1.537 0.453 -0.632) 1.722 48.282 ( -0.052 0.209 0.383) 0.440 ======================= Grid point 24 (19/125) ======================= q-point: (-0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.825 ( -40.507 6.808 -0.615) 41.079 3.259 ( -40.325 -24.901 7.924) 48.052 4.560 ( 21.656 10.409 1.287) 24.062 5.328 ( -45.371 2.954 -10.409) 46.643 5.515 ( 3.619 -10.676 -1.531) 11.377 5.878 ( -7.741 3.144 0.609) 8.378 6.609 ( 15.333 -4.736 0.232) 16.049 7.087 ( 10.267 5.227 -3.829) 12.141 7.351 ( 5.988 7.865 -10.922) 14.731 7.523 ( -4.559 -1.703 2.574) 5.505 7.848 ( 13.023 -9.525 5.905) 17.181 8.178 ( -1.487 12.532 6.330) 14.118 8.476 ( 4.150 -4.082 -3.436) 6.760 8.838 ( 2.767 4.476 1.567) 5.490 9.159 ( 9.223 -9.733 -1.086) 13.453 9.649 ( -0.070 6.757 13.925) 15.478 10.036 ( 8.623 -4.995 5.742) 11.501 10.176 ( -1.740 15.337 -3.957) 15.934 10.595 ( -2.411 -8.531 -2.642) 9.251 10.823 ( 1.797 -6.399 -8.182) 10.541 11.365 ( 3.459 5.646 -3.239) 7.371 11.547 ( 1.666 1.698 9.555) 9.846 11.820 ( 0.752 -0.789 -1.410) 1.782 12.244 ( -7.852 -2.738 -1.074) 8.385 15.781 ( 16.127 0.998 3.614) 16.557 16.388 ( -0.292 0.766 0.653) 1.048 16.917 ( -8.269 -1.605 -3.306) 9.049 17.373 ( 12.964 4.058 3.322) 13.985 17.583 ( 7.358 -0.139 0.653) 7.388 18.439 ( 20.370 -0.773 -4.006) 20.774 23.333 ( -4.490 -5.893 3.104) 8.033 23.735 ( -12.181 4.522 -5.194) 13.993 23.880 ( -5.157 0.444 0.077) 5.177 24.303 ( 10.409 -2.544 -5.522) 12.055 24.923 ( 3.527 -2.870 11.787) 12.634 25.229 ( -1.633 -2.901 -0.486) 3.364 25.420 ( -15.218 8.676 -4.985) 18.213 25.984 ( -18.123 -7.498 5.264) 20.307 26.337 ( 19.882 10.344 -3.890) 22.747 27.129 ( 8.715 -6.360 8.870) 13.967 27.886 ( 7.883 -1.485 -9.081) 12.117 28.722 ( -4.763 4.200 6.670) 9.209 29.110 ( 4.432 -5.237 -3.300) 7.613 29.307 ( 3.344 5.002 -5.437) 8.110 29.697 ( -8.187 -2.005 0.191) 8.431 30.261 ( 0.654 -2.238 3.742) 4.409 30.645 ( -7.215 -0.201 3.608) 8.069 30.911 ( 5.611 4.799 -2.124) 7.683 39.221 ( 13.698 -5.424 -9.904) 17.752 39.718 ( 15.733 -4.724 11.292) 19.934 41.185 ( 0.368 14.774 -16.130) 21.877 41.719 ( 11.008 -2.828 0.266) 11.369 42.083 ( 0.243 -7.400 12.058) 14.149 42.209 ( 3.384 -4.870 1.747) 6.182 43.144 ( -6.347 -1.048 7.807) 10.116 43.605 ( -7.128 13.431 -5.749) 16.255 44.546 ( -17.098 -6.446 0.459) 18.279 45.428 ( -2.358 2.172 -4.740) 5.723 48.024 ( 1.764 0.270 0.096) 1.787 48.287 ( -0.033 0.126 0.286) 0.314 ======================= Grid point 25 (20/125) ======================= q-point: (-0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.423 ( -42.282 15.427 14.485) 47.282 2.624 ( -43.674 -16.429 16.628) 49.537 4.267 ( -66.684 0.993 -18.102) 69.104 4.919 ( 21.609 4.352 -4.041) 22.410 5.493 ( 9.240 -17.109 -9.247) 21.532 5.896 ( -8.373 10.994 9.849) 16.970 6.871 ( 16.055 3.427 4.915) 17.137 7.161 ( 8.140 5.718 -7.631) 12.537 7.417 ( -6.048 -3.783 -0.942) 7.195 7.457 ( 11.209 -1.253 -1.550) 11.385 8.056 ( 16.337 -8.357 5.938) 19.287 8.338 ( 0.577 8.591 4.047) 9.514 8.460 ( 3.227 1.563 -6.280) 7.231 8.856 ( -1.787 -1.475 -1.382) 2.698 9.276 ( 15.441 -4.526 1.495) 16.160 9.847 ( 0.065 4.958 10.795) 11.880 10.149 ( -8.895 6.794 -1.640) 11.312 10.204 ( 17.290 -8.130 -7.839) 20.652 10.517 ( -1.097 -1.843 4.740) 5.203 10.709 ( 3.678 -5.483 -6.594) 9.331 11.401 ( 0.680 4.080 -2.384) 4.774 11.707 ( -1.520 9.194 6.629) 11.436 11.758 ( -4.192 -3.150 -3.244) 6.166 12.098 ( -7.436 -4.614 2.606) 9.131 16.063 ( 17.545 -0.134 1.233) 17.589 16.378 ( -4.197 1.687 1.516) 4.771 16.728 ( -11.448 -1.707 -2.354) 11.812 17.597 ( 13.180 0.007 0.193) 13.182 17.713 ( 9.636 0.092 0.544) 9.652 18.749 ( 26.521 0.322 -0.458) 26.527 23.261 ( -8.728 -2.941 6.987) 11.561 23.498 ( -15.417 3.081 -5.708) 16.726 23.810 ( -5.551 0.592 -0.368) 5.595 24.388 ( 9.676 -0.429 -2.331) 9.962 25.045 ( -9.176 -5.246 10.834) 15.136 25.124 ( -2.070 4.255 -3.615) 5.955 25.299 ( -1.563 5.348 -4.664) 7.266 25.751 ( -15.861 -6.394 4.645) 17.721 26.688 ( 26.047 10.831 -6.367) 28.919 27.237 ( 12.713 -20.948 4.756) 24.961 28.009 ( 9.906 12.994 -1.274) 16.389 28.768 ( -6.946 6.162 7.904) 12.195 28.985 ( -8.204 -6.710 -5.434) 11.910 29.355 ( 5.080 5.853 -5.986) 9.793 29.545 ( -6.610 -7.067 2.257) 9.936 30.328 ( 2.715 0.470 2.739) 3.885 30.563 ( -8.400 -0.150 1.476) 8.530 30.977 ( 6.759 0.256 -5.595) 8.778 39.320 ( 14.828 -1.003 -2.606) 15.088 40.129 ( 20.197 3.116 15.732) 25.790 41.097 ( -0.996 2.137 -9.222) 9.519 41.833 ( 12.555 -11.070 -1.125) 16.776 42.137 ( -0.650 -6.198 4.941) 7.953 42.301 ( 4.889 12.393 1.246) 13.380 43.121 ( -6.397 -5.740 6.731) 10.917 43.455 ( -9.917 7.456 -14.612) 19.169 44.304 ( -19.408 -0.473 7.097) 20.670 45.305 ( -3.005 -0.702 -7.641) 8.241 48.049 ( 1.319 0.006 0.140) 1.326 48.289 ( 0.016 -0.003 -0.007) 0.018 ======================= Grid point 26 (21/125) ======================= q-point: (-0.11 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( -42.424 -14.439 27.321) 52.486 2.364 ( -42.015 21.685 21.563) 51.966 3.204 ( -68.615 17.205 0.995) 70.746 5.166 ( 20.062 0.686 -6.982) 21.253 5.369 ( 9.201 -12.221 -10.323) 18.455 5.979 ( -9.226 7.560 10.381) 15.812 7.164 ( 9.482 3.833 6.022) 11.869 7.221 ( 3.571 -0.966 -4.079) 5.506 7.358 ( 9.501 -0.133 -4.336) 10.445 7.556 ( 10.317 -7.815 -0.970) 12.979 8.256 ( 6.672 -5.458 -0.197) 8.622 8.342 ( 6.496 0.939 -7.542) 9.997 8.470 ( -2.003 4.513 -1.510) 5.163 8.881 ( 2.551 1.100 9.952) 10.333 9.447 ( 12.073 -4.898 -1.997) 13.181 9.992 ( 0.975 5.531 3.470) 6.602 10.040 ( -3.323 -11.038 1.071) 11.577 10.112 ( 4.002 -5.551 -16.721) 18.067 10.563 ( 9.583 3.739 -13.939) 17.324 10.792 ( 3.584 2.530 13.423) 14.121 11.378 ( -2.921 2.783 -4.607) 6.123 11.572 ( -11.202 -4.246 -2.179) 12.176 11.775 ( -2.507 2.678 1.403) 3.927 12.072 ( -4.466 1.512 7.791) 9.107 16.219 ( 9.555 -3.628 -6.815) 12.284 16.376 ( -1.168 2.823 2.748) 4.109 16.537 ( -11.801 1.651 -0.928) 11.952 17.736 ( 11.398 -3.677 -3.657) 12.522 17.839 ( 8.919 -0.367 -2.276) 9.212 19.108 ( 25.092 -2.330 -2.084) 25.286 23.187 ( -13.711 0.504 5.500) 14.782 23.282 ( -10.788 3.156 -0.183) 11.242 23.732 ( -4.654 -0.973 1.354) 4.944 24.506 ( 5.498 3.328 1.679) 6.642 24.901 ( -12.972 0.608 4.389) 13.708 25.149 ( -0.088 1.989 -3.320) 3.872 25.278 ( 1.209 1.205 -5.152) 5.427 25.561 ( -11.611 -2.467 2.243) 12.080 27.064 ( 27.385 5.642 -5.943) 28.585 27.312 ( 18.146 -19.558 0.345) 26.682 28.267 ( 8.643 11.558 3.327) 14.811 28.633 ( -15.030 -11.352 -6.094) 19.797 28.862 ( -6.450 8.201 8.865) 13.691 29.369 ( -1.503 4.577 -2.401) 5.383 29.474 ( -3.559 -0.382 -0.021) 3.580 30.389 ( 1.813 -0.867 1.924) 2.782 30.453 ( -6.276 -0.566 -1.359) 6.446 30.957 ( 5.187 -2.205 -10.161) 11.620 39.555 ( 16.005 1.471 5.264) 16.912 40.651 ( 19.108 9.221 12.240) 24.494 40.960 ( -1.609 -17.756 -0.855) 17.849 41.846 ( 8.595 -9.490 -7.763) 14.973 42.136 ( -1.119 11.789 -3.301) 12.293 42.518 ( 7.373 5.052 3.725) 9.683 42.994 ( -6.503 -2.623 -6.160) 9.334 43.141 ( -12.666 -4.656 -10.258) 16.951 44.118 ( -22.217 4.544 5.988) 23.454 45.266 ( 3.505 1.937 4.106) 5.736 48.060 ( 0.526 -0.159 -0.496) 0.741 48.288 ( 0.166 -0.111 -0.276) 0.341 ======================= Grid point 28 (22/125) ======================= q-point: ( 0.11 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.393 ( -30.016 13.519 24.724) 41.170 2.822 ( -15.508 6.869 37.135) 40.825 4.857 ( -9.596 27.018 23.073) 36.802 4.988 ( 15.969 3.451 1.422) 16.400 5.285 ( 10.197 5.510 0.006) 11.590 5.974 ( -10.681 -11.902 0.178) 15.993 6.898 ( -2.446 -15.238 -2.631) 15.655 7.243 ( 6.691 -0.421 -4.212) 7.918 7.519 ( -2.057 -3.285 0.087) 3.877 7.635 ( 3.428 6.407 1.891) 7.508 8.025 ( 4.133 -6.179 1.611) 7.606 8.242 ( -0.022 -6.524 -0.893) 6.585 8.336 ( 9.980 0.724 -13.380) 16.707 8.983 ( -0.653 -0.864 -11.459) 11.510 9.200 ( 11.129 -6.126 -9.342) 15.769 9.461 ( 5.318 -9.056 -7.326) 12.805 9.778 ( -3.109 -5.410 6.407) 8.943 10.205 ( -1.718 8.196 0.935) 8.426 10.542 ( 1.547 4.233 -3.254) 5.558 11.071 ( -3.214 9.207 -8.915) 13.212 11.293 ( 2.780 -2.198 6.011) 6.978 11.568 ( -2.382 0.503 7.626) 8.005 11.762 ( -5.684 -0.993 -1.207) 5.895 12.118 ( -4.590 0.098 -0.359) 4.605 15.811 ( 3.245 -6.448 -12.904) 14.786 16.350 ( -0.889 4.134 1.028) 4.352 16.621 ( -11.391 10.141 2.304) 15.424 17.383 ( 3.651 -8.027 -13.370) 16.016 17.678 ( 1.401 0.182 -7.405) 7.539 18.811 ( 1.300 -10.890 -14.321) 18.038 23.213 ( -9.804 -1.277 8.605) 13.107 23.672 ( 3.866 15.349 11.277) 19.435 23.928 ( 2.649 -0.000 4.924) 5.591 24.573 ( 4.620 -8.106 -6.491) 11.366 24.737 ( -15.127 -4.780 0.130) 15.865 25.127 ( -0.657 5.588 -1.008) 5.716 25.258 ( -0.133 8.780 5.217) 10.214 25.520 ( -7.480 5.296 4.478) 10.201 26.894 ( 12.580 -17.018 -8.451) 22.788 27.220 ( 21.552 0.141 -8.764) 23.266 28.176 ( -10.923 -9.868 4.088) 15.278 28.607 ( 1.318 1.764 2.591) 3.400 29.108 ( -1.505 0.220 -1.436) 2.092 29.346 ( -10.369 3.677 -2.518) 11.287 29.517 ( -4.644 5.910 3.792) 8.419 30.260 ( 4.837 -3.452 -0.156) 5.944 30.478 ( 0.872 1.036 2.326) 2.691 30.867 ( 3.588 6.628 -3.125) 8.159 39.688 ( 3.171 -14.826 -13.524) 20.317 40.198 ( -3.185 -23.959 12.799) 27.349 41.164 ( -3.456 0.168 -23.888) 24.137 41.294 ( 2.956 20.523 -5.760) 21.520 42.107 ( -3.507 -5.110 -0.608) 6.228 42.455 ( -5.919 -4.884 -2.369) 8.032 42.931 ( 5.711 8.204 8.720) 13.265 43.322 ( 9.216 7.172 5.418) 12.874 44.479 ( -11.080 7.243 17.330) 21.807 45.521 ( 7.106 -3.130 -3.253) 8.419 48.022 ( -0.301 0.391 -1.455) 1.536 48.275 ( 0.293 -0.046 -0.211) 0.364 ======================= Grid point 29 (23/125) ======================= q-point: ( 0.22 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.611 ( -6.950 17.319 29.026) 34.507 3.274 ( 3.499 14.984 37.340) 40.386 5.019 ( 12.065 1.373 -9.654) 15.513 5.194 ( -0.300 -13.994 -6.331) 15.362 5.514 ( -15.912 32.346 30.667) 47.328 5.880 ( 2.672 -5.407 11.108) 12.640 6.699 ( 0.394 -17.403 -6.480) 18.574 7.273 ( 0.774 -11.076 -4.797) 12.094 7.314 ( -5.375 -3.357 -4.985) 8.063 7.639 ( -4.662 2.070 -1.576) 5.339 8.116 ( 0.187 -2.121 4.373) 4.864 8.148 ( 4.000 -5.611 -6.509) 9.479 8.447 ( 8.775 6.298 0.810) 10.831 8.733 ( 0.467 2.885 -20.058) 20.270 9.215 ( 4.785 -2.223 -8.559) 10.055 9.499 ( 15.946 -5.399 -3.093) 17.117 9.730 ( -2.990 -10.737 6.860) 13.088 10.245 ( -7.242 6.560 4.328) 10.687 10.534 ( -0.766 3.220 -2.961) 4.441 10.997 ( -0.852 7.940 -11.091) 13.667 11.328 ( -5.822 -4.228 4.146) 8.304 11.577 ( -4.667 5.757 0.704) 7.445 11.727 ( 5.279 -7.760 -0.114) 9.386 12.097 ( -1.776 4.970 3.508) 6.337 15.613 ( -0.652 -6.385 -13.522) 14.968 16.436 ( 2.318 7.545 3.193) 8.514 16.585 ( -8.986 9.187 2.228) 13.043 17.181 ( 1.352 -6.862 -14.700) 16.278 17.602 ( -0.036 1.463 -7.467) 7.609 18.526 ( -1.642 -11.001 -15.614) 19.170 23.202 ( -5.401 0.537 7.167) 8.991 23.901 ( -1.099 6.156 1.842) 6.519 24.066 ( 4.924 3.116 8.653) 10.432 24.409 ( -1.539 -10.210 -6.951) 12.447 24.613 ( -3.088 -2.317 4.326) 5.798 25.126 ( -2.128 1.061 0.732) 2.488 25.451 ( 3.968 11.889 7.727) 14.724 25.587 ( -1.832 11.030 5.531) 12.474 26.770 ( 2.265 -13.901 -6.263) 15.414 27.436 ( 23.765 -0.540 -9.450) 25.580 27.941 ( -16.302 -9.275 -0.304) 18.758 28.621 ( 2.092 -3.201 -4.534) 5.932 29.083 ( 0.560 -3.448 2.056) 4.054 29.209 ( -11.703 2.778 3.482) 12.522 29.544 ( -3.386 4.283 3.614) 6.548 30.358 ( 8.492 -1.091 2.022) 8.797 30.542 ( 1.727 3.392 2.125) 4.360 30.895 ( -1.543 6.116 -3.856) 7.393 39.409 ( 2.195 -16.874 -13.752) 21.878 40.015 ( -8.726 -26.252 0.982) 27.682 40.938 ( 2.800 6.834 -15.349) 17.034 41.415 ( 3.494 21.831 -10.428) 24.445 42.053 ( -1.893 -9.297 6.593) 11.553 42.308 ( -6.391 0.717 -3.752) 7.446 43.155 ( 3.235 2.369 8.719) 9.597 43.526 ( 4.085 5.042 4.874) 8.116 44.689 ( -0.568 10.805 18.314) 21.271 45.482 ( 0.857 -6.487 -4.845) 8.142 48.002 ( -0.450 0.677 -1.773) 1.951 48.277 ( 0.138 0.052 -0.057) 0.158 ======================= Grid point 30 (24/125) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.057 ( 3.643 19.775 22.158) 29.922 3.983 ( 16.918 15.037 33.318) 40.280 4.838 ( -13.624 -15.540 -9.479) 22.737 4.986 ( -1.659 -3.526 -7.897) 8.806 5.879 ( -5.629 16.283 22.582) 28.404 6.122 ( 1.656 4.898 15.332) 16.180 6.465 ( 1.877 -19.088 -11.128) 22.175 6.960 ( -5.542 -13.975 -5.256) 15.926 7.330 ( 3.620 -4.647 0.644) 5.925 7.548 ( -2.897 2.920 -8.116) 9.098 8.037 ( -2.860 3.699 -3.807) 6.029 8.100 ( -5.427 -1.431 -4.552) 7.226 8.517 ( 3.230 -1.060 -0.210) 3.406 8.790 ( 8.223 11.502 -0.300) 14.142 9.116 ( 0.593 -1.511 -10.438) 10.563 9.598 ( 5.780 -5.130 1.438) 7.861 9.764 ( 8.204 -5.767 0.146) 10.029 10.198 ( -11.048 -2.219 7.575) 13.578 10.519 ( -2.787 7.501 -1.075) 8.074 10.908 ( 0.877 4.178 -11.529) 12.294 11.207 ( -4.398 -4.218 -1.346) 6.241 11.584 ( 1.442 0.920 -8.523) 8.693 11.708 ( 0.391 -8.249 7.626) 11.241 12.230 ( 2.896 9.004 4.711) 10.567 15.409 ( -0.217 -4.383 -10.767) 11.627 16.520 ( -5.291 4.488 -2.794) 7.479 16.612 ( 3.360 6.704 5.126) 9.084 17.018 ( 3.267 -1.237 -10.291) 10.868 17.537 ( -1.058 2.454 -4.648) 5.362 18.265 ( 0.005 -7.766 -12.559) 14.766 23.228 ( -0.338 -0.292 3.483) 3.512 23.877 ( -1.404 0.521 -3.885) 4.164 24.095 ( -1.813 -8.303 -2.021) 8.735 24.352 ( 3.449 -2.646 -0.497) 4.375 24.665 ( -1.872 2.300 9.084) 9.556 25.131 ( -0.141 -0.287 2.767) 2.786 25.718 ( 3.401 12.879 8.860) 15.998 25.732 ( 1.160 11.957 3.040) 12.392 26.648 ( -0.715 -5.977 -0.034) 6.020 27.462 ( -12.981 -5.787 -9.650) 17.180 27.744 ( 11.943 -7.164 -0.741) 13.947 28.487 ( 2.388 -8.028 -13.656) 16.020 29.117 ( -0.473 -2.105 2.476) 3.284 29.179 ( -3.319 0.427 9.475) 10.048 29.585 ( -2.127 4.884 4.253) 6.817 30.491 ( 4.996 1.820 2.706) 5.966 30.625 ( 3.033 2.241 2.119) 4.325 30.833 ( -5.653 3.991 -4.318) 8.156 39.177 ( 5.127 -13.651 -13.625) 19.957 39.643 ( -8.146 -22.260 -5.341) 24.298 40.936 ( 6.583 8.017 -8.911) 13.676 41.489 ( 3.379 18.269 -12.888) 22.612 42.050 ( -1.250 -16.536 14.106) 21.771 42.206 ( -5.027 6.790 -5.140) 9.889 43.256 ( -1.493 -2.160 7.059) 7.531 43.653 ( 0.545 6.535 3.642) 7.501 45.004 ( 3.275 9.041 13.851) 16.862 45.365 ( -2.631 -5.255 -2.328) 6.321 47.981 ( -0.194 0.672 -1.822) 1.951 48.279 ( 0.017 0.122 0.070) 0.142 ======================= Grid point 31 (25/125) ======================= q-point: ( 0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.519 ( 8.181 17.787 14.454) 24.335 4.377 ( -18.097 -7.237 -6.873) 20.667 4.649 ( -2.303 0.464 10.050) 10.321 4.787 ( -1.587 -1.341 12.656) 12.826 6.128 ( 3.950 -9.267 -1.367) 10.166 6.205 ( 0.149 -4.182 0.117) 4.186 6.285 ( 1.110 2.905 6.654) 7.345 6.836 ( -2.151 -3.798 -0.103) 4.366 7.328 ( 1.760 -3.078 -2.327) 4.241 7.442 ( 2.643 1.013 -8.443) 8.904 7.878 ( -6.589 1.536 -10.169) 12.214 8.132 ( -3.094 12.645 8.576) 15.589 8.528 ( 2.002 -8.171 -0.726) 8.444 8.931 ( -2.933 2.901 -0.587) 4.166 9.003 ( -0.967 3.140 -0.693) 3.358 9.674 ( 0.771 -6.234 1.809) 6.537 9.754 ( 4.105 7.254 -6.018) 10.280 10.118 ( -7.685 -7.835 8.864) 14.107 10.616 ( 6.430 6.784 2.863) 9.775 10.824 ( 1.515 0.410 -8.756) 8.896 11.151 ( 3.999 -0.782 -4.407) 6.003 11.437 ( 0.068 -9.537 -6.949) 11.800 11.783 ( -0.179 1.038 6.018) 6.109 12.370 ( 1.294 5.808 2.399) 6.416 15.313 ( 4.775 -1.830 -5.703) 7.660 16.414 ( -3.215 -0.412 -4.460) 5.513 16.794 ( 6.974 4.738 3.899) 9.289 17.006 ( 5.425 3.053 -5.267) 8.155 17.504 ( -1.979 2.608 -0.743) 3.357 18.109 ( 2.680 -4.251 -8.859) 10.186 23.267 ( 3.590 -2.228 0.997) 4.341 23.828 ( 2.671 0.080 -4.879) 5.563 23.980 ( 0.070 -7.464 -2.943) 8.024 24.329 ( -1.441 -1.662 -2.632) 3.431 24.771 ( -2.329 1.396 10.327) 10.678 25.173 ( 1.615 -0.735 2.296) 2.901 25.849 ( -4.105 13.069 3.784) 14.212 25.910 ( 2.378 4.227 2.332) 5.382 26.689 ( 0.080 8.519 3.728) 9.299 27.046 ( -21.859 -11.186 0.658) 24.564 27.832 ( 10.426 -11.769 -7.093) 17.249 28.351 ( 12.008 -3.539 -11.810) 17.210 29.090 ( -3.841 -0.462 1.492) 4.146 29.271 ( 2.029 -2.300 4.993) 5.860 29.681 ( -0.045 7.108 6.188) 9.424 30.545 ( -4.777 1.463 0.610) 5.033 30.701 ( 1.426 -1.749 3.584) 4.235 30.748 ( -0.364 4.549 -3.817) 5.950 38.999 ( 6.889 -10.942 -13.581) 18.751 39.387 ( -0.812 -14.168 -0.622) 14.205 41.002 ( 7.857 10.533 -10.441) 16.784 41.504 ( 2.605 9.675 -9.816) 14.027 42.080 ( -0.398 -22.736 19.293) 29.821 42.154 ( -3.273 11.350 -6.213) 13.347 43.276 ( -3.217 -1.753 5.463) 6.578 43.732 ( -1.662 7.715 1.094) 7.968 45.094 ( -5.386 -4.273 0.199) 6.878 45.391 ( 1.168 6.091 6.782) 9.190 47.968 ( 0.547 0.490 -1.361) 1.546 48.282 ( 0.047 0.155 0.173) 0.237 ======================= Grid point 32 (26/125) ======================= q-point: (-0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.777 ( -15.601 7.824 4.956) 18.143 4.096 ( -3.078 7.938 1.005) 8.573 4.275 ( -27.218 -15.834 2.999) 31.631 5.148 ( 11.497 -5.546 8.072) 15.103 6.038 ( 1.793 -6.734 1.027) 7.044 6.125 ( 0.096 0.579 -5.618) 5.648 6.520 ( -4.822 0.754 3.231) 5.854 6.712 ( 1.687 6.395 -4.416) 7.953 7.303 ( 4.624 4.652 -12.031) 13.703 7.481 ( 4.554 -3.284 7.061) 9.022 7.705 ( -5.249 -0.145 -4.073) 6.645 8.309 ( -3.388 15.345 5.935) 16.798 8.443 ( -1.254 -10.035 0.715) 10.139 8.813 ( -3.642 0.453 -3.854) 5.322 9.050 ( -0.985 -5.492 3.428) 6.548 9.618 ( 0.904 1.885 0.919) 2.283 9.865 ( 6.040 0.504 -2.710) 6.639 10.125 ( 0.213 2.828 7.238) 7.774 10.696 ( -3.107 -3.022 -3.749) 5.731 10.792 ( 4.500 -1.912 -1.380) 5.080 11.188 ( 7.355 3.845 -5.399) 9.901 11.376 ( 7.083 -5.451 2.753) 9.352 11.832 ( -1.357 1.977 1.606) 2.886 12.400 ( -2.930 0.928 -0.118) 3.076 15.382 ( 11.251 -0.176 -0.775) 11.279 16.366 ( 0.851 0.867 -0.553) 1.334 16.932 ( 6.191 -0.860 -2.294) 6.658 17.079 ( 7.134 3.946 -0.147) 8.154 17.504 ( -1.051 1.084 1.526) 2.147 18.064 ( 6.585 -1.321 -5.305) 8.559 23.314 ( 4.151 -3.399 1.415) 5.549 23.845 ( 5.012 2.828 -4.611) 7.374 23.919 ( 1.699 -4.185 -0.699) 4.570 24.232 ( -5.459 -0.332 -4.040) 6.800 24.871 ( -0.167 -0.220 9.327) 9.331 25.204 ( 1.397 -0.660 0.108) 1.549 25.866 ( -12.503 5.860 2.233) 13.988 25.975 ( 5.687 3.772 -1.133) 6.918 26.562 ( -21.532 -0.679 -1.496) 21.595 26.977 ( 1.985 -1.889 12.065) 12.373 27.699 ( 5.075 -8.484 -11.516) 15.177 28.498 ( 19.761 1.331 -3.989) 20.204 29.048 ( -3.940 0.205 0.874) 4.041 29.304 ( 0.281 -1.595 1.343) 2.104 29.806 ( 0.086 5.801 3.304) 6.676 30.409 ( -10.488 -3.418 0.539) 11.044 30.738 ( 2.413 3.815 -2.223) 5.031 30.788 ( 1.533 -0.811 2.062) 2.694 38.897 ( 8.918 -6.690 -8.963) 14.305 39.383 ( 7.739 -5.800 4.867) 10.827 41.059 ( 7.282 13.851 -15.335) 21.910 41.507 ( 3.611 -4.425 0.317) 5.721 42.121 ( 0.948 -22.323 17.109) 28.141 42.152 ( -1.997 14.214 -5.075) 15.225 43.280 ( -3.419 -0.471 4.559) 5.718 43.751 ( -3.333 7.918 -3.091) 9.131 44.941 ( -10.597 -3.881 0.995) 11.329 45.486 ( -1.365 3.342 0.405) 3.632 47.974 ( 1.477 0.283 -0.426) 1.563 48.286 ( 0.107 0.115 0.162) 0.226 ======================= Grid point 33 (27/125) ======================= q-point: (-0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.528 ( -34.874 14.540 10.123) 39.117 3.755 ( -36.438 -15.765 11.275) 41.272 4.314 ( 18.319 4.401 -5.430) 19.608 5.159 ( 10.234 -19.558 -10.848) 24.595 5.848 ( -37.382 2.131 -8.480) 38.391 6.121 ( -3.232 4.647 8.473) 10.190 6.402 ( 9.242 7.640 -1.429) 12.076 6.955 ( 12.584 4.207 2.236) 13.455 7.234 ( -0.034 11.310 -11.868) 16.394 7.598 ( -0.796 -1.570 5.472) 5.748 7.672 ( 7.728 -11.349 4.225) 14.366 8.328 ( 2.894 -3.618 -5.978) 7.563 8.423 ( -8.424 11.725 4.857) 15.232 8.842 ( 5.937 -0.190 3.647) 6.970 8.975 ( 1.966 -10.520 -1.601) 10.821 9.737 ( 11.632 0.175 -2.649) 11.931 9.885 ( 1.449 -1.542 1.010) 2.345 10.275 ( 3.303 9.400 1.602) 10.092 10.516 ( -6.662 -9.267 -4.263) 12.183 10.780 ( -2.370 -3.832 4.388) 6.289 11.271 ( 7.386 4.433 -4.478) 9.709 11.586 ( 11.018 2.944 7.675) 13.747 11.816 ( -2.359 1.824 -2.237) 3.728 12.311 ( -6.484 -3.297 -1.063) 7.351 15.581 ( 15.777 -0.141 1.135) 15.819 16.423 ( 1.178 3.351 3.373) 4.898 16.897 ( 0.038 -3.907 -5.502) 6.748 17.243 ( 11.255 0.660 0.313) 11.279 17.532 ( 2.215 -0.658 2.158) 3.162 18.164 ( 13.538 1.305 -1.009) 13.638 23.360 ( 1.401 -2.764 4.098) 5.138 23.827 ( -4.425 4.837 -4.785) 8.116 23.972 ( 0.721 -0.141 3.781) 3.852 24.105 ( 0.767 -0.631 -5.996) 6.078 24.993 ( 3.012 0.583 7.137) 7.769 25.206 ( 1.036 0.296 -1.998) 2.270 25.679 ( -17.702 1.138 -0.654) 17.751 26.092 ( 6.907 -3.804 1.993) 8.133 26.279 ( -14.358 3.264 -1.282) 14.780 27.027 ( 2.176 -14.458 1.861) 14.738 27.726 ( 9.680 10.576 -1.973) 14.472 28.759 ( 17.025 2.768 0.194) 17.249 29.003 ( -3.996 0.619 0.044) 4.044 29.299 ( -1.342 1.287 -0.435) 1.909 29.788 ( -7.500 -2.786 -0.533) 8.019 30.299 ( -3.068 -0.883 1.682) 3.608 30.756 ( -0.574 2.663 -2.471) 3.678 30.804 ( 1.748 -2.630 -0.444) 3.189 38.941 ( 11.519 -1.021 -2.617) 11.856 39.620 ( 15.314 1.904 10.285) 18.545 41.052 ( 4.348 10.489 -16.167) 19.755 41.548 ( 6.420 -17.009 8.672) 20.143 42.153 ( 0.671 -8.836 7.886) 11.862 42.207 ( 1.025 11.292 -1.738) 11.471 43.271 ( -4.019 -2.039 3.621) 5.782 43.677 ( -5.937 6.162 -8.743) 12.234 44.787 ( -14.194 -0.199 5.828) 15.346 45.411 ( -4.240 -0.874 -6.912) 8.156 48.000 ( 1.945 0.021 0.297) 1.967 48.289 ( 0.063 -0.002 -0.031) 0.070 ======================= Grid point 34 (28/125) ======================= q-point: (-0.22 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.211 ( -39.906 -11.046 18.662) 45.418 3.430 ( -34.303 19.412 18.386) 43.492 4.508 ( 20.850 -1.089 -12.166) 24.164 4.910 ( -14.893 -7.572 -13.404) 21.420 5.163 ( -26.355 -4.160 -9.297) 28.255 6.231 ( -8.010 8.478 11.904) 16.666 6.702 ( 19.432 8.680 1.013) 21.307 7.087 ( 1.499 11.223 -3.871) 11.966 7.268 ( 8.980 -1.578 -2.635) 9.491 7.514 ( -11.259 -6.208 3.076) 13.220 7.823 ( 16.050 -10.501 6.192) 20.155 8.284 ( 4.235 1.007 -9.923) 10.836 8.478 ( -0.845 5.919 2.668) 6.547 8.843 ( 0.308 -6.336 0.049) 6.344 9.091 ( 12.570 0.074 3.627) 13.084 9.779 ( 12.442 -10.903 -11.451) 20.120 9.928 ( 3.226 2.024 -0.738) 3.879 10.286 ( -8.352 -5.638 -4.102) 10.879 10.395 ( 2.761 5.862 -0.392) 6.492 10.822 ( -3.715 -1.336 13.404) 13.973 11.343 ( 5.122 3.990 -4.639) 7.980 11.743 ( -1.564 0.432 -4.261) 4.560 11.814 ( 2.416 5.304 2.911) 6.515 12.190 ( -5.059 -4.395 2.900) 7.302 15.804 ( 16.155 -1.603 -1.862) 16.341 16.493 ( -3.182 3.809 4.454) 6.668 16.773 ( -3.574 -3.271 -4.633) 6.704 17.388 ( 12.649 -3.926 -1.716) 13.355 17.609 ( 5.859 0.041 0.985) 5.942 18.433 ( 20.321 2.065 2.689) 20.602 23.404 ( -2.221 -0.953 6.514) 6.948 23.677 ( -14.029 5.391 -4.894) 15.806 23.902 ( -7.504 -2.095 0.932) 7.846 24.218 ( 13.073 2.772 -0.110) 13.364 25.102 ( 3.040 1.470 0.870) 3.487 25.195 ( -0.527 1.116 -1.881) 2.250 25.432 ( -16.668 0.340 1.205) 16.715 25.951 ( -14.938 -9.171 3.282) 17.833 26.377 ( 18.218 6.375 -4.030) 19.717 26.948 ( 6.828 -15.157 -2.721) 16.845 27.998 ( 10.038 14.061 4.290) 17.801 28.905 ( -0.832 -5.397 -5.694) 7.889 29.006 ( 1.279 6.915 7.645) 10.387 29.289 ( 0.339 5.606 -3.451) 6.592 29.611 ( -8.664 -7.907 1.516) 11.827 30.321 ( 2.564 0.761 0.643) 2.751 30.690 ( -6.949 0.791 -2.069) 7.293 30.790 ( 4.451 -3.762 -5.035) 7.701 39.130 ( 13.708 3.233 2.728) 14.346 40.068 ( 20.725 9.657 13.208) 26.406 40.969 ( 1.306 -3.266 -9.280) 9.925 41.594 ( 7.351 -21.430 8.001) 24.027 42.187 ( -1.118 4.143 1.974) 4.723 42.324 ( 5.863 12.512 -3.439) 14.239 43.189 ( -6.440 -6.229 -1.078) 9.024 43.472 ( -10.265 1.072 -10.906) 15.015 44.679 ( -17.221 3.519 9.457) 19.960 45.250 ( -2.049 -1.201 -7.284) 7.662 48.029 ( 1.617 -0.304 0.223) 1.660 48.287 ( -0.013 -0.126 -0.312) 0.337 ======================= Grid point 35 (29/125) ======================= q-point: (-0.11 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.837 ( -37.878 -7.643 25.196) 46.130 3.269 ( -41.616 9.644 12.029) 44.380 4.308 ( -39.211 21.046 11.566) 45.981 4.770 ( 14.958 3.123 -6.608) 16.648 4.943 ( 15.045 -9.824 -15.512) 23.738 6.282 ( -9.489 3.374 8.315) 13.060 7.051 ( 18.050 7.388 1.392) 19.553 7.153 ( 2.649 9.808 -4.754) 11.217 7.292 ( -2.708 -10.967 0.256) 11.299 7.374 ( 2.278 -4.671 2.149) 5.624 8.059 ( 16.644 -9.492 6.372) 20.192 8.202 ( 0.417 1.071 -10.273) 10.337 8.499 ( -1.033 1.823 -3.191) 3.817 8.868 ( 6.570 -0.847 0.054) 6.625 9.269 ( 9.223 -4.866 1.696) 10.564 9.695 ( 9.070 -11.594 -9.420) 17.477 9.948 ( 4.194 -6.927 -8.873) 12.012 10.101 ( -5.050 5.686 -3.212) 8.255 10.461 ( -1.240 6.310 0.763) 6.476 10.952 ( -0.116 -0.209 13.004) 13.006 11.348 ( 0.430 2.743 -6.324) 6.907 11.642 ( -6.011 -2.565 -1.457) 6.696 11.837 ( -1.719 3.281 -1.414) 3.964 12.195 ( -1.763 -0.378 5.192) 5.497 15.928 ( 12.075 -3.793 -7.226) 14.574 16.468 ( -5.356 -0.983 -0.458) 5.464 16.690 ( -6.189 5.007 1.623) 8.124 17.487 ( 11.760 -6.306 -4.163) 13.978 17.693 ( 6.348 -0.087 -2.153) 6.704 18.765 ( 20.004 -0.507 1.170) 20.045 23.420 ( -6.237 0.197 5.455) 8.288 23.464 ( -14.558 4.257 -1.112) 15.209 23.812 ( -4.546 -1.471 2.485) 5.386 24.432 ( 11.348 4.060 1.088) 12.101 25.098 ( -4.818 2.236 -3.493) 6.357 25.136 ( -3.237 -1.936 0.244) 3.779 25.297 ( -7.783 3.129 0.398) 8.398 25.732 ( -13.166 -2.795 2.033) 13.612 26.660 ( 24.152 -4.691 -2.057) 24.689 26.934 ( 12.561 -7.123 -6.580) 15.869 28.286 ( 8.200 9.614 5.392) 13.739 28.681 ( -11.967 -10.489 -3.568) 16.308 29.109 ( -6.618 6.723 6.878) 11.674 29.356 ( 6.630 8.971 -4.183) 11.914 29.502 ( -3.443 -4.156 1.850) 5.705 30.372 ( 2.430 -1.469 1.411) 3.171 30.537 ( -9.017 -0.253 -4.050) 9.888 30.762 ( 5.035 -2.200 -5.519) 7.788 39.420 ( 15.046 4.247 5.738) 16.654 40.553 ( 15.276 10.200 -2.207) 18.501 40.851 ( 1.855 -17.136 9.428) 19.646 41.582 ( 5.782 -15.811 -0.553) 16.844 42.258 ( -0.615 15.818 -0.446) 15.836 42.443 ( 5.614 5.832 -7.326) 10.918 42.988 ( -6.242 -2.465 -5.878) 8.921 43.180 ( -12.749 -7.171 -5.309) 15.561 44.559 ( -20.332 4.546 9.822) 23.033 45.243 ( 6.346 2.592 0.202) 6.858 48.042 ( 0.809 -0.409 -0.400) 0.991 48.281 ( 0.062 -0.187 -0.473) 0.512 ======================= Grid point 37 (30/125) ======================= q-point: ( 0.11 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.219 ( -33.193 11.687 20.735) 40.844 3.471 ( -12.490 8.051 25.142) 29.205 4.435 ( 24.956 -5.603 -12.321) 28.390 4.772 ( 25.411 -3.114 -6.237) 26.350 5.888 ( -0.342 -10.146 -3.326) 10.682 5.988 ( -12.239 24.433 22.655) 35.497 6.845 ( -10.684 -15.728 -0.515) 19.021 7.134 ( 2.637 2.748 -2.846) 4.755 7.511 ( 10.728 -5.162 3.005) 12.279 7.591 ( 10.488 3.310 -4.168) 11.762 7.791 ( -1.948 -7.166 -8.245) 11.096 8.094 ( 3.689 4.764 -10.372) 11.995 8.286 ( -1.426 -1.592 9.130) 9.376 8.884 ( -5.144 -0.499 -14.632) 15.518 9.089 ( 1.785 3.941 8.728) 9.742 9.242 ( 2.289 -10.352 -3.767) 11.251 9.807 ( -0.006 -1.641 1.056) 1.951 10.255 ( 2.654 3.837 -0.451) 4.688 10.556 ( -0.682 2.973 -0.307) 3.065 11.084 ( -4.345 5.133 -7.548) 10.109 11.293 ( 3.716 -0.787 3.822) 5.389 11.659 ( -0.838 -5.930 6.829) 9.083 11.793 ( -2.810 1.211 -1.431) 3.377 12.199 ( -5.361 2.417 -1.545) 6.081 15.652 ( -2.040 -2.201 -5.693) 6.436 16.405 ( 0.583 3.850 2.825) 4.811 16.898 ( -11.863 8.390 2.886) 14.813 17.120 ( 3.455 -7.540 -10.580) 13.444 17.616 ( -1.169 1.692 -4.197) 4.673 18.614 ( -4.322 -7.187 -9.920) 12.990 23.414 ( -7.130 -1.451 5.619) 9.193 23.789 ( 9.916 10.726 6.193) 15.866 23.928 ( 1.876 -1.516 0.920) 2.582 24.367 ( 0.293 -9.903 -6.198) 11.686 24.907 ( -10.250 -3.621 3.327) 11.369 25.171 ( -0.650 3.411 0.305) 3.486 25.380 ( 0.295 7.359 3.500) 8.154 25.785 ( -12.250 10.567 4.211) 16.716 26.475 ( 17.034 -10.834 -6.110) 21.092 26.884 ( 13.224 -1.820 -4.417) 14.061 28.286 ( -9.857 -10.353 1.639) 14.389 28.645 ( 0.212 2.965 2.547) 3.915 29.138 ( -6.123 -1.235 -1.044) 6.333 29.410 ( -1.477 1.245 -3.351) 3.868 29.608 ( 3.607 5.978 0.062) 6.982 30.223 ( -4.059 -4.525 1.916) 6.374 30.500 ( 1.346 0.877 2.888) 3.304 30.811 ( 6.771 4.888 -1.705) 8.523 39.445 ( -4.120 -11.989 -10.283) 16.324 40.243 ( -5.571 -17.871 13.141) 22.871 40.969 ( -4.815 4.777 -21.713) 22.747 41.345 ( 1.748 22.960 -9.142) 24.775 42.163 ( -5.539 -6.521 6.621) 10.818 42.445 ( -3.102 -12.561 1.949) 13.085 42.983 ( 6.705 5.632 5.832) 10.521 43.297 ( 10.905 8.438 3.615) 14.255 44.840 ( -8.804 3.091 12.227) 15.380 45.316 ( 9.913 -2.368 -7.407) 12.600 48.017 ( -0.549 0.514 -0.896) 1.170 48.271 ( 0.223 0.085 0.113) 0.264 ======================= Grid point 38 (31/125) ======================= q-point: ( 0.22 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.251 ( -18.065 13.546 25.863) 34.333 3.787 ( -1.553 15.974 27.692) 32.007 4.606 ( 23.790 0.356 -13.057) 27.140 4.849 ( 12.034 -17.882 -11.788) 24.567 5.876 ( 5.871 -5.278 8.303) 11.457 6.317 ( -8.279 21.382 20.308) 30.629 6.545 ( -8.777 -17.127 -4.443) 19.751 7.129 ( -0.660 -3.506 -7.029) 7.882 7.340 ( -10.739 -0.060 -7.706) 13.218 7.691 ( 7.818 -7.068 -4.174) 11.336 7.765 ( 8.938 -7.987 1.133) 12.040 8.135 ( 4.984 3.428 -5.786) 8.371 8.436 ( 8.032 12.468 6.888) 16.353 8.646 ( -8.685 3.060 -8.834) 12.761 9.114 ( -1.512 -7.975 -3.359) 8.785 9.282 ( 8.199 0.867 5.486) 9.903 9.764 ( -3.579 -6.120 2.763) 7.609 10.355 ( 4.069 9.775 -1.845) 10.748 10.545 ( -1.813 -1.646 0.637) 2.530 10.952 ( -4.969 2.279 -8.656) 10.237 11.362 ( 2.512 -0.402 -1.346) 2.878 11.637 ( -6.928 -6.553 -1.546) 9.661 11.718 ( -3.624 -0.547 4.944) 6.154 12.189 ( 0.049 5.939 1.888) 6.232 15.501 ( -5.892 -2.062 -6.664) 9.131 16.512 ( 1.529 6.520 4.571) 8.109 16.788 ( -9.661 0.183 -2.994) 10.116 16.993 ( -1.160 0.796 -6.068) 6.229 17.557 ( -1.535 3.164 -4.992) 6.106 18.341 ( -5.572 -8.005 -11.085) 14.766 23.368 ( -7.326 0.602 3.176) 8.008 23.913 ( -0.768 -2.441 -1.042) 2.763 24.087 ( 8.902 4.582 4.338) 10.911 24.190 ( 1.562 -12.661 -7.192) 14.645 24.820 ( -9.073 2.505 8.201) 12.484 25.161 ( -1.880 -1.232 0.796) 2.384 25.553 ( 4.646 11.313 4.906) 13.177 25.806 ( -5.188 12.083 4.905) 14.035 26.545 ( 10.637 -7.065 -2.226) 12.962 27.022 ( 18.211 -1.807 -6.843) 19.538 28.058 ( -11.386 -12.481 -0.438) 16.900 28.578 ( -8.884 -2.183 -4.258) 10.091 29.086 ( 0.048 -2.570 2.638) 3.683 29.348 ( -4.084 2.789 -2.272) 5.443 29.675 ( -2.278 4.111 3.537) 5.882 30.258 ( 7.080 -2.342 4.393) 8.655 30.564 ( 1.478 2.570 1.752) 3.444 30.890 ( 2.467 4.476 -3.082) 5.968 39.151 ( -3.754 -12.898 -10.411) 16.995 39.985 ( -15.212 -22.912 -1.598) 27.548 40.825 ( 1.532 7.025 -7.323) 10.263 41.423 ( 1.359 28.704 -16.504) 33.139 42.133 ( -4.844 -13.233 13.149) 19.274 42.317 ( -3.030 -5.816 -1.892) 6.825 43.197 ( 5.853 3.565 5.747) 8.944 43.536 ( 7.786 4.788 4.510) 10.192 44.965 ( -1.399 6.264 13.663) 15.095 45.312 ( 6.932 -4.584 -7.343) 11.090 47.999 ( -0.954 0.718 -1.322) 1.781 48.277 ( 0.119 0.152 0.220) 0.293 ======================= Grid point 39 (32/125) ======================= q-point: ( 0.33 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.482 ( -6.827 14.424 20.856) 26.260 4.288 ( 6.758 15.194 23.530) 28.814 4.666 ( 5.022 -15.786 -8.652) 18.689 4.775 ( 16.226 2.653 -9.168) 18.825 6.003 ( -2.302 -12.508 11.423) 17.095 6.225 ( -3.185 -11.701 -8.159) 14.616 6.572 ( -6.415 13.648 11.272) 18.828 6.843 ( -5.139 -9.612 -9.703) 14.593 7.306 ( 0.357 1.443 2.900) 3.259 7.517 ( -7.443 -0.379 -12.901) 14.899 7.869 ( 9.300 -9.095 -0.524) 13.019 8.190 ( 4.024 7.867 -0.181) 8.838 8.516 ( -7.081 5.686 0.318) 9.087 8.796 ( 12.888 12.762 5.826) 19.051 8.980 ( 0.132 -7.578 -6.090) 9.723 9.462 ( 9.021 -0.352 3.402) 9.648 9.718 ( -2.017 -5.626 5.196) 7.920 10.389 ( -7.039 1.779 0.644) 7.289 10.556 ( 2.843 4.303 0.051) 5.157 10.786 ( -2.594 0.287 -10.956) 11.262 11.268 ( -9.024 -5.867 -1.739) 10.903 11.434 ( -2.635 -3.095 -9.320) 10.168 11.780 ( 0.461 -1.012 7.451) 7.534 12.307 ( 2.814 6.587 3.737) 8.079 15.325 ( -5.539 -1.408 -5.828) 8.162 16.549 ( -5.266 -2.338 -7.060) 9.113 16.677 ( 1.073 3.735 3.881) 5.492 16.958 ( -2.562 5.239 -0.888) 5.899 17.525 ( -0.149 3.909 -2.925) 4.885 18.112 ( -2.702 -5.470 -7.828) 9.925 23.295 ( -5.421 0.066 -0.074) 5.422 23.826 ( -2.566 -3.764 -4.153) 6.165 24.002 ( -1.485 -9.678 -3.635) 10.444 24.264 ( 6.407 -0.950 1.015) 6.556 24.866 ( -4.642 5.388 6.898) 9.908 25.151 ( 0.230 -2.238 2.698) 3.514 25.759 ( 4.592 8.695 3.299) 10.372 25.936 ( 0.007 12.045 5.013) 13.047 26.635 ( 4.909 1.051 4.787) 6.937 27.184 ( 18.712 -1.514 -9.232) 20.920 27.765 ( -12.692 -14.008 -0.284) 18.905 28.317 ( -9.858 -5.874 -9.176) 14.693 29.117 ( 1.315 -2.293 2.318) 3.516 29.303 ( -3.203 1.635 0.652) 3.655 29.727 ( -2.825 3.638 6.567) 8.022 30.437 ( 9.813 -0.238 5.489) 11.246 30.615 ( 1.669 2.427 -0.395) 2.972 30.872 ( -2.946 3.051 -4.351) 6.076 38.907 ( -0.967 -10.218 -9.316) 13.862 39.566 ( -11.822 -15.721 -6.122) 20.601 40.857 ( 2.353 2.044 -0.097) 3.118 41.456 ( 0.907 24.128 -16.453) 29.217 42.117 ( -3.095 -24.155 18.798) 30.764 42.237 ( -1.852 9.728 -8.432) 13.006 43.312 ( 1.046 0.266 3.484) 3.647 43.699 ( 4.090 3.037 3.761) 6.333 45.134 ( 1.174 1.046 3.251) 3.612 45.328 ( 4.692 1.403 3.478) 6.007 47.973 ( -0.887 0.543 -1.431) 1.769 48.281 ( -0.014 0.137 0.188) 0.233 ======================= Grid point 40 (33/125) ======================= q-point: ( 0.44 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.736 ( 0.176 10.444 10.943) 15.128 4.417 ( -3.212 -4.910 -2.965) 6.574 4.741 ( 1.155 0.229 0.882) 1.472 4.942 ( 5.658 6.729 11.403) 14.399 5.823 ( 0.523 -15.002 -6.334) 16.293 6.137 ( -0.284 -5.067 0.426) 5.093 6.552 ( -8.142 3.885 2.557) 9.377 6.827 ( 4.470 -3.153 5.034) 7.434 7.208 ( -3.736 0.401 -14.738) 15.209 7.402 ( 0.618 2.192 1.674) 2.827 7.866 ( -0.692 -0.820 -2.020) 2.287 8.330 ( 3.020 7.489 1.898) 8.295 8.517 ( -5.465 1.434 7.503) 9.393 8.847 ( 2.187 -5.132 -7.962) 9.722 9.065 ( 3.738 5.583 3.449) 7.552 9.608 ( 6.509 0.825 1.699) 6.777 9.719 ( -0.488 -2.432 1.272) 2.787 10.286 ( -8.651 -2.704 4.778) 10.246 10.596 ( 1.619 1.683 -3.361) 4.093 10.695 ( 3.283 2.613 -5.509) 6.925 11.106 ( -3.646 -2.621 -0.712) 4.547 11.289 ( 0.204 -4.875 -6.518) 8.142 11.855 ( 0.063 0.663 3.864) 3.921 12.418 ( 1.315 3.503 1.964) 4.226 15.217 ( -0.337 -0.583 -2.936) 3.012 16.386 ( -2.561 -2.185 -4.519) 5.635 16.780 ( 2.922 2.505 1.876) 4.282 16.969 ( 0.089 3.393 -0.190) 3.400 17.534 ( -0.177 2.378 -0.370) 2.413 17.992 ( -0.143 -2.091 -4.072) 4.579 23.239 ( -0.798 -0.906 -0.517) 1.313 23.731 ( 0.381 -2.241 -3.440) 4.123 23.899 ( -0.230 -4.702 -1.753) 5.024 24.311 ( 0.913 -0.624 -0.207) 1.125 24.904 ( -2.079 1.453 3.450) 4.283 25.185 ( 0.519 -0.400 2.559) 2.641 25.880 ( 2.476 3.615 0.408) 4.400 26.061 ( -1.587 6.687 3.444) 7.687 26.822 ( 2.778 9.681 7.465) 12.537 27.187 ( -5.251 -4.501 -4.618) 8.316 27.569 ( 2.287 -12.337 -1.791) 12.674 28.080 ( 0.849 -2.784 -8.331) 8.824 29.125 ( -0.512 -0.961 0.523) 1.208 29.297 ( -0.718 -0.254 1.505) 1.686 29.805 ( -0.886 3.408 5.249) 6.321 30.602 ( 1.054 1.007 3.701) 3.978 30.664 ( 7.024 -0.176 1.054) 7.105 30.762 ( -6.421 1.517 -5.386) 8.517 38.746 ( 1.485 -6.120 -6.600) 9.123 39.315 ( -3.275 -7.363 -1.852) 8.268 40.901 ( 2.827 2.378 -1.929) 4.168 41.456 ( 0.676 10.527 -8.402) 13.486 42.106 ( -0.689 -18.163 12.812) 22.238 42.214 ( -1.493 10.294 -5.556) 11.793 43.340 ( -0.853 -0.450 2.049) 2.265 43.786 ( 0.933 2.638 1.001) 2.971 45.113 ( -1.541 -2.441 -1.178) 3.118 45.482 ( 2.065 3.792 5.104) 6.685 47.954 ( -0.149 0.257 -0.874) 0.924 48.284 ( 0.014 0.084 0.108) 0.138 ======================= Grid point 41 (34/125) ======================= q-point: (-0.44 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.893 ( 6.135 3.154 -1.187) 7.000 4.293 ( -12.152 3.636 1.644) 12.790 4.590 ( -19.624 -6.923 5.388) 21.495 5.030 ( -2.151 -9.089 -4.836) 10.518 5.807 ( 11.862 2.913 -1.552) 12.312 6.160 ( 4.130 2.345 0.417) 4.768 6.601 ( 3.164 -0.015 7.925) 8.534 6.767 ( -10.342 5.809 -9.045) 14.917 7.174 ( 7.404 2.291 1.954) 7.993 7.449 ( 3.503 -5.077 3.301) 6.996 7.796 ( -7.840 6.820 -3.990) 11.131 8.336 ( -2.714 -6.619 -1.691) 7.351 8.603 ( -1.820 6.382 11.033) 12.875 8.764 ( 1.656 -0.992 -7.234) 7.487 9.063 ( -5.820 -7.192 -0.412) 9.261 9.581 ( -2.873 -2.853 -3.586) 5.408 9.770 ( 5.873 5.418 -4.084) 8.974 10.272 ( -3.600 1.404 8.594) 9.423 10.652 ( 9.981 -3.529 -0.301) 10.591 10.676 ( -2.327 -2.002 -2.593) 4.018 11.120 ( 3.270 5.433 0.352) 6.351 11.266 ( 6.693 -2.132 2.209) 7.364 11.873 ( -1.223 1.047 -0.796) 1.797 12.430 ( -2.036 -1.045 -0.831) 2.435 15.247 ( 6.828 -0.051 0.475) 6.845 16.362 ( 1.845 1.666 1.742) 3.036 16.822 ( 2.736 -1.742 -2.562) 4.133 17.015 ( 4.402 0.384 0.050) 4.419 17.536 ( -0.888 -0.918 0.879) 1.550 17.973 ( 2.047 1.038 -0.536) 2.356 23.258 ( 3.646 -0.920 1.626) 4.096 23.736 ( 4.842 0.945 -1.200) 5.077 23.878 ( 1.014 0.718 -0.288) 1.275 24.279 ( -4.145 0.657 -1.475) 4.448 24.935 ( 1.069 -0.439 2.861) 3.086 25.197 ( -0.420 0.297 -0.826) 0.973 25.897 ( 0.078 -2.264 -1.504) 2.719 26.076 ( -4.526 1.418 1.548) 4.990 26.820 ( -15.594 0.401 -2.752) 15.840 27.078 ( -5.249 -6.798 6.537) 10.793 27.516 ( 4.257 4.111 -2.340) 6.364 28.175 ( 18.955 2.202 -2.549) 19.252 29.109 ( -2.102 0.653 0.360) 2.230 29.308 ( 0.402 -1.068 1.407) 1.812 29.856 ( 0.387 1.413 -0.096) 1.468 30.545 ( -10.926 -1.093 -0.739) 11.006 30.660 ( 1.969 1.087 -5.214) 5.678 30.793 ( 4.247 -1.347 4.869) 6.600 38.711 ( 4.380 -0.428 -1.236) 4.571 39.315 ( 5.805 0.612 3.425) 6.767 40.923 ( 3.185 5.173 -6.941) 9.224 41.456 ( 1.142 -7.743 4.568) 9.062 42.114 ( 1.002 0.440 0.528) 1.215 42.220 ( -0.637 0.247 1.614) 1.753 43.342 ( -1.153 -0.239 1.190) 1.674 43.788 ( -2.011 2.244 -2.819) 4.126 45.060 ( -4.962 -0.078 2.094) 5.387 45.512 ( -2.318 -0.294 -2.514) 3.432 47.957 ( 0.931 0.016 0.172) 0.947 48.286 ( 0.114 0.002 -0.019) 0.115 ======================= Grid point 42 (35/125) ======================= q-point: (-0.33 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.917 ( 10.344 -6.291 -13.207) 17.917 4.206 ( -20.948 13.516 10.514) 27.056 4.292 ( -25.293 -5.791 10.667) 28.055 4.742 ( 1.329 -17.121 -17.214) 24.315 6.071 ( 1.974 11.423 -8.693) 14.490 6.148 ( 1.792 2.879 4.274) 5.456 6.557 ( -11.911 7.654 1.247) 14.213 6.857 ( 13.597 -0.401 8.623) 16.106 7.289 ( -3.468 10.455 -0.711) 11.038 7.516 ( 6.408 -8.942 4.225) 11.785 7.697 ( -5.663 5.938 -0.939) 8.259 8.213 ( -1.340 -7.845 -2.555) 8.359 8.671 ( -9.553 2.370 -2.828) 10.241 8.751 ( 5.166 -6.002 3.196) 8.539 8.889 ( -0.768 -3.677 0.064) 3.757 9.510 ( 4.208 -2.308 -7.843) 9.195 9.811 ( 4.963 1.857 -5.899) 7.929 10.369 ( -1.115 0.985 8.517) 8.646 10.532 ( -7.192 -4.630 -2.497) 8.910 10.793 ( 7.908 -0.174 4.718) 9.210 11.222 ( 1.246 4.954 2.676) 5.767 11.491 ( 15.079 2.788 4.992) 16.127 11.826 ( -1.828 1.559 -4.426) 5.036 12.338 ( -4.395 -4.638 -2.168) 6.747 15.398 ( 11.692 -0.214 2.029) 11.869 16.486 ( 3.351 4.919 6.792) 9.031 16.771 ( 1.512 -4.704 -5.712) 7.553 17.087 ( 8.063 -3.626 -1.258) 8.930 17.530 ( 0.494 -2.998 2.275) 3.796 18.066 ( 6.303 3.963 3.497) 8.225 23.351 ( 5.033 -0.640 3.836) 6.361 23.830 ( 4.770 4.044 -0.518) 6.274 23.931 ( 3.057 4.992 1.670) 6.087 24.170 ( -9.040 0.536 -2.030) 9.280 24.993 ( 4.082 -1.611 1.128) 4.531 25.169 ( 0.199 2.010 -3.791) 4.296 25.799 ( -5.589 -7.258 -2.362) 9.460 26.027 ( -0.215 -5.135 0.157) 5.142 26.538 ( -18.538 -0.586 -1.144) 18.582 26.943 ( -6.622 -8.081 -0.159) 10.449 27.735 ( 8.428 15.419 5.120) 18.303 28.476 ( 21.171 3.063 -0.639) 21.401 29.086 ( -3.016 2.149 0.016) 3.703 29.323 ( 0.117 -0.900 1.927) 2.130 29.823 ( -2.178 -2.947 -2.711) 4.558 30.363 ( -8.154 -0.064 -3.742) 8.972 30.646 ( 2.439 -0.756 -3.976) 4.726 30.857 ( -1.009 -2.278 4.235) 4.914 38.828 ( 7.285 4.816 3.567) 9.434 39.566 ( 14.213 8.722 8.346) 18.648 40.904 ( 2.316 3.923 -9.000) 10.087 41.468 ( 1.926 -23.019 14.403) 27.222 42.160 ( 2.841 15.976 -8.134) 18.151 42.236 ( 0.513 -4.637 4.059) 6.184 43.318 ( -2.612 -1.941 -0.333) 3.271 43.695 ( -5.610 1.044 -6.254) 8.466 45.031 ( -7.520 2.690 6.319) 10.184 45.366 ( -5.438 -3.526 -8.914) 11.021 47.981 ( 1.572 -0.290 0.837) 1.804 48.286 ( 0.096 -0.104 -0.209) 0.252 ======================= Grid point 43 (36/125) ======================= q-point: (-0.22 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.762 ( -12.264 -7.423 -0.787) 14.357 4.031 ( 2.789 -11.983 -5.351) 13.417 4.184 ( -22.860 11.882 7.115) 26.728 4.541 ( 6.854 -2.978 -9.311) 11.939 5.682 ( -30.870 5.244 -5.784) 31.842 6.499 ( -3.026 4.776 7.851) 9.675 6.540 ( 13.557 11.804 -1.734) 18.059 7.111 ( 8.014 -3.033 6.604) 10.819 7.255 ( -10.183 15.398 -3.291) 18.752 7.570 ( 9.803 -9.615 2.462) 13.951 7.695 ( -6.011 -2.231 5.541) 8.474 8.122 ( 2.119 -2.388 -5.969) 6.769 8.513 ( -2.584 -6.526 -1.851) 7.259 8.750 ( 5.176 -6.367 -0.118) 8.206 9.018 ( 5.382 6.733 3.714) 9.386 9.441 ( 6.834 -5.574 -11.548) 14.530 9.823 ( 4.075 0.892 -4.291) 5.984 10.308 ( -8.091 -7.618 0.811) 11.142 10.504 ( -1.287 5.356 3.692) 6.632 10.955 ( 3.885 -1.919 8.804) 9.813 11.288 ( 0.366 3.178 0.632) 3.261 11.697 ( 3.251 4.615 -4.896) 7.472 11.804 ( 4.867 1.405 0.065) 5.066 12.225 ( -2.342 -5.099 0.660) 5.650 15.582 ( 11.800 -0.921 0.575) 11.850 16.583 ( -2.112 -2.839 -1.049) 3.691 16.737 ( 2.078 4.098 3.148) 5.570 17.149 ( 10.808 -7.243 -2.602) 13.268 17.567 ( 2.999 -2.006 2.785) 4.558 18.297 ( 11.713 5.248 6.985) 14.613 23.452 ( 3.290 -0.370 2.939) 4.427 23.851 ( -7.015 6.065 -0.453) 9.284 23.989 ( -9.394 -2.452 -2.567) 10.042 24.109 ( 8.510 6.117 3.551) 11.066 25.022 ( 5.471 -0.591 -5.356) 7.679 25.180 ( 1.876 3.212 -1.123) 3.886 25.593 ( -9.297 -8.343 -2.015) 12.653 26.007 ( 4.334 -11.851 1.680) 12.730 26.313 ( -11.642 2.758 -0.170) 11.965 26.818 ( -4.169 -1.483 -1.649) 4.722 28.043 ( 8.710 13.545 5.555) 17.035 28.727 ( 12.103 -0.309 -2.757) 12.417 29.084 ( 1.072 4.390 0.438) 4.540 29.339 ( -1.671 0.386 2.598) 3.113 29.692 ( -8.010 -6.502 0.472) 10.327 30.270 ( 1.770 1.774 -4.904) 5.507 30.609 ( 1.151 -1.254 -5.196) 5.467 30.827 ( -5.740 -3.350 2.839) 7.227 39.063 ( 9.815 8.051 6.498) 14.261 40.016 ( 19.370 16.825 7.466) 26.721 40.841 ( 0.290 -6.026 -2.478) 6.522 41.467 ( 2.089 -27.836 14.753) 31.573 42.254 ( 5.817 10.746 -9.547) 15.507 42.264 ( 0.936 10.341 0.111) 10.384 43.201 ( -6.798 -5.377 -4.045) 9.565 43.505 ( -9.671 -2.605 -6.380) 11.875 45.036 ( -11.613 4.435 9.915) 15.901 45.152 ( -1.163 -3.058 -10.316) 10.823 48.009 ( 1.427 -0.590 0.714) 1.701 48.281 ( -0.040 -0.189 -0.396) 0.441 ======================= Grid point 44 (37/125) ======================= q-point: (-0.11 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.514 ( -24.979 -2.861 13.482) 28.529 3.916 ( -17.023 -4.537 -3.821) 18.027 4.065 ( 15.642 -3.994 -6.730) 17.490 4.524 ( 5.318 -0.483 -10.674) 11.935 5.411 ( -27.188 24.848 15.029) 39.781 6.402 ( -3.144 -9.806 -4.343) 11.176 6.910 ( 16.238 14.175 1.244) 21.590 7.151 ( 0.500 0.385 -3.292) 3.352 7.242 ( -4.112 5.549 0.981) 6.976 7.481 ( -12.268 -8.345 3.970) 15.359 7.829 ( 14.990 -7.373 7.252) 18.211 8.090 ( 3.104 -2.119 -2.473) 4.499 8.419 ( 0.608 -2.075 -9.189) 9.440 8.817 ( 3.052 0.675 4.965) 5.867 9.147 ( 3.962 0.887 -0.708) 4.122 9.364 ( 9.739 -6.707 -11.229) 16.308 9.813 ( -0.255 -2.838 -1.463) 3.203 10.196 ( -4.477 3.292 0.350) 5.568 10.548 ( -1.580 1.162 2.128) 2.894 11.069 ( 0.884 -4.420 9.535) 10.547 11.292 ( 0.051 2.859 -4.545) 5.370 11.670 ( -1.509 2.881 -2.740) 4.253 11.834 ( 0.127 0.149 -2.807) 2.813 12.239 ( 2.003 -1.496 3.535) 4.330 15.702 ( 7.846 -1.713 -2.252) 8.341 16.465 ( -2.403 -4.555 -4.194) 6.642 16.864 ( -3.401 8.762 7.213) 11.847 17.209 ( 11.820 -8.681 -4.064) 15.218 17.624 ( 2.765 -0.563 0.962) 2.981 18.591 ( 11.965 3.200 5.634) 13.607 23.493 ( 0.540 2.171 -0.764) 2.364 23.694 ( -15.119 -2.084 0.197) 15.263 23.882 ( -2.684 0.083 1.545) 3.098 24.324 ( 9.269 5.751 1.400) 10.997 25.035 ( 4.045 2.474 -5.450) 7.224 25.186 ( -2.378 -1.821 -0.016) 2.996 25.419 ( -5.202 -2.075 -1.169) 5.721 25.943 ( -9.443 -4.198 5.342) 11.633 26.300 ( 11.239 -6.081 -1.706) 12.892 26.759 ( -0.138 2.822 -3.875) 4.796 28.311 ( 7.965 9.448 4.022) 12.995 28.691 ( -4.889 -6.397 -3.564) 8.805 29.230 ( 10.349 5.403 0.546) 11.687 29.329 ( -6.224 2.478 2.211) 7.055 29.556 ( -5.619 -4.403 1.970) 7.405 30.312 ( 6.394 0.886 -1.139) 6.555 30.536 ( -1.316 0.384 -6.329) 6.476 30.730 ( -6.042 -3.801 1.430) 7.280 39.363 ( 10.559 8.082 7.405) 15.220 40.376 ( 9.093 11.598 -11.542) 18.719 40.861 ( 5.439 -9.288 18.060) 21.024 41.421 ( 1.279 -20.917 6.452) 21.927 42.290 ( 5.721 2.749 -6.004) 8.737 42.387 ( 1.019 19.488 -5.880) 20.381 42.989 ( -6.493 -4.182 -4.685) 9.033 43.243 ( -11.998 -8.120 -3.261) 14.850 44.940 ( -13.301 2.031 4.562) 14.208 45.147 ( 5.600 1.909 -0.763) 5.965 48.025 ( 0.781 -0.548 0.172) 0.970 48.273 ( -0.070 -0.182 -0.414) 0.457 ======================= Grid point 91 (38/125) ======================= q-point: ( 0.11 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.654 ( 0.000 -0.000 44.998) 44.998 1.654 ( 0.000 -0.000 44.998) 44.998 2.715 ( 0.000 -0.000 71.682) 71.682 5.439 ( -0.000 0.000 -8.387) 8.387 5.740 ( 0.000 -0.000 4.818) 4.818 5.740 ( 0.000 -0.000 4.818) 4.818 7.302 ( -0.000 0.000 -3.228) 3.228 7.302 ( -0.000 0.000 -3.228) 3.228 7.775 ( -0.000 0.000 -12.102) 12.102 7.868 ( 0.000 -0.000 0.524) 0.524 7.868 ( -0.000 0.000 0.524) 0.524 8.290 ( -0.000 0.000 -2.711) 2.711 8.667 ( -0.000 0.000 -4.458) 4.458 9.375 ( -0.000 0.000 -20.017) 20.017 9.375 ( -0.000 0.000 -20.017) 20.017 9.549 ( 0.000 -0.000 24.082) 24.082 10.067 ( 0.000 -0.000 -0.008) 0.008 10.067 ( -0.000 0.000 -0.008) 0.008 10.655 ( -0.000 0.000 -9.089) 9.089 10.655 ( -0.000 0.000 -9.089) 9.089 11.304 ( 0.000 -0.000 5.469) 5.469 11.416 ( 0.000 -0.000 5.718) 5.718 11.416 ( 0.000 -0.000 5.718) 5.718 12.299 ( -0.000 0.000 -3.497) 3.497 16.184 ( 0.000 -0.000 1.442) 1.442 16.184 ( 0.000 -0.000 1.442) 1.442 16.293 ( -0.000 0.000 -19.249) 19.249 17.802 ( -0.000 0.000 -13.673) 13.673 17.802 ( -0.000 0.000 -13.673) 13.673 19.368 ( -0.000 0.000 -24.478) 24.478 23.016 ( 0.000 -0.000 14.491) 14.491 23.016 ( 0.000 -0.000 14.491) 14.491 24.014 ( 0.000 -0.000 9.575) 9.575 24.552 ( 0.000 -0.000 3.200) 3.200 24.552 ( 0.000 -0.000 3.200) 3.200 24.835 ( 0.000 -0.000 11.217) 11.217 25.318 ( -0.000 0.000 -4.271) 4.271 25.318 ( -0.000 0.000 -4.271) 4.271 27.731 ( -0.000 0.000 -12.200) 12.200 27.731 ( -0.000 0.000 -12.200) 12.200 28.085 ( -0.000 0.000 -16.003) 16.003 28.873 ( 0.000 -0.000 3.727) 3.727 28.879 ( 0.000 -0.000 15.281) 15.281 28.879 ( 0.000 -0.000 15.281) 15.281 29.193 ( -0.000 0.000 -2.934) 2.934 30.450 ( 0.000 -0.000 1.476) 1.476 30.450 ( 0.000 -0.000 1.476) 1.476 30.651 ( -0.000 0.000 -0.473) 0.473 40.618 ( -0.000 0.000 -15.931) 15.931 40.618 ( -0.000 0.000 -15.931) 15.931 40.999 ( 0.000 -0.000 9.509) 9.509 41.605 ( -0.000 0.000 -22.279) 22.279 41.605 ( -0.000 0.000 -22.279) 22.279 42.491 ( 0.000 -0.000 11.558) 11.558 42.491 ( 0.000 -0.000 11.558) 11.558 43.594 ( 0.000 -0.000 20.991) 20.991 43.594 ( 0.000 -0.000 20.991) 20.991 45.853 ( -0.000 0.000 -5.474) 5.474 48.031 ( -0.000 0.000 -1.931) 1.931 48.288 ( -0.000 0.000 -0.434) 0.434 ======================= Grid point 92 (39/125) ======================= q-point: ( 0.22 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.987 ( -0.093 0.816 39.914) 39.923 2.539 ( 13.387 20.568 41.459) 48.178 3.737 ( 25.049 5.329 61.180) 66.324 5.264 ( -7.245 -5.160 -10.552) 13.801 5.592 ( -11.078 -12.513 2.021) 16.834 5.951 ( 5.950 9.552 5.508) 12.529 7.158 ( -5.718 -1.619 -5.365) 8.007 7.321 ( 0.717 1.062 -2.076) 2.440 7.592 ( -2.341 -8.253 -4.937) 9.898 7.735 ( -12.011 2.111 -1.912) 12.344 7.971 ( 7.128 -4.054 1.019) 8.263 8.286 ( 1.378 2.482 -0.837) 2.960 8.518 ( -6.683 -5.127 -9.266) 12.522 9.073 ( -1.840 1.768 -19.550) 19.716 9.258 ( 5.742 3.867 -21.063) 22.172 9.776 ( -6.705 -5.231 14.626) 16.918 9.943 ( -8.507 4.215 1.942) 9.690 10.116 ( 0.963 -1.097 0.802) 1.665 10.410 ( 0.608 -8.059 -7.593) 11.089 10.768 ( 10.213 6.963 -7.812) 14.622 11.347 ( -1.052 -4.939 2.553) 5.658 11.432 ( 3.263 1.782 6.452) 7.447 11.651 ( 7.571 11.228 4.167) 14.169 12.194 ( -5.130 -3.670 -2.939) 6.959 15.996 ( -4.791 -2.717 -19.332) 20.102 16.230 ( 3.138 1.654 0.798) 3.636 16.294 ( 7.563 4.661 2.828) 9.323 17.566 ( -3.909 -1.373 -15.350) 15.899 17.663 ( 1.036 -0.325 -13.675) 13.718 19.010 ( -3.884 -2.143 -26.149) 26.522 23.188 ( 0.690 7.425 12.310) 14.392 23.307 ( 9.403 -2.157 15.556) 18.304 24.054 ( -6.491 -3.897 10.564) 12.996 24.608 ( 5.036 -1.072 -2.052) 5.543 24.661 ( 2.255 6.690 3.843) 8.038 25.005 ( 2.509 2.394 11.215) 11.738 25.180 ( -2.657 -4.790 -4.736) 7.241 25.375 ( 4.617 5.868 -0.542) 7.486 27.399 ( -9.698 -10.602 -8.095) 16.493 27.519 ( -14.497 -6.098 -15.673) 22.203 28.062 ( 12.759 10.291 -9.699) 19.047 28.747 ( -11.834 -3.018 8.316) 14.775 29.040 ( 6.795 -8.042 2.806) 10.897 29.163 ( 1.025 10.396 5.146) 11.645 29.257 ( 9.572 2.315 5.541) 11.300 30.399 ( -4.238 -3.441 1.173) 5.583 30.493 ( -0.785 2.570 2.306) 3.540 30.708 ( 5.889 1.124 -1.795) 6.259 40.109 ( -14.644 -10.781 -14.149) 23.041 40.668 ( -1.924 16.063 -8.724) 18.380 40.898 ( 2.127 -22.262 -6.189) 23.204 41.274 ( -11.185 18.672 -23.417) 31.971 41.700 ( 27.552 1.136 -14.652) 31.226 42.511 ( -4.231 -4.147 12.613) 13.935 42.787 ( 4.273 3.594 13.403) 14.520 43.563 ( -13.189 -9.014 16.963) 23.301 44.108 ( 13.755 9.923 19.837) 26.099 45.712 ( -5.978 -4.995 -4.994) 9.254 48.008 ( 0.304 0.144 -2.150) 2.176 48.281 ( -0.149 -0.086 -0.356) 0.396 ======================= Grid point 93 (40/125) ======================= q-point: ( 0.33 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.570 ( 14.750 10.681 31.210) 36.134 3.309 ( 4.152 24.511 36.099) 43.831 4.831 ( 19.145 2.212 31.931) 37.296 4.903 ( -0.584 -11.829 0.876) 11.876 5.287 ( -14.906 -19.211 -0.032) 24.315 6.137 ( -0.243 12.195 1.742) 12.321 7.015 ( -3.127 -0.838 -6.236) 7.026 7.269 ( -8.150 1.804 0.568) 8.366 7.478 ( 2.321 -8.994 -3.994) 10.111 7.619 ( -3.790 -0.012 2.029) 4.299 7.976 ( 5.741 -14.090 -4.572) 15.887 8.194 ( -10.588 -4.837 -13.559) 17.870 8.355 ( -1.426 10.396 1.424) 10.590 8.889 ( -1.526 3.099 -11.570) 12.075 9.093 ( 0.128 -0.660 -13.602) 13.619 9.570 ( -14.737 1.297 -4.466) 15.453 10.010 ( -11.491 -0.762 6.755) 13.351 10.080 ( 6.507 -6.305 2.612) 9.430 10.417 ( 8.514 0.012 -0.027) 8.514 10.856 ( 8.343 4.858 -7.382) 12.153 11.322 ( 0.502 -4.154 0.250) 4.192 11.586 ( 5.776 1.851 5.214) 7.998 11.860 ( -0.532 10.017 4.092) 10.834 12.079 ( 0.865 -2.097 -3.803) 4.428 15.705 ( -2.564 -1.384 -15.771) 16.038 16.310 ( 3.382 1.683 1.849) 4.206 16.519 ( 11.718 6.544 4.012) 14.008 17.327 ( -4.453 0.387 -14.026) 14.721 17.525 ( 2.270 -1.018 -11.280) 11.551 18.672 ( -0.444 -0.183 -22.525) 22.530 23.395 ( 0.868 8.739 8.460) 12.195 23.574 ( 8.601 -6.672 12.869) 16.855 24.050 ( -6.499 -2.424 8.312) 10.826 24.560 ( -1.793 -4.052 -5.598) 7.139 24.796 ( 2.632 8.847 0.687) 9.256 25.097 ( 1.217 -0.056 1.396) 1.853 25.196 ( 5.039 -0.721 6.780) 8.479 25.529 ( 5.734 8.791 3.654) 11.113 27.016 ( -15.599 -14.258 -15.555) 26.241 27.117 ( -12.257 -6.655 -2.493) 14.168 28.248 ( 11.673 11.052 -5.144) 16.878 28.662 ( -6.859 -0.324 1.600) 7.051 29.063 ( 2.289 -3.886 1.648) 4.802 29.301 ( 4.208 4.897 1.776) 6.697 29.454 ( 6.686 -1.991 4.544) 8.325 30.332 ( -4.764 -0.103 1.880) 5.122 30.525 ( -1.593 2.792 2.296) 3.950 30.753 ( 3.445 -2.476 -0.883) 4.334 39.719 ( -10.227 -2.665 -13.205) 16.914 40.510 ( -4.926 -14.909 -5.490) 16.634 40.837 ( 15.377 1.818 -12.323) 19.789 41.029 ( -10.531 23.625 -21.346) 33.536 41.917 ( 19.426 0.317 -6.162) 20.382 42.584 ( -2.718 -3.978 12.668) 13.553 42.971 ( -1.108 0.657 11.150) 11.224 43.489 ( -12.251 -9.160 13.319) 20.283 44.583 ( 10.866 10.315 16.493) 22.282 45.510 ( -6.716 -7.276 -5.621) 11.385 47.993 ( 0.791 0.338 -1.916) 2.101 48.275 ( -0.177 -0.096 -0.098) 0.224 ======================= Grid point 94 (41/125) ======================= q-point: ( 0.44 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.264 ( 22.651 12.090 23.664) 34.917 3.818 ( -9.977 12.129 17.657) 23.631 4.394 ( -13.088 -8.636 -7.448) 17.360 4.859 ( -20.603 -20.581 2.283) 29.211 5.781 ( 29.240 -1.010 25.529) 38.829 6.136 ( -11.925 7.919 -1.801) 14.428 6.920 ( 3.227 -2.691 -5.957) 7.290 7.169 ( -9.006 4.668 -0.398) 10.151 7.408 ( 2.852 -11.514 -4.259) 12.603 7.578 ( 1.612 -5.362 -4.286) 7.051 7.785 ( -13.548 -2.474 -11.049) 17.656 7.939 ( 3.076 -4.456 -0.474) 5.435 8.456 ( -2.472 11.068 4.794) 12.312 8.761 ( -1.583 2.820 -10.437) 10.927 9.066 ( 7.854 -4.938 6.287) 11.207 9.373 ( -9.994 5.837 -4.576) 12.446 9.883 ( -7.001 -2.255 0.647) 7.383 10.171 ( 4.728 -2.888 2.096) 5.923 10.536 ( 3.514 2.246 2.040) 4.643 10.903 ( 6.672 3.099 -8.047) 10.903 11.305 ( 1.309 -1.861 -0.669) 2.371 11.732 ( 5.891 0.559 3.481) 6.865 11.838 ( -7.401 -3.738 3.134) 8.864 12.139 ( 5.223 7.707 -3.054) 9.798 15.568 ( 3.675 1.874 -8.139) 9.125 16.382 ( 2.648 -0.754 2.570) 3.766 16.805 ( 13.424 7.022 4.647) 15.847 17.117 ( -6.308 2.693 -10.777) 12.774 17.474 ( 6.655 0.687 -7.093) 9.751 18.474 ( 4.902 2.720 -17.663) 18.532 23.537 ( -0.115 5.352 4.247) 6.833 23.723 ( 3.083 -9.223 8.839) 13.141 24.015 ( -7.260 -1.543 3.872) 8.371 24.415 ( -4.684 -0.159 -5.162) 6.972 24.890 ( 6.323 1.057 -0.436) 6.425 25.190 ( 1.330 2.719 4.325) 5.279 25.327 ( 5.224 1.193 4.091) 6.742 25.739 ( 6.597 9.366 3.480) 11.973 26.519 ( -15.749 -10.836 -11.597) 22.359 26.919 ( -8.354 -6.179 3.040) 10.826 28.372 ( 3.776 5.349 -6.323) 9.102 28.617 ( 0.499 0.069 -0.118) 0.518 29.111 ( 4.890 0.809 0.635) 4.997 29.391 ( 0.238 4.562 0.857) 4.648 29.500 ( 2.812 -8.108 0.362) 8.589 30.325 ( -2.836 3.443 2.971) 5.360 30.560 ( -0.680 3.767 2.793) 4.738 30.745 ( -0.382 -5.010 1.006) 5.124 39.466 ( -4.956 3.541 -12.068) 13.518 40.296 ( 8.359 -24.123 -6.343) 26.306 40.850 ( -5.722 23.178 -21.366) 32.038 40.976 ( 10.695 11.787 -5.086) 16.709 42.096 ( 13.169 -0.478 -2.203) 13.361 42.656 ( -3.628 -5.649 12.899) 14.541 43.044 ( -4.935 0.299 8.420) 9.764 43.402 ( -10.552 -8.459 11.297) 17.621 44.947 ( 5.765 7.911 11.203) 14.877 45.271 ( -7.701 -7.407 -7.147) 12.855 47.992 ( 1.288 0.529 -1.284) 1.894 48.274 ( -0.087 -0.033 0.260) 0.276 ======================= Grid point 95 (42/125) ======================= q-point: (-0.44 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.344 ( -24.017 -24.569 -15.243) 37.587 3.955 ( 8.961 0.255 15.195) 17.642 4.168 ( -13.094 -6.748 3.155) 15.064 4.764 ( -1.724 14.228 17.899) 22.930 5.703 ( -34.920 -3.526 -11.178) 36.834 6.244 ( 10.118 -11.887 3.881) 16.085 6.968 ( 8.935 2.552 -3.542) 9.945 7.102 ( -0.089 6.127 -5.149) 8.003 7.215 ( 5.157 -15.606 -10.202) 19.345 7.512 ( -16.447 -1.494 6.712) 17.826 7.633 ( 9.403 11.276 -4.070) 15.236 8.058 ( 9.474 -1.794 4.666) 10.712 8.565 ( -3.877 6.724 7.051) 10.487 8.700 ( 6.462 0.033 -4.885) 8.100 9.236 ( -1.770 3.570 0.006) 3.985 9.364 ( 9.021 1.956 11.437) 14.697 9.820 ( -2.300 1.464 1.236) 2.993 10.201 ( 0.958 -0.831 -1.301) 1.817 10.580 ( -1.783 1.285 1.083) 2.450 10.895 ( 3.887 3.164 -10.294) 11.449 11.325 ( 2.879 -0.150 0.834) 3.001 11.737 ( -4.402 -8.841 3.615) 10.517 11.840 ( 3.293 0.000 2.362) 4.052 12.194 ( 0.280 5.965 -4.176) 7.286 15.645 ( 10.162 5.211 -0.707) 11.442 16.437 ( 2.750 -3.650 3.043) 5.490 16.929 ( -8.085 3.547 -6.277) 10.833 17.118 ( 13.829 7.039 4.340) 16.113 17.536 ( 8.046 2.650 -3.316) 9.097 18.440 ( 11.584 6.528 -13.202) 18.738 23.561 ( -4.185 -0.217 0.860) 4.278 23.718 ( -5.038 -9.807 5.753) 12.436 23.915 ( -7.401 -1.900 0.117) 7.642 24.358 ( 1.353 4.931 -3.348) 6.113 24.994 ( 8.369 -2.220 0.836) 8.698 25.219 ( -4.190 0.376 2.368) 4.828 25.410 ( 0.629 -4.006 0.513) 4.087 25.883 ( -1.016 6.624 -2.670) 7.214 26.242 ( 1.016 -2.379 0.349) 2.610 26.882 ( -2.901 3.311 6.746) 8.055 28.317 ( 2.292 0.159 -10.517) 10.765 28.634 ( -0.183 -5.500 4.016) 6.813 29.217 ( 7.821 5.248 -4.432) 10.410 29.348 ( -3.528 -6.310 -1.259) 7.338 29.502 ( -0.958 4.283 1.115) 4.528 30.346 ( -0.989 0.281 1.801) 2.074 30.658 ( 2.924 6.241 3.821) 7.881 30.689 ( -4.994 -5.639 4.023) 8.539 39.349 ( 1.256 7.260 -10.851) 13.116 40.224 ( 17.852 -24.861 -3.084) 30.761 40.732 ( -3.455 24.445 -20.034) 31.794 41.206 ( 11.412 13.871 0.313) 17.965 42.217 ( 8.370 -0.167 -2.874) 8.851 42.681 ( -5.732 -9.484 12.139) 16.436 43.064 ( -6.370 2.614 7.299) 10.034 43.336 ( -8.809 -7.739 11.690) 16.557 44.918 ( -11.045 -11.663 -6.250) 17.236 45.213 ( 1.485 8.660 2.749) 9.207 48.007 ( 1.605 0.697 -0.461) 1.810 48.278 ( 0.015 0.030 0.500) 0.501 ======================= Grid point 96 (43/125) ======================= q-point: (-0.33 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.553 ( -28.634 -27.427 -16.328) 42.880 3.439 ( -36.118 -27.853 -0.030) 45.611 4.568 ( -2.428 2.555 6.815) 7.673 4.863 ( -24.562 -13.762 -1.261) 28.183 5.152 ( -3.274 21.570 10.719) 24.308 6.150 ( -0.033 -12.095 -10.267) 15.865 6.986 ( 7.084 -1.102 -7.839) 10.623 7.119 ( 9.515 -4.559 -2.952) 10.956 7.262 ( 9.463 8.689 -2.836) 13.156 7.410 ( -10.746 2.767 6.933) 13.085 7.875 ( 12.781 12.980 -0.770) 18.233 8.234 ( 8.934 -3.805 6.179) 11.510 8.591 ( -3.467 0.031 2.410) 4.223 8.809 ( 6.705 3.013 -0.267) 7.356 9.265 ( 2.730 6.862 0.970) 7.448 9.647 ( 7.173 0.706 9.214) 11.698 9.911 ( 6.461 1.414 4.718) 8.124 10.181 ( -0.051 1.013 1.008) 1.430 10.565 ( -2.779 2.984 1.069) 4.215 10.817 ( -0.102 5.240 -12.830) 13.859 11.393 ( 3.777 -1.132 2.603) 4.725 11.653 ( -4.056 -10.106 5.075) 12.015 11.871 ( -0.638 -1.900 0.191) 2.013 12.148 ( -3.240 2.798 -5.538) 6.999 15.889 ( 14.050 7.527 2.927) 16.206 16.448 ( -0.199 -4.961 0.629) 5.005 16.778 ( -9.234 0.511 -2.010) 9.464 17.417 ( 13.269 7.291 3.576) 15.557 17.650 ( 8.126 4.030 -1.093) 9.136 18.601 ( 19.619 11.145 -8.556) 24.131 23.442 ( -9.848 -4.444 -0.329) 10.809 23.577 ( -10.896 -9.291 3.474) 14.735 23.814 ( -4.937 -2.410 0.939) 5.573 24.420 ( 6.000 5.849 -4.321) 9.428 25.076 ( 2.980 0.610 -6.391) 7.078 25.133 ( -5.834 -5.488 4.372) 9.125 25.328 ( -2.187 -7.385 1.272) 7.807 25.779 ( -11.363 1.096 -0.419) 11.423 26.479 ( 21.062 5.005 2.262) 21.767 27.051 ( 2.711 16.048 8.072) 18.167 28.231 ( 7.030 -5.020 -10.940) 13.940 28.619 ( -3.413 -7.619 7.565) 11.266 29.139 ( -8.893 -0.497 -6.486) 11.019 29.342 ( 9.710 -1.226 -6.614) 11.813 29.535 ( -4.733 7.083 2.846) 8.981 30.353 ( 0.631 -1.496 1.223) 2.033 30.591 ( -6.298 -4.924 1.670) 8.167 30.840 ( 4.020 5.801 8.153) 10.783 39.353 ( 7.148 8.286 -9.453) 14.461 40.320 ( 23.402 -20.948 1.387) 31.439 40.670 ( -1.472 24.505 -18.014) 30.450 41.523 ( 13.152 14.490 4.547) 20.090 42.240 ( 1.853 1.987 -7.225) 7.719 42.640 ( -5.190 -13.248 10.399) 17.623 43.082 ( -7.230 5.940 4.700) 10.471 43.316 ( -7.157 -9.235 15.778) 19.633 44.549 ( -15.111 -12.247 -6.968) 20.661 45.284 ( -0.789 5.318 -1.635) 5.619 48.034 ( 1.481 0.729 0.122) 1.656 48.285 ( 0.050 0.041 0.438) 0.443 ======================= Grid point 97 (44/125) ======================= q-point: (-0.22 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.782 ( -32.513 -22.616 -4.088) 39.816 2.642 ( -45.783 -21.351 -4.638) 50.730 3.686 ( -59.263 -35.789 5.720) 69.467 5.158 ( 20.542 2.297 6.607) 21.700 5.422 ( -1.018 17.875 7.793) 19.527 5.891 ( -3.057 -9.473 -12.183) 15.732 7.034 ( 9.783 1.353 -4.605) 10.897 7.235 ( 10.003 1.068 -1.397) 10.156 7.332 ( 2.381 5.201 -2.191) 6.126 7.526 ( 6.368 6.842 6.235) 11.236 8.131 ( 10.670 11.571 -2.292) 15.906 8.375 ( 5.828 -2.186 2.339) 6.649 8.539 ( -2.340 -3.705 -0.607) 4.424 8.854 ( -1.141 1.101 1.177) 1.975 9.447 ( 7.984 9.608 3.617) 13.005 9.838 ( 7.987 0.810 2.392) 8.377 9.910 ( 0.767 -5.122 -5.941) 7.882 10.347 ( -0.158 5.290 14.093) 15.054 10.620 ( 5.743 8.046 -6.333) 11.740 10.699 ( 2.085 2.166 -7.248) 7.846 11.440 ( 0.347 -3.144 1.300) 3.419 11.589 ( -4.619 -6.919 6.631) 10.639 11.802 ( -3.365 -5.230 0.143) 6.221 12.026 ( -6.974 1.772 -6.532) 9.718 16.183 ( 13.756 8.014 1.324) 15.975 16.373 ( -3.433 -3.544 -1.865) 5.275 16.608 ( -10.896 -4.714 -0.561) 11.885 17.686 ( 11.785 6.850 2.299) 13.824 17.789 ( 8.559 4.812 -2.356) 10.097 18.943 ( 24.740 14.078 -5.163) 28.930 23.224 ( -13.486 -4.254 -2.313) 14.329 23.382 ( -11.570 -10.106 4.966) 16.145 23.759 ( -3.884 -3.033 3.673) 6.146 24.480 ( 4.539 2.834 -4.554) 7.027 24.889 ( -8.753 -2.019 -5.210) 10.384 25.177 ( 2.330 -1.776 2.699) 3.984 25.297 ( 1.185 -4.722 1.739) 5.170 25.597 ( -12.666 -0.159 -1.953) 12.817 26.866 ( 26.493 4.450 -1.022) 26.884 27.388 ( 5.539 25.584 9.650) 27.899 28.182 ( 11.711 -10.445 -8.850) 18.016 28.610 ( -4.689 -5.875 9.880) 12.414 28.900 ( -11.600 0.212 -8.934) 14.643 29.348 ( 3.525 -0.523 -6.338) 7.271 29.532 ( -4.988 0.905 1.500) 5.286 30.374 ( 0.959 0.106 1.121) 1.479 30.487 ( -5.612 -3.013 1.133) 6.470 31.031 ( 5.233 2.784 5.586) 8.145 39.452 ( 10.998 7.384 -5.641) 14.398 40.543 ( 20.957 -6.254 -1.779) 21.942 40.671 ( 2.089 17.057 -7.705) 18.833 41.898 ( 16.733 12.255 3.264) 20.996 42.133 ( -5.894 3.528 -8.072) 10.599 42.588 ( -2.607 -12.829 8.343) 15.524 43.023 ( -8.762 5.986 -5.953) 12.167 43.364 ( -5.693 -12.191 21.306) 25.198 44.160 ( -17.247 -9.406 -5.302) 20.348 45.261 ( -0.796 0.189 -1.704) 1.890 48.058 ( 0.861 0.493 0.047) 0.994 48.289 ( 0.082 0.050 0.134) 0.165 ======================= Grid point 98 (45/125) ======================= q-point: (-0.11 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.303 ( -35.517 -2.804 26.624) 44.476 1.721 ( -54.698 -11.610 -4.473) 56.095 2.765 ( -51.661 -50.384 32.481) 79.135 5.456 ( 16.268 -3.911 1.117) 16.768 5.579 ( -3.850 11.982 1.157) 12.638 5.682 ( -1.379 -2.923 -4.535) 5.568 7.148 ( 7.721 7.486 -4.084) 11.503 7.312 ( 2.489 -0.476 1.981) 3.217 7.487 ( 15.688 3.909 -3.568) 16.557 7.732 ( 6.326 5.860 3.245) 9.213 8.209 ( -0.362 4.562 -13.059) 13.838 8.369 ( 1.474 -0.596 -5.599) 5.820 8.533 ( 2.476 -0.456 3.858) 4.607 8.949 ( 1.921 -2.782 17.572) 17.894 9.656 ( 4.835 4.491 -7.450) 9.953 9.749 ( 0.612 9.439 -3.808) 10.197 9.990 ( 6.966 -6.420 0.812) 9.508 10.341 ( -8.207 8.655 -15.331) 19.424 10.628 ( 3.606 -0.049 -0.923) 3.722 10.895 ( 17.134 -3.414 5.285) 18.253 11.353 ( -5.757 -3.874 -3.775) 7.900 11.521 ( -6.935 -6.481 -0.293) 9.497 11.755 ( -13.056 0.331 -0.427) 13.067 11.883 ( 1.726 3.144 6.109) 7.084 16.273 ( -4.712 -2.663 0.414) 5.428 16.388 ( -2.132 1.702 -3.623) 4.536 16.408 ( 2.702 -1.039 -3.691) 4.691 17.883 ( 6.658 5.402 -6.350) 10.669 17.890 ( 8.803 3.561 -1.659) 9.639 19.326 ( 22.147 12.710 -7.505) 26.615 22.975 ( -12.769 -1.359 -2.338) 13.053 23.229 ( -10.979 -9.442 8.434) 16.758 23.742 ( -2.629 -3.481 6.112) 7.509 24.491 ( 1.548 0.173 -2.075) 2.595 24.738 ( -6.387 -0.903 0.303) 6.458 25.157 ( -3.247 -6.811 -6.091) 9.697 25.288 ( 1.882 0.205 -3.360) 3.857 25.435 ( -7.408 3.062 0.419) 8.026 27.253 ( 27.307 5.474 -4.097) 28.151 27.813 ( 4.586 30.825 9.536) 32.591 28.161 ( 12.273 -14.034 -7.847) 20.228 28.600 ( -6.089 -7.340 1.753) 9.697 28.654 ( -8.561 -0.002 1.421) 8.678 29.300 ( -0.433 -0.279 -4.431) 4.461 29.423 ( -9.256 -4.968 -0.736) 10.531 30.395 ( -0.589 1.698 0.312) 1.825 30.432 ( -1.158 -1.205 1.039) 1.968 31.094 ( 1.027 -3.185 -6.729) 7.515 39.684 ( 16.204 7.170 6.451) 18.857 40.630 ( 2.585 23.433 -16.435) 28.738 40.918 ( 12.344 -2.340 13.612) 18.524 41.919 ( -0.728 1.620 -17.196) 17.287 42.244 ( 10.002 1.264 2.914) 10.494 42.605 ( 1.127 -3.605 11.194) 11.814 42.767 ( -10.851 1.493 -17.956) 21.033 43.421 ( -3.508 -20.136 15.143) 25.438 43.735 ( -25.439 -2.072 -9.298) 27.164 45.336 ( 7.465 -0.923 12.900) 14.933 48.064 ( 0.132 0.099 -0.649) 0.670 48.291 ( 0.155 0.094 -0.175) 0.252 ======================= Grid point 101 (46/125) ======================= q-point: ( 0.22 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.441 ( -1.140 -7.554 39.395) 40.129 3.014 ( 8.997 19.658 39.877) 45.360 4.438 ( -5.417 21.152 53.497) 57.781 5.179 ( -1.175 -3.471 -10.038) 10.686 5.613 ( -6.012 -17.081 -0.909) 18.131 5.988 ( 6.528 5.285 7.385) 11.184 7.053 ( 0.372 -9.884 -7.425) 12.368 7.315 ( 2.008 5.591 -3.119) 6.709 7.524 ( -5.558 -8.470 -1.925) 10.312 7.713 ( 8.765 -9.775 -5.551) 14.254 7.968 ( -11.356 0.608 2.964) 11.752 8.295 ( 2.950 2.458 2.086) 4.370 8.446 ( -1.901 -2.343 -9.798) 10.252 8.775 ( 5.125 -3.253 -20.285) 21.174 9.071 ( -0.747 12.803 -18.221) 22.282 9.877 ( 3.251 -8.992 -3.357) 10.133 10.043 ( 2.082 -8.932 12.951) 15.869 10.086 ( -0.314 1.453 2.081) 2.557 10.351 ( -5.698 0.601 -3.828) 6.891 10.695 ( 0.486 14.512 -8.099) 16.626 11.380 ( -6.847 -6.608 2.590) 9.862 11.454 ( 3.981 1.569 3.228) 5.360 11.715 ( 4.465 13.750 3.593) 14.897 12.147 ( -0.914 -7.581 -2.488) 8.031 15.751 ( 0.030 -3.977 -20.530) 20.911 16.275 ( -0.491 5.152 3.121) 6.043 16.315 ( 0.480 6.233 4.213) 7.538 17.359 ( 0.398 -6.311 -15.807) 17.025 17.522 ( -0.330 4.464 -13.051) 13.797 18.673 ( 0.032 -2.616 -28.452) 28.572 23.260 ( 1.620 -6.602 12.600) 14.317 23.559 ( -2.660 14.121 12.796) 19.241 24.191 ( -0.028 -6.910 10.843) 12.858 24.528 ( -0.806 -5.812 0.593) 5.898 24.725 ( 2.884 4.195 0.548) 5.120 25.073 ( -0.348 -3.518 2.442) 4.297 25.227 ( -3.263 5.615 7.373) 9.825 25.364 ( 3.600 9.539 -0.662) 10.217 27.191 ( -1.956 -20.381 -9.409) 22.533 27.613 ( -1.068 4.841 -9.349) 10.583 27.789 ( 2.557 6.895 -12.002) 14.076 28.798 ( 2.946 -3.821 -6.509) 8.102 29.091 ( -7.092 -5.698 12.922) 15.803 29.185 ( 4.910 -1.527 4.560) 6.873 29.354 ( -1.599 7.964 7.403) 10.990 30.442 ( -1.599 -1.944 1.558) 2.961 30.521 ( 4.037 1.465 2.559) 4.999 30.692 ( -2.216 6.157 -2.146) 6.887 39.898 ( 1.127 -19.668 -16.373) 25.616 40.502 ( 1.452 1.732 -8.085) 8.395 40.689 ( -8.465 -9.870 -21.910) 25.478 41.184 ( 17.613 10.486 -18.247) 27.443 41.565 ( -10.997 23.753 -2.812) 26.326 42.606 ( -0.208 -16.974 16.131) 23.417 43.014 ( 0.081 11.325 12.867) 17.141 43.752 ( -1.209 -17.307 14.695) 22.736 44.338 ( 1.672 17.541 18.058) 25.231 45.640 ( -0.951 -5.526 -7.063) 9.018 47.982 ( -0.036 0.458 -2.233) 2.279 48.278 ( -0.001 -0.028 -0.257) 0.259 ======================= Grid point 102 (47/125) ======================= q-point: ( 0.33 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.863 ( 5.169 2.019 32.436) 32.907 3.814 ( 12.819 22.728 33.736) 42.650 4.867 ( -17.345 -10.960 -11.093) 23.324 5.128 ( 5.740 6.839 30.032) 31.331 5.357 ( -9.301 -11.351 10.123) 17.827 6.217 ( 4.986 7.027 4.741) 9.834 6.877 ( 1.138 -8.947 -10.159) 13.585 7.277 ( 1.095 -17.162 -6.789) 18.488 7.406 ( -3.011 3.650 2.586) 5.392 7.670 ( 7.827 -7.716 -8.440) 13.858 7.790 ( -15.411 -0.348 0.732) 15.432 8.126 ( -5.941 -8.449 -10.260) 14.559 8.494 ( 1.073 12.061 5.950) 13.491 8.737 ( 9.118 0.998 -8.920) 12.795 8.958 ( -0.738 9.000 -13.141) 15.944 9.712 ( -11.153 -0.799 -6.307) 12.838 9.963 ( -0.736 -11.808 0.648) 11.849 10.264 ( -9.720 1.645 6.285) 11.691 10.299 ( 11.753 0.561 4.672) 12.660 10.739 ( 4.319 10.127 -8.284) 13.778 11.280 ( -1.702 -4.241 -1.094) 4.699 11.565 ( 5.722 -0.088 2.407) 6.208 11.945 ( 7.575 9.442 -1.192) 12.164 12.027 ( -4.964 -4.055 2.116) 6.750 15.504 ( 1.012 -2.047 -16.060) 16.221 16.342 ( -0.464 4.396 2.773) 5.218 16.497 ( 7.623 7.802 5.325) 12.138 17.148 ( 2.140 -4.562 -13.742) 14.637 17.415 ( -1.210 5.177 -9.338) 10.746 18.355 ( 2.616 0.497 -25.165) 25.305 23.394 ( 6.738 -7.090 8.284) 12.818 23.725 ( -3.159 7.517 7.421) 11.026 24.207 ( -5.283 -5.952 7.411) 10.875 24.491 ( -0.081 -6.025 0.069) 6.026 24.771 ( 3.775 -3.044 -1.314) 5.024 25.082 ( 1.425 2.389 3.138) 4.193 25.342 ( -3.852 9.875 7.630) 13.060 25.561 ( 7.516 11.528 3.259) 14.142 26.866 ( -7.175 -15.957 -9.924) 20.115 27.305 ( -19.486 -1.459 -3.259) 19.811 27.980 ( 20.948 7.020 -9.130) 23.905 28.661 ( -0.828 -2.725 -11.634) 11.977 29.108 ( -4.198 -4.817 8.925) 10.977 29.316 ( 4.874 -2.527 8.351) 9.993 29.452 ( -0.606 1.818 4.052) 4.482 30.425 ( -3.231 1.963 2.224) 4.386 30.602 ( -1.374 4.271 1.414) 4.705 30.699 ( 2.695 1.366 -0.855) 3.140 39.571 ( -0.921 -12.545 -15.361) 19.854 40.179 ( -1.394 -26.359 -13.411) 29.608 40.590 ( 7.612 19.559 -17.150) 27.104 41.145 ( -2.202 21.561 -20.659) 29.941 41.730 ( 6.920 10.089 5.189) 13.289 42.666 ( 1.064 -18.614 17.074) 25.282 43.202 ( -4.166 7.291 10.706) 13.607 43.696 ( -8.338 -14.383 11.674) 20.314 44.747 ( 6.957 15.530 14.506) 22.361 45.462 ( -5.063 -6.624 -6.838) 10.783 47.965 ( 0.508 0.641 -1.882) 2.052 48.276 ( -0.045 0.070 -0.044) 0.094 ======================= Grid point 103 (48/125) ======================= q-point: ( 0.44 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.375 ( 12.950 6.255 24.625) 28.517 4.224 ( -28.108 -6.408 -1.676) 28.877 4.527 ( 1.151 10.241 13.887) 17.294 4.984 ( -11.105 -17.856 4.963) 21.606 5.802 ( 9.765 7.556 21.670) 24.941 6.309 ( -4.446 6.845 0.379) 8.171 6.715 ( 5.135 -9.834 -9.616) 14.681 7.025 ( 2.569 -23.577 -9.694) 25.621 7.406 ( -12.400 0.456 -14.083) 18.770 7.476 ( 2.862 4.325 -0.845) 5.254 7.781 ( 4.419 5.839 2.106) 7.620 7.946 ( -6.064 -11.117 4.783) 13.537 8.615 ( -4.161 11.425 -2.798) 12.477 8.723 ( -1.067 3.376 -2.716) 4.463 8.985 ( 8.357 -2.609 6.436) 10.866 9.497 ( -9.384 6.534 -6.332) 13.070 9.886 ( 0.926 -6.101 -1.016) 6.254 10.228 ( -7.210 -2.746 7.365) 10.666 10.499 ( 8.547 4.367 0.841) 9.635 10.769 ( 4.378 6.483 -8.283) 11.394 11.240 ( 2.347 -1.525 -2.652) 3.856 11.655 ( 6.991 -4.464 0.235) 8.298 11.877 ( -2.921 -8.777 1.124) 9.319 12.160 ( 1.936 13.204 0.815) 13.370 15.402 ( 6.544 1.552 -8.957) 11.201 16.384 ( 0.306 -0.019 1.491) 1.522 16.754 ( 10.654 7.675 5.275) 14.151 17.037 ( 2.911 0.674 -9.090) 9.569 17.368 ( 0.770 5.936 -4.645) 7.576 18.170 ( 7.133 3.289 -20.246) 21.716 23.511 ( 6.761 -7.736 5.112) 11.476 23.786 ( -1.521 1.850 2.706) 3.613 24.136 ( -5.830 -6.635 3.198) 9.393 24.401 ( -3.708 -4.235 -3.043) 6.399 24.807 ( 3.986 -2.662 3.106) 5.711 25.199 ( 4.952 1.942 2.884) 6.051 25.439 ( -5.137 10.345 5.244) 12.685 25.788 ( 5.207 10.997 3.052) 12.544 26.516 ( -12.327 -5.349 -9.253) 16.315 27.068 ( -11.501 -6.157 5.938) 14.333 28.150 ( 12.132 -1.256 -10.219) 15.912 28.532 ( 6.585 0.975 -10.706) 12.607 29.097 ( -2.684 -5.025 4.251) 7.108 29.429 ( 1.391 -6.770 2.522) 7.357 29.495 ( -1.303 6.499 6.665) 9.400 30.426 ( -4.059 2.274 2.207) 5.149 30.606 ( -0.234 4.842 -1.735) 5.149 30.757 ( 1.165 -0.699 3.896) 4.126 39.318 ( 1.759 -6.104 -15.311) 16.576 39.878 ( 6.047 -22.915 -8.167) 25.067 40.646 ( 8.070 18.211 -19.026) 27.545 41.093 ( -1.501 25.736 -13.634) 29.163 41.958 ( 8.113 3.137 5.506) 10.294 42.726 ( 0.900 -20.407 16.313) 26.142 43.279 ( -7.131 3.427 9.196) 12.131 43.601 ( -9.059 -8.758 9.481) 15.769 45.063 ( 2.550 7.147 6.929) 10.276 45.254 ( -6.256 -1.965 -4.893) 8.182 47.964 ( 1.241 0.737 -1.152) 1.847 48.278 ( 0.030 0.163 0.206) 0.265 ======================= Grid point 104 (49/125) ======================= q-point: (-0.44 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.483 ( -32.233 -14.376 -2.931) 35.415 3.998 ( 13.057 5.930 14.530) 20.415 4.377 ( -24.768 -18.327 3.602) 31.021 5.149 ( 0.977 16.883 19.245) 25.619 5.971 ( -8.524 0.994 -4.560) 9.718 6.111 ( -16.437 -10.900 -5.723) 20.536 6.766 ( 15.758 -14.274 -6.784) 22.318 6.802 ( 9.177 -6.899 -3.014) 11.870 7.081 ( -5.345 9.704 -18.829) 21.846 7.610 ( 4.639 0.975 5.392) 7.180 7.852 ( -12.980 1.243 10.715) 16.877 7.945 ( 9.249 1.197 2.702) 9.710 8.552 ( 2.272 -2.458 -6.389) 7.213 8.753 ( -3.494 5.676 6.000) 8.968 9.180 ( 7.742 -3.235 2.664) 8.804 9.474 ( 0.700 7.847 7.284) 10.730 9.875 ( 0.997 4.871 -2.367) 5.507 10.186 ( -3.153 -6.307 4.284) 8.251 10.597 ( 1.499 5.195 -3.529) 6.457 10.777 ( 2.943 5.959 -7.424) 9.964 11.255 ( 5.117 -0.994 -1.924) 5.556 11.685 ( 4.827 -11.319 2.286) 12.515 11.827 ( -0.246 -2.202 1.396) 2.619 12.242 ( -2.466 8.954 -1.593) 9.423 15.498 ( 12.836 4.800 -2.944) 14.017 16.404 ( 2.044 -2.915 1.773) 3.977 16.968 ( -0.972 2.983 -4.274) 5.302 17.047 ( 11.037 7.269 3.658) 13.713 17.430 ( 5.675 5.629 -1.495) 8.132 18.129 ( 12.672 5.845 -15.678) 20.989 23.570 ( 2.455 -9.112 4.987) 10.674 23.776 ( -3.166 -0.001 -0.858) 3.280 24.035 ( -7.399 -5.670 4.391) 10.304 24.284 ( 0.698 -3.170 -6.328) 7.112 24.898 ( 4.564 0.164 2.976) 5.451 25.274 ( 3.138 -2.382 0.305) 3.952 25.459 ( -10.408 6.495 2.940) 12.616 25.936 ( 3.107 8.857 -0.884) 9.428 26.282 ( -8.921 0.459 -0.089) 8.933 27.039 ( -2.629 0.600 10.056) 10.412 28.039 ( 5.401 -10.979 -15.381) 19.654 28.623 ( 9.705 4.593 -2.326) 10.986 29.069 ( 2.294 -3.776 -1.492) 4.663 29.352 ( -5.232 -4.342 -0.807) 6.847 29.625 ( -1.361 7.850 5.325) 9.583 30.383 ( -3.498 -2.215 0.663) 4.192 30.657 ( 2.470 4.514 -0.719) 5.195 30.803 ( -1.414 -0.421 5.870) 6.052 39.166 ( 6.224 -2.354 -13.586) 15.128 39.797 ( 13.323 -16.960 -1.251) 21.603 40.651 ( 3.924 20.865 -19.920) 29.113 41.209 ( 6.965 23.493 -7.696) 25.684 42.129 ( 5.359 0.113 5.091) 7.393 42.728 ( -1.285 -22.821 13.322) 26.456 43.303 ( -7.192 1.671 9.061) 11.688 43.533 ( -8.236 -4.790 8.536) 12.792 44.927 ( -11.294 -8.086 -4.607) 14.634 45.296 ( -0.107 9.476 0.237) 9.479 47.984 ( 1.847 0.798 -0.271) 2.030 48.283 ( 0.090 0.172 0.315) 0.370 ======================= Grid point 105 (50/125) ======================= q-point: (-0.33 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.850 ( -40.508 -7.543 4.140) 41.412 3.784 ( -35.861 -23.129 6.692) 43.194 4.494 ( 21.320 4.201 7.102) 22.861 5.289 ( -44.976 -10.842 -2.109) 46.312 5.528 ( -6.429 15.651 8.817) 19.079 5.868 ( 1.740 -12.412 -12.742) 17.873 6.708 ( 14.465 -10.137 -6.522) 18.829 6.901 ( 6.552 4.798 -9.839) 12.758 7.135 ( 14.390 8.876 -1.853) 17.009 7.627 ( -8.750 -4.302 5.465) 11.178 7.936 ( 1.201 10.769 7.708) 13.298 8.118 ( 9.412 0.293 3.077) 9.906 8.497 ( 5.216 -7.827 -6.211) 11.271 8.861 ( -0.227 3.473 8.350) 9.046 9.215 ( 6.034 -0.756 -3.194) 6.869 9.735 ( 4.914 3.390 13.964) 15.186 9.903 ( 0.712 7.569 -7.137) 10.428 10.193 ( 3.148 -2.070 7.273) 8.191 10.562 ( -0.237 2.812 -7.956) 8.441 10.747 ( -1.806 4.053 -6.264) 7.677 11.315 ( 6.811 -1.773 -0.957) 7.103 11.685 ( -1.153 -6.293 5.573) 8.484 11.832 ( 2.199 -2.560 -1.207) 3.584 12.210 ( -6.084 4.640 -1.900) 7.884 15.735 ( 16.675 6.502 -1.379) 17.951 16.426 ( 0.391 -3.135 2.150) 3.821 16.881 ( -6.893 1.032 -2.414) 7.376 17.323 ( 13.275 6.236 2.869) 14.945 17.548 ( 7.438 4.047 -1.506) 8.601 18.267 ( 20.837 9.523 -10.533) 25.215 23.547 ( -5.261 -8.154 5.916) 11.365 23.664 ( -8.009 -4.053 -1.549) 9.109 23.940 ( -9.368 -3.619 5.821) 11.608 24.258 ( 9.299 -0.737 -7.122) 11.736 24.979 ( 3.231 4.532 -3.525) 6.588 25.268 ( 1.939 -4.833 -1.834) 5.521 25.341 ( -15.712 1.009 6.986) 17.224 25.964 ( -8.430 8.690 -3.341) 12.559 26.295 ( 9.307 -3.089 4.525) 10.799 27.237 ( 4.467 11.858 11.597) 17.177 27.848 ( 9.807 -14.015 -15.712) 23.227 28.745 ( -0.571 2.747 5.970) 6.596 29.082 ( 10.411 -1.110 -8.251) 13.330 29.207 ( -9.267 0.181 -3.273) 9.830 29.678 ( -4.864 4.584 1.997) 6.976 30.346 ( 0.189 -3.209 1.662) 3.619 30.668 ( -4.151 0.764 0.315) 4.232 30.880 ( 3.832 0.178 3.922) 5.486 39.141 ( 10.645 0.570 -8.991) 13.946 39.938 ( 19.137 -8.988 3.721) 21.468 40.647 ( 2.097 22.668 -16.384) 28.048 41.449 ( 13.091 19.494 -6.247) 24.299 42.226 ( 0.515 1.367 3.188) 3.507 42.644 ( -2.308 -25.608 10.761) 27.873 43.296 ( -8.824 4.782 1.338) 10.126 43.505 ( -5.278 -9.374 13.232) 17.053 44.637 ( -15.753 -5.488 -1.933) 16.793 45.302 ( -2.105 4.265 -5.245) 7.081 48.018 ( 1.881 0.737 0.213) 2.031 48.288 ( 0.044 0.067 0.166) 0.185 ======================= Grid point 106 (51/125) ======================= q-point: (-0.22 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.414 ( -41.221 7.005 21.664) 47.091 3.132 ( -44.159 -16.137 4.929) 47.273 4.346 ( -57.227 -24.447 7.357) 62.663 4.880 ( 21.959 -2.540 -0.919) 22.125 5.607 ( 6.658 -14.616 -14.299) 21.504 5.759 ( -8.308 19.409 9.157) 23.013 6.839 ( 14.439 3.618 -3.419) 15.273 6.983 ( 15.169 2.248 -6.554) 16.677 7.347 ( 5.393 7.282 -1.230) 9.145 7.546 ( -1.662 -4.591 4.493) 6.635 8.139 ( 3.505 10.544 3.291) 11.589 8.259 ( 6.951 -1.291 -1.506) 7.228 8.425 ( 5.314 -7.128 -4.767) 10.088 8.933 ( -1.600 -1.640 6.581) 6.969 9.361 ( 14.060 -1.154 3.827) 14.618 9.814 ( -2.996 6.069 -11.708) 13.523 9.928 ( -0.712 6.703 7.336) 9.963 10.375 ( 10.552 -4.541 -1.419) 11.575 10.459 ( 2.469 -2.301 -10.624) 11.148 10.706 ( -3.977 5.997 6.217) 9.509 11.363 ( 4.635 -2.968 -2.596) 6.085 11.687 ( -3.439 1.100 3.512) 5.037 11.785 ( -1.699 -4.084 -2.591) 5.126 12.138 ( -7.362 2.612 1.630) 7.980 15.989 ( 16.711 6.037 -5.705) 18.662 16.408 ( -3.797 -1.960 3.012) 5.228 16.728 ( -10.644 -2.055 -1.991) 11.022 17.574 ( 12.977 3.661 1.013) 13.522 17.655 ( 8.267 3.763 -4.659) 10.208 18.597 ( 26.760 11.684 -6.436) 29.900 23.388 ( -15.271 0.413 -2.835) 15.538 23.524 ( -7.572 -12.250 9.411) 17.204 23.868 ( -6.790 -3.257 5.655) 9.418 24.333 ( 9.859 1.953 -4.824) 11.148 24.949 ( -4.597 8.058 -7.457) 11.902 25.222 ( 0.893 -2.429 -2.761) 3.784 25.264 ( -8.578 -5.066 9.314) 13.638 25.795 ( -15.298 2.900 -1.814) 15.676 26.545 ( 21.320 1.561 0.168) 21.378 27.587 ( 10.684 4.990 13.428) 17.871 27.744 ( 13.100 -3.582 -13.754) 19.329 28.794 ( -6.364 1.375 7.941) 10.269 28.983 ( -11.181 -1.432 -5.049) 12.351 29.166 ( 9.360 5.868 -9.298) 14.439 29.621 ( -6.250 -1.253 0.226) 6.379 30.375 ( 1.997 -1.156 2.906) 3.711 30.582 ( -7.810 -0.833 0.382) 7.863 30.963 ( 6.243 -3.543 -1.332) 7.301 39.264 ( 14.227 3.692 -2.334) 14.882 40.236 ( 20.992 2.275 0.537) 21.122 40.718 ( 3.483 19.795 -4.638) 20.628 41.693 ( 13.035 14.733 -9.760) 21.960 42.239 ( -4.569 2.944 0.742) 5.486 42.545 ( 1.683 -26.152 10.841) 28.360 43.122 ( -12.775 4.566 -11.159) 17.567 43.526 ( -3.579 -15.954 14.576) 21.905 44.367 ( -20.150 0.119 2.273) 20.279 45.234 ( 0.395 -0.278 -3.228) 3.264 48.046 ( 1.195 0.429 -0.101) 1.273 48.289 ( 0.010 -0.053 -0.121) 0.133 ======================= Grid point 107 (52/125) ======================= q-point: (-0.11 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.320 ( -37.672 8.014 27.647) 47.411 2.444 ( -50.273 9.983 12.637) 52.790 3.548 ( -52.243 -33.852 33.499) 70.693 5.128 ( 22.373 -4.413 -4.649) 23.273 5.423 ( 7.002 -11.374 -13.123) 18.724 5.901 ( -7.938 15.617 8.705) 19.563 7.031 ( 10.745 9.174 -4.338) 14.780 7.190 ( 18.816 2.216 -3.088) 19.196 7.356 ( -3.035 -0.938 1.440) 3.488 7.643 ( 10.879 -2.561 0.354) 11.182 8.120 ( -3.349 2.063 -12.352) 12.963 8.315 ( 1.795 4.169 0.046) 4.539 8.464 ( 6.966 -4.062 0.402) 8.074 9.049 ( 7.551 -4.567 11.305) 14.341 9.529 ( 3.375 -3.126 -2.338) 5.160 9.757 ( 4.397 11.457 -3.626) 12.796 9.972 ( -3.012 3.432 -5.521) 7.165 10.247 ( -2.348 6.698 -17.596) 18.973 10.380 ( 7.835 -19.082 -4.043) 21.020 10.917 ( 3.007 4.065 15.055) 15.882 11.310 ( -1.433 -2.624 -6.500) 7.155 11.586 ( -9.831 -0.916 -3.180) 10.373 11.800 ( 4.951 -1.307 4.241) 6.649 12.077 ( -9.683 5.534 2.531) 11.437 16.125 ( 12.334 2.554 -12.039) 17.424 16.377 ( -4.848 -0.060 3.201) 5.809 16.524 ( -12.296 -1.834 -1.233) 12.493 17.700 ( 8.005 1.301 -8.490) 11.741 17.761 ( 9.566 2.678 -3.868) 10.660 18.974 ( 24.471 9.501 -8.649) 27.639 23.155 ( -13.739 3.798 -1.578) 14.341 23.441 ( -10.751 -10.921 12.404) 19.716 23.826 ( -3.981 -4.161 5.948) 8.278 24.434 ( 6.159 4.842 -1.995) 8.085 24.859 ( -6.956 6.407 -2.138) 9.696 25.169 ( -7.640 -3.856 -0.781) 8.594 25.197 ( 0.973 -2.475 -1.781) 3.201 25.605 ( -12.374 1.039 1.279) 12.483 26.883 ( 24.677 5.884 -3.982) 25.680 27.668 ( 19.057 -23.107 -8.272) 31.073 28.041 ( 8.314 22.614 8.092) 25.417 28.697 ( -12.701 -4.530 -1.856) 13.612 28.837 ( -7.788 4.799 5.389) 10.617 29.221 ( 4.739 5.680 -6.616) 9.924 29.503 ( -7.443 -3.211 -0.817) 8.148 30.434 ( 0.803 0.435 3.364) 3.486 30.466 ( -5.925 -2.652 -0.241) 6.497 30.936 ( 2.675 -7.355 -6.647) 10.269 39.541 ( 18.505 5.869 3.372) 19.704 40.480 ( 14.380 16.542 -14.325) 26.185 41.003 ( 9.015 7.807 14.516) 18.786 41.752 ( 0.841 14.422 -15.295) 21.039 42.159 ( -1.694 -15.604 0.742) 15.713 42.518 ( 2.369 -10.752 -5.796) 12.442 42.842 ( -9.155 4.473 -3.731) 10.851 43.397 ( -9.364 -20.501 2.190) 22.645 44.153 ( -22.503 3.672 12.151) 25.836 45.314 ( 9.740 -0.270 5.891) 11.386 48.052 ( 0.229 0.049 -0.942) 0.971 48.286 ( 0.117 -0.096 -0.320) 0.354 ======================= Grid point 110 (53/125) ======================= q-point: ( 0.22 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.891 ( -5.164 -0.331 36.300) 36.667 3.533 ( -2.160 7.175 35.193) 35.982 4.928 ( 13.760 -4.161 -9.220) 17.078 5.328 ( -11.145 13.552 25.586) 31.025 5.460 ( 3.965 -2.193 4.704) 6.531 6.055 ( 0.764 -0.479 8.740) 8.786 6.882 ( -1.995 -12.509 -6.268) 14.133 7.269 ( 0.698 0.840 -3.637) 3.797 7.385 ( 4.335 -15.189 -11.116) 19.315 7.623 ( -5.515 3.003 3.371) 7.127 8.145 ( -9.393 -7.603 -3.742) 12.651 8.195 ( 19.398 5.879 -11.806) 23.457 8.262 ( 6.230 4.566 4.174) 8.780 8.576 ( -7.914 -3.945 -10.366) 13.625 9.037 ( -3.599 9.927 -7.547) 12.979 9.593 ( 15.076 -9.468 -2.744) 18.013 10.004 ( 0.756 -13.650 1.776) 13.786 10.170 ( -0.908 5.243 0.862) 5.391 10.446 ( -2.595 6.558 2.845) 7.604 10.738 ( -4.768 9.068 -7.275) 12.566 11.390 ( 4.556 2.238 -1.869) 5.409 11.524 ( -12.127 -4.496 1.684) 13.043 11.815 ( -0.245 4.672 4.265) 6.331 12.080 ( 1.358 -1.670 -0.600) 2.234 15.504 ( -1.052 -1.980 -15.978) 16.134 16.361 ( 0.163 6.029 4.058) 7.269 16.491 ( -8.154 7.564 4.898) 12.153 17.125 ( -0.142 -7.101 -13.453) 15.213 17.421 ( 0.169 6.069 -10.751) 12.347 18.359 ( -2.729 0.674 -24.620) 24.780 23.364 ( -4.705 -6.676 9.077) 12.210 23.806 ( -1.299 10.586 6.117) 12.295 24.212 ( 6.663 -5.978 10.485) 13.787 24.485 ( 0.217 -8.100 -5.306) 9.686 24.702 ( -3.048 -2.769 2.943) 5.062 25.126 ( -1.884 1.924 3.425) 4.357 25.356 ( 4.981 10.116 4.993) 12.332 25.486 ( -6.533 7.633 4.751) 11.114 26.925 ( 4.777 -15.574 -8.805) 18.518 27.295 ( 20.555 2.754 -7.303) 21.987 27.956 ( -20.568 4.039 -5.871) 21.767 28.619 ( 2.392 -5.233 -8.833) 10.542 29.167 ( 3.752 -2.181 5.297) 6.848 29.268 ( -4.318 -2.113 7.245) 8.695 29.527 ( -3.511 4.761 5.796) 8.282 30.411 ( 6.581 -1.595 2.709) 7.294 30.522 ( 0.102 1.300 1.090) 1.700 30.762 ( -2.996 5.560 -1.818) 6.572 39.509 ( 3.390 -16.337 -15.239) 22.597 40.392 ( -13.240 -25.444 -14.063) 31.945 40.571 ( -3.367 15.989 -12.623) 20.647 40.872 ( 13.690 19.798 -16.404) 29.129 41.857 ( -9.840 17.064 -1.984) 19.797 42.667 ( -1.476 -17.887 16.124) 24.127 43.196 ( 4.687 6.650 10.617) 13.376 43.733 ( 7.170 -12.981 12.376) 19.315 44.694 ( -4.974 12.542 14.856) 20.068 45.493 ( 3.647 -4.176 -7.829) 9.594 47.967 ( -0.593 0.788 -1.874) 2.117 48.276 ( 0.049 0.062 -0.044) 0.091 ======================= Grid point 111 (54/125) ======================= q-point: ( 0.33 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.228 ( -2.307 -0.144 31.202) 31.287 4.134 ( 14.974 13.824 30.149) 36.390 4.882 ( -6.646 -5.882 -7.430) 11.575 5.143 ( -1.859 -20.576 -3.569) 20.966 5.814 ( -6.498 22.320 23.954) 33.380 6.253 ( 4.290 2.372 8.128) 9.491 6.642 ( -0.906 -16.528 -9.747) 19.209 7.020 ( -1.514 -13.403 -15.390) 20.464 7.389 ( 7.778 -0.560 -3.633) 8.603 7.549 ( -7.801 -6.473 2.252) 10.384 7.972 ( 0.334 -6.604 -4.426) 7.957 8.059 ( -16.216 0.966 -3.634) 16.646 8.468 ( 17.610 10.427 -7.161) 21.682 8.662 ( 3.975 5.581 13.018) 14.711 8.945 ( -5.257 7.784 -8.108) 12.408 9.667 ( 4.802 -4.609 -3.552) 7.545 9.910 ( -1.746 -10.886 0.806) 11.055 10.218 ( 4.666 7.568 -1.182) 8.969 10.475 ( -6.150 -0.790 6.649) 9.092 10.678 ( 0.305 7.865 -8.897) 11.879 11.298 ( -8.730 -7.054 -0.066) 11.224 11.462 ( 6.426 1.189 -6.048) 8.904 11.891 ( 1.261 -3.338 2.253) 4.220 12.126 ( 0.673 8.208 3.703) 9.030 15.307 ( -0.061 -0.318 -12.562) 12.566 16.439 ( -3.399 4.226 1.642) 5.666 16.560 ( 1.807 7.484 5.824) 9.653 16.937 ( 1.501 -4.102 -9.538) 10.490 17.381 ( 0.622 7.581 -6.427) 9.958 18.075 ( -0.680 4.750 -21.720) 22.244 23.371 ( 0.694 -8.001 6.860) 10.562 23.844 ( -2.865 1.348 -0.373) 3.188 24.244 ( -2.564 -12.005 0.672) 12.294 24.434 ( 3.320 -5.888 1.421) 6.908 24.734 ( 0.918 0.593 6.174) 6.270 25.155 ( -1.681 2.120 3.525) 4.444 25.548 ( 0.558 13.425 0.820) 13.461 25.616 ( 3.491 11.800 8.510) 14.962 26.744 ( -3.116 -9.847 -5.302) 11.610 27.446 ( 2.409 -3.422 -5.513) 6.921 27.714 ( -0.784 6.228 -4.299) 7.608 28.445 ( 0.832 -7.264 -14.703) 16.421 29.200 ( -1.854 -4.664 3.794) 6.292 29.337 ( 2.117 -4.730 8.843) 10.249 29.582 ( -3.768 3.819 7.021) 8.837 30.494 ( -0.019 1.946 2.960) 3.542 30.608 ( 7.192 2.508 1.343) 7.734 30.713 ( -5.063 4.605 -3.610) 7.737 39.242 ( 2.894 -15.143 -14.666) 21.279 39.886 ( -6.306 -20.402 -14.137) 25.610 40.536 ( -1.709 21.393 -13.448) 25.327 41.001 ( 9.305 19.341 -16.367) 26.991 41.889 ( -3.567 12.279 2.965) 13.126 42.699 ( 0.213 -21.757 17.820) 28.124 43.383 ( 0.466 1.693 8.419) 8.600 43.779 ( -2.351 -12.951 9.948) 16.499 44.961 ( 2.551 14.401 10.873) 18.224 45.384 ( -1.310 -3.741 -6.678) 7.766 47.948 ( -0.119 0.823 -1.468) 1.687 48.277 ( 0.004 0.195 0.019) 0.196 ======================= Grid point 112 (55/125) ======================= q-point: ( 0.44 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.582 ( 4.154 3.051 23.647) 24.202 4.452 ( -21.327 -11.538 -5.644) 24.896 4.772 ( 5.585 8.243 19.062) 21.506 4.997 ( 0.051 -12.079 5.608) 13.318 6.097 ( -8.102 14.154 9.715) 18.983 6.345 ( 4.062 -2.554 -3.349) 5.852 6.390 ( 6.383 -18.673 -5.186) 20.404 6.737 ( -2.954 -4.289 -16.540) 17.340 7.325 ( -3.198 -2.428 -11.308) 12.000 7.494 ( 0.551 -4.925 6.580) 8.238 7.805 ( -2.432 -2.351 -2.693) 4.324 8.058 ( -2.735 5.530 9.164) 11.047 8.642 ( 1.661 -0.738 -0.815) 1.992 8.797 ( -2.482 10.158 -1.200) 10.525 8.968 ( 5.908 2.175 7.253) 9.605 9.581 ( -5.645 4.810 -5.234) 9.077 9.811 ( -0.601 -8.257 0.344) 8.286 10.359 ( 1.241 -8.495 3.971) 9.460 10.457 ( -0.034 11.879 1.537) 11.978 10.666 ( 4.502 5.581 -7.852) 10.633 11.173 ( -1.030 -4.352 -1.703) 4.785 11.467 ( 7.943 -5.527 -5.892) 11.330 11.878 ( -1.729 -3.944 2.683) 5.074 12.264 ( 0.717 10.309 2.313) 10.590 15.231 ( 5.293 2.432 -7.198) 9.260 16.398 ( -2.234 -1.668 -0.847) 2.914 16.749 ( 7.059 6.428 4.161) 10.415 16.904 ( 4.504 2.273 -3.174) 5.960 17.397 ( -0.602 8.117 -1.964) 8.373 17.911 ( 3.028 7.873 -17.272) 19.222 23.417 ( 5.150 -9.253 5.660) 12.007 23.796 ( -0.334 -1.543 -2.332) 2.816 24.103 ( -0.351 -11.477 -2.695) 11.794 24.394 ( -3.827 -6.752 1.342) 7.876 24.844 ( 0.804 2.456 6.297) 6.806 25.192 ( 0.786 0.631 1.035) 1.445 25.666 ( -2.664 13.858 3.194) 14.469 25.842 ( 3.167 9.082 4.237) 10.510 26.577 ( -8.514 3.079 -3.453) 9.690 27.257 ( -12.402 -8.001 5.110) 15.618 27.840 ( 12.722 -0.683 -8.706) 15.431 28.241 ( 7.939 -4.236 -15.212) 17.674 29.157 ( -3.876 -5.104 2.724) 6.964 29.402 ( 1.382 -6.010 4.541) 7.659 29.664 ( -2.602 5.400 7.903) 9.920 30.526 ( -3.888 2.678 1.685) 5.013 30.622 ( -2.808 3.627 -4.105) 6.156 30.752 ( 6.056 1.331 2.638) 6.738 39.015 ( 4.154 -10.837 -13.391) 17.721 39.580 ( 2.164 -14.980 -7.882) 17.065 40.540 ( 1.271 21.932 -15.270) 26.754 41.082 ( 4.864 23.055 -14.066) 27.442 42.005 ( 2.280 4.655 5.395) 7.481 42.732 ( 0.490 -24.046 17.179) 29.557 43.445 ( -2.531 -4.262 7.466) 8.962 43.742 ( -5.898 -6.262 7.352) 11.316 45.124 ( -1.934 0.125 -1.135) 2.245 45.315 ( -1.572 8.289 0.807) 8.476 47.945 ( 0.741 0.754 -0.667) 1.250 48.280 ( 0.101 0.255 0.078) 0.285 ======================= Grid point 113 (56/125) ======================= q-point: (-0.44 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.831 ( -15.510 -3.670 9.483) 18.546 4.073 ( -5.595 0.348 6.490) 8.576 4.627 ( -21.971 -17.790 6.936) 29.109 5.295 ( 13.011 -0.113 8.319) 15.443 6.036 ( -10.773 2.549 -2.712) 11.398 6.148 ( 2.693 -9.049 -10.283) 13.960 6.429 ( -6.258 -2.594 -13.554) 15.152 6.644 ( 14.645 3.151 5.976) 16.128 7.068 ( -12.714 6.635 -12.663) 19.132 7.599 ( 5.762 -4.189 8.571) 11.145 7.820 ( 6.750 -7.237 2.917) 10.318 8.172 ( -4.624 8.673 7.755) 12.519 8.507 ( -9.457 -0.969 -4.288) 10.429 8.868 ( 0.823 -0.818 5.817) 5.931 9.097 ( 2.911 -0.989 -0.108) 3.077 9.587 ( 2.221 6.027 4.596) 7.898 9.789 ( 5.587 -0.545 -4.944) 7.480 10.274 ( -5.758 -8.432 6.257) 11.975 10.563 ( 1.059 9.900 -7.353) 12.377 10.729 ( 4.318 7.030 -1.914) 8.469 11.138 ( 3.772 -2.976 -2.580) 5.453 11.511 ( 11.218 -7.008 0.964) 13.262 11.846 ( -2.619 -1.875 0.685) 3.293 12.334 ( -2.445 6.604 -0.397) 7.053 15.322 ( 11.602 4.756 -3.008) 12.894 16.382 ( 1.549 -1.818 2.054) 3.150 16.896 ( 5.775 0.985 -2.871) 6.524 17.013 ( 7.462 5.689 3.077) 9.875 17.445 ( -0.079 7.581 -0.113) 7.582 17.875 ( 7.249 9.505 -12.476) 17.278 23.494 ( 6.170 -10.520 7.007) 14.065 23.767 ( 0.825 0.366 -2.714) 2.860 24.010 ( 3.418 -7.986 -2.585) 9.064 24.268 ( -8.441 -6.225 1.225) 10.559 24.928 ( 0.347 3.416 2.495) 4.244 25.200 ( 1.725 -1.605 -1.953) 3.061 25.758 ( -8.821 12.250 6.217) 16.325 25.918 ( 1.213 1.647 -1.260) 2.403 26.475 ( -11.753 8.424 0.383) 14.465 27.195 ( -2.674 -3.641 11.459) 12.317 27.691 ( 1.754 -12.262 -17.002) 21.036 28.356 ( 21.309 5.959 -7.948) 23.511 29.085 ( -4.744 -3.625 1.555) 6.170 29.389 ( -3.002 -4.557 2.770) 6.120 29.762 ( -1.340 5.334 4.685) 7.225 30.429 ( -6.646 -0.876 -2.775) 7.256 30.641 ( 2.677 3.313 -0.965) 4.367 30.852 ( 1.863 -0.128 3.675) 4.122 38.887 ( 6.981 -5.601 -9.182) 12.822 39.518 ( 10.480 -7.904 -2.297) 13.326 40.562 ( 2.538 21.315 -14.760) 26.050 41.201 ( 5.722 24.732 -10.523) 27.480 42.136 ( 4.564 -1.201 5.694) 7.396 42.709 ( -1.771 -25.814 13.718) 29.286 43.453 ( -2.720 -6.176 7.563) 10.136 43.689 ( -7.091 -3.179 5.278) 9.394 44.990 ( -8.673 -2.820 -1.759) 9.288 45.369 ( -2.453 8.346 -3.219) 9.276 47.965 ( 1.593 0.707 0.245) 1.760 48.285 ( 0.188 0.202 0.039) 0.279 ======================= Grid point 114 (57/125) ======================= q-point: (-0.33 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.509 ( -35.153 4.431 13.824) 38.032 4.188 ( -27.912 -18.096 6.468) 33.888 4.294 ( 12.136 -3.174 5.331) 13.630 5.331 ( 10.176 -20.333 -14.663) 27.055 5.759 ( -31.047 -3.746 -5.271) 31.713 6.046 ( -12.599 17.385 6.891) 22.549 6.325 ( 17.172 -5.050 -5.952) 18.863 6.838 ( -5.748 9.407 -6.239) 12.667 6.987 ( 14.705 7.690 0.571) 16.604 7.721 ( -0.098 -5.412 7.661) 9.380 7.908 ( 10.174 -8.985 4.103) 14.180 8.243 ( -2.462 7.142 -0.040) 7.555 8.338 ( -6.565 0.790 -1.304) 6.740 8.971 ( 2.132 -1.814 9.060) 9.482 9.065 ( 3.523 -5.324 -3.964) 7.514 9.754 ( 10.516 -3.086 -0.049) 10.959 9.803 ( 4.912 4.378 -7.132) 9.704 10.261 ( -2.753 -1.310 7.751) 8.329 10.502 ( -3.520 3.579 -8.115) 9.542 10.796 ( -0.872 6.619 1.827) 6.921 11.177 ( 6.887 -0.054 -2.173) 7.222 11.668 ( 9.627 -1.947 3.919) 10.575 11.787 ( -2.691 -1.701 -1.627) 3.575 12.303 ( -4.828 2.358 -1.047) 5.474 15.528 ( 15.162 5.555 -2.666) 16.366 16.447 ( 1.233 0.110 5.325) 5.467 16.883 ( 0.419 -2.191 -4.845) 5.334 17.220 ( 11.104 3.476 2.165) 11.835 17.504 ( 1.692 5.445 -1.096) 5.806 17.993 ( 14.481 11.855 -6.913) 19.950 23.573 ( 2.861 -11.637 10.251) 15.770 23.723 ( -5.284 2.037 -3.125) 6.468 24.023 ( 9.840 -1.788 -4.745) 11.070 24.110 ( -9.921 -5.676 4.106) 12.145 24.969 ( 0.179 6.680 -3.341) 7.471 25.173 ( 1.752 -2.543 -3.333) 4.544 25.706 ( -17.415 1.870 8.309) 19.386 25.990 ( 6.063 8.320 -2.206) 10.529 26.347 ( -11.655 -3.545 2.637) 12.464 27.322 ( 5.472 -15.816 4.011) 17.210 27.488 ( 5.938 10.348 -8.594) 14.704 28.630 ( 20.260 7.485 -5.810) 22.366 29.008 ( -5.066 -1.566 0.784) 5.361 29.317 ( -7.735 -0.833 1.438) 7.911 29.791 ( -4.567 1.854 1.117) 5.054 30.328 ( -0.485 -2.646 -1.571) 3.116 30.678 ( 1.965 1.119 -2.325) 3.243 30.886 ( -1.334 -2.370 3.305) 4.280 38.911 ( 10.416 -0.035 -3.521) 10.995 39.678 ( 17.467 0.474 0.317) 17.476 40.617 ( 3.410 19.580 -9.922) 22.214 41.388 ( 8.211 23.845 -7.974) 26.450 42.239 ( 4.453 -2.914 3.508) 6.374 42.589 ( -4.171 -27.664 9.802) 29.644 43.411 ( -6.466 -2.833 -0.874) 7.114 43.634 ( -5.149 -8.858 9.472) 13.953 44.839 ( -12.800 0.790 3.659) 13.337 45.290 ( -3.986 3.228 -8.946) 10.312 48.001 ( 1.817 0.568 0.588) 1.993 48.288 ( 0.123 0.036 -0.136) 0.187 ======================= Grid point 115 (58/125) ======================= q-point: (-0.22 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.328 ( -34.147 13.386 23.697) 43.667 3.693 ( -37.039 -10.976 9.931) 39.887 4.482 ( 20.101 -7.402 -4.695) 21.929 4.977 ( -24.006 -19.318 -5.621) 31.322 5.212 ( -13.162 -13.148 -6.925) 19.851 6.149 ( -9.227 16.833 8.817) 21.124 6.564 ( 21.932 5.283 -3.849) 22.885 6.827 ( 2.832 11.363 -5.498) 12.937 7.249 ( 12.193 4.636 0.789) 13.069 7.659 ( -10.668 -6.731 5.616) 13.808 8.076 ( 14.519 -10.288 6.308) 18.879 8.159 ( 1.164 -1.234 -10.405) 10.542 8.371 ( -3.000 10.238 3.419) 11.203 8.946 ( 0.195 -6.861 -2.561) 7.326 9.217 ( 12.782 -4.205 9.310) 16.363 9.755 ( 1.665 9.223 -11.285) 14.670 9.835 ( 11.995 -11.602 -9.354) 19.130 10.318 ( -3.422 -1.929 5.078) 6.420 10.346 ( -5.914 2.460 -5.517) 8.453 10.917 ( -0.435 7.664 10.385) 12.915 11.239 ( 4.893 0.917 -3.337) 5.993 11.710 ( 1.481 -2.675 -4.669) 5.581 11.774 ( -1.671 2.782 0.674) 3.314 12.254 ( -3.553 0.037 2.410) 4.294 15.731 ( 14.468 4.498 -6.297) 16.408 16.510 ( -3.281 1.372 5.773) 6.780 16.773 ( -3.721 -3.591 -4.742) 7.016 17.413 ( 12.260 -0.591 -0.171) 12.276 17.551 ( 3.252 5.133 -3.795) 7.164 18.297 ( 21.218 12.927 -2.852) 25.008 23.552 ( -11.216 -0.492 -4.121) 11.959 23.632 ( -4.087 -8.117 12.556) 15.500 23.980 ( -4.852 -4.152 1.122) 6.484 24.165 ( 10.113 2.518 0.174) 10.424 24.955 ( -0.101 8.524 -9.033) 12.421 25.143 ( 0.659 -0.017 -2.606) 2.688 25.554 ( -16.371 -4.885 8.509) 19.086 26.010 ( -13.876 4.767 -0.779) 14.693 26.316 ( 12.981 -2.111 2.443) 13.376 27.194 ( 12.226 -21.295 -10.193) 26.587 27.787 ( 9.256 19.364 7.857) 22.856 28.855 ( 12.081 2.282 -8.605) 15.007 28.958 ( -2.267 4.149 4.024) 6.209 29.200 ( -11.251 4.049 -0.246) 11.960 29.697 ( -7.498 -2.750 -0.480) 8.000 30.346 ( 5.234 -2.449 1.478) 5.965 30.642 ( -2.269 -1.205 -3.586) 4.411 30.860 ( -1.377 -5.096 0.767) 5.334 39.088 ( 13.865 4.463 1.234) 14.618 39.971 ( 19.852 10.527 -5.748) 23.194 40.772 ( 6.737 13.800 3.188) 15.684 41.604 ( 7.777 22.193 -6.927) 24.515 42.275 ( -0.452 1.587 -4.509) 4.801 42.402 ( -0.626 -32.978 8.809) 34.140 43.192 ( -12.355 -0.932 -8.890) 15.250 43.596 ( -5.323 -15.287 9.561) 18.799 44.725 ( -17.287 4.175 8.427) 19.679 45.170 ( 0.959 0.208 -6.036) 6.115 48.031 ( 1.220 0.245 0.067) 1.246 48.285 ( 0.004 -0.152 -0.316) 0.350 ======================= Grid point 116 (59/125) ======================= q-point: (-0.11 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.062 ( -41.887 0.246 7.464) 42.548 3.442 ( -31.855 11.118 29.500) 44.817 4.441 ( -42.174 -12.307 29.604) 52.977 4.671 ( 24.499 -4.459 -8.483) 26.307 4.985 ( 11.545 -15.418 -14.795) 24.288 6.238 ( -8.508 12.713 6.633) 16.674 6.884 ( 20.405 11.095 -4.772) 23.712 6.938 ( 8.373 7.915 -3.640) 12.083 7.406 ( 6.495 1.333 -0.925) 6.695 7.513 ( -6.737 -10.515 4.961) 13.438 8.022 ( -0.062 0.722 -10.890) 10.914 8.285 ( 11.004 -5.895 5.207) 13.526 8.423 ( -3.501 5.868 1.039) 6.912 8.888 ( 8.522 -7.902 -6.685) 13.407 9.467 ( 9.895 -8.642 10.336) 16.716 9.687 ( 9.170 -2.897 -19.334) 21.593 9.791 ( 2.517 7.427 -4.472) 9.028 10.094 ( -6.711 -9.030 -8.384) 14.031 10.399 ( -5.221 6.323 6.773) 10.635 11.100 ( -0.646 2.212 11.967) 12.187 11.223 ( 0.361 0.677 -6.901) 6.944 11.660 ( -3.212 -0.625 -2.104) 3.891 11.751 ( 2.183 3.140 -2.417) 4.524 12.241 ( -5.270 0.863 2.942) 6.096 15.835 ( 10.764 2.167 -10.693) 15.326 16.486 ( -6.163 -1.720 0.614) 6.428 16.654 ( -7.411 1.506 0.854) 7.610 17.505 ( 7.263 -1.906 -6.428) 9.884 17.604 ( 6.470 3.437 -4.946) 8.840 18.651 ( 19.880 10.133 -5.269) 22.927 23.352 ( -11.305 4.549 -2.076) 12.361 23.629 ( -8.402 -9.613 11.807) 17.390 23.912 ( -3.418 -4.830 4.605) 7.498 24.341 ( 10.299 6.136 -1.521) 12.084 24.914 ( 0.282 8.679 -8.817) 12.375 25.125 ( -1.618 2.380 -1.320) 3.166 25.375 ( -14.416 -7.408 6.297) 17.388 25.815 ( -14.542 -1.415 2.687) 14.856 26.595 ( 18.698 5.678 0.063) 19.541 27.109 ( 17.681 -21.287 -10.703) 29.670 28.157 ( 9.381 15.462 6.679) 19.279 28.768 ( -5.414 -6.014 -3.031) 8.641 29.067 ( -10.348 6.973 3.949) 13.088 29.140 ( 6.411 11.015 -3.875) 13.321 29.560 ( -6.663 -3.411 -1.164) 7.575 30.437 ( 4.692 -2.724 3.669) 6.549 30.524 ( -5.814 -2.917 -2.230) 6.876 30.792 ( -0.106 -5.994 -2.214) 6.390 39.379 ( 16.379 6.620 3.157) 17.946 40.200 ( 16.443 16.987 -17.517) 29.424 41.081 ( 8.013 0.890 14.126) 16.265 41.776 ( 2.265 24.905 -6.867) 25.934 42.068 ( -8.267 -25.039 0.742) 26.379 42.297 ( 4.263 -4.184 -12.378) 13.744 42.949 ( -7.597 -0.382 -1.017) 7.674 43.428 ( -10.404 -17.204 4.399) 20.581 44.631 ( -18.350 3.600 13.454) 23.037 45.220 ( 9.104 0.621 0.755) 9.157 48.038 ( 0.231 -0.001 -0.871) 0.901 48.280 ( 0.042 -0.257 -0.332) 0.422 ======================= Grid point 119 (60/125) ======================= q-point: ( 0.22 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.449 ( -13.454 6.700 30.629) 34.119 3.952 ( 1.739 -0.871 22.208) 22.293 4.504 ( 20.187 -3.982 -7.374) 21.858 5.048 ( 14.824 -19.292 -6.965) 25.307 5.975 ( -0.825 7.944 7.800) 11.164 6.229 ( -3.631 13.967 18.194) 23.222 6.777 ( -7.023 -13.870 -4.397) 16.157 7.059 ( 3.166 -8.566 -16.705) 19.039 7.266 ( -6.262 -0.809 -2.773) 6.896 7.719 ( 11.508 6.898 -6.466) 14.894 7.871 ( 6.606 1.134 1.703) 6.916 7.988 ( 4.141 -7.030 -5.339) 9.751 8.376 ( -1.699 3.371 6.352) 7.390 8.597 ( -6.100 -0.669 -1.020) 6.221 9.152 ( -8.247 1.833 1.197) 8.533 9.332 ( 10.539 -1.944 1.668) 10.845 9.892 ( 2.862 -7.642 -0.462) 8.173 10.205 ( 0.366 4.895 -2.219) 5.386 10.544 ( -1.978 2.241 1.203) 3.222 10.788 ( -4.564 5.650 -6.284) 9.605 11.310 ( 2.246 2.361 -4.968) 5.941 11.686 ( -12.757 -4.807 1.469) 13.711 11.872 ( -0.116 -4.767 4.945) 6.870 12.081 ( 1.650 7.875 -0.903) 8.097 15.406 ( -6.686 2.020 -9.025) 11.412 16.461 ( 0.079 5.978 4.532) 7.502 16.742 ( -11.376 5.380 2.936) 12.922 16.945 ( -0.896 -5.162 -7.774) 9.375 17.384 ( -2.868 7.652 -7.332) 10.979 18.186 ( -6.658 3.786 -19.003) 20.489 23.470 ( -5.744 -6.090 4.088) 9.316 23.914 ( -0.341 3.539 1.797) 3.983 24.167 ( 10.722 -4.433 9.120) 14.758 24.299 ( 1.704 -10.351 -6.824) 12.514 24.838 ( -7.663 2.583 3.426) 8.783 25.213 ( -2.171 -0.196 4.683) 5.166 25.429 ( 2.797 10.149 3.246) 11.016 25.687 ( -5.408 7.259 3.299) 9.634 26.591 ( 15.374 -5.153 -7.496) 17.864 27.022 ( 10.281 -5.222 -0.645) 11.550 28.156 ( -12.257 -2.095 -5.892) 13.760 28.510 ( -7.919 0.937 -7.874) 11.206 29.161 ( 2.799 -2.205 3.974) 5.338 29.356 ( -2.237 -2.730 3.844) 5.218 29.623 ( 3.602 5.577 1.702) 6.854 30.353 ( 3.914 -2.508 4.196) 6.263 30.554 ( -1.335 1.606 1.632) 2.650 30.803 ( 0.100 2.858 -0.710) 2.947 39.219 ( -1.965 -11.531 -12.284) 16.963 40.207 ( -15.824 -16.478 -21.014) 31.040 40.592 ( 9.520 13.959 -0.889) 16.920 40.799 ( -7.719 21.506 -14.416) 27.017 42.057 ( -6.771 9.643 -2.347) 12.014 42.735 ( -2.437 -18.911 15.129) 24.340 43.248 ( 8.494 2.373 8.349) 12.144 43.675 ( 9.642 -6.958 12.284) 17.097 44.996 ( -5.110 6.950 10.051) 13.245 45.282 ( 8.582 -3.333 -8.318) 12.408 47.968 ( -1.228 1.002 -1.210) 1.994 48.277 ( -0.025 0.142 0.212) 0.256 ======================= Grid point 120 (61/125) ======================= q-point: ( 0.33 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.661 ( -9.218 0.394 27.370) 28.883 4.349 ( 10.930 7.691 18.515) 22.834 4.699 ( 17.981 -1.310 -1.931) 18.131 4.882 ( 4.298 -22.559 -7.550) 24.174 6.164 ( 3.370 8.200 5.648) 10.512 6.384 ( -8.106 -4.303 -3.840) 9.948 6.502 ( -10.479 -7.835 5.831) 14.325 6.769 ( 0.975 -2.205 -15.784) 15.967 7.281 ( 3.014 3.077 -2.440) 4.951 7.581 ( -5.963 -16.300 -3.083) 17.628 7.920 ( -5.437 4.141 -1.169) 6.934 8.087 ( 13.915 0.814 -0.126) 13.939 8.411 ( -3.156 11.874 1.947) 12.440 8.753 ( 9.513 3.686 11.106) 15.080 9.014 ( -7.326 -3.608 -1.846) 8.372 9.517 ( 8.688 -0.045 3.492) 9.363 9.852 ( 0.212 -6.648 0.936) 6.717 10.234 ( 0.910 9.516 -3.968) 10.350 10.523 ( -0.090 1.926 -4.896) 5.262 10.697 ( -5.693 0.016 -0.570) 5.722 11.287 ( 4.175 0.709 -8.733) 9.706 11.412 ( -15.159 -8.277 -0.507) 17.279 11.901 ( 0.060 -2.811 3.696) 4.644 12.211 ( 3.209 9.499 2.707) 10.385 15.233 ( -5.460 2.667 -7.485) 9.641 16.515 ( -4.274 0.011 -1.752) 4.619 16.662 ( -1.789 2.454 2.353) 3.842 16.876 ( -2.859 3.855 0.634) 4.841 17.372 ( 1.118 8.986 -3.867) 9.846 17.942 ( -4.483 7.652 -15.933) 18.235 23.393 ( -3.212 -7.776 3.683) 9.184 23.862 ( -4.420 -3.834 -1.318) 5.997 24.121 ( -0.498 -11.804 -5.201) 12.909 24.372 ( 6.063 -6.124 6.504) 10.797 24.846 ( -2.250 4.732 3.963) 6.569 25.219 ( -1.849 -1.961 2.688) 3.807 25.608 ( 4.358 13.096 1.216) 13.855 25.791 ( 0.759 12.015 5.269) 13.141 26.656 ( 4.871 -0.459 -1.512) 5.120 27.145 ( 16.889 -4.303 -4.448) 17.987 27.885 ( -13.918 -2.952 -3.626) 14.682 28.262 ( -8.849 -3.145 -11.402) 14.772 29.196 ( 1.075 -5.006 2.020) 5.504 29.365 ( 0.243 -4.676 4.522) 6.509 29.735 ( -0.380 4.605 6.013) 7.583 30.489 ( 9.797 0.922 2.576) 10.172 30.576 ( -1.285 2.881 1.808) 3.636 30.774 ( -4.242 2.973 -3.187) 6.082 38.966 ( -1.181 -11.347 -10.368) 15.416 39.682 ( -9.397 -13.711 -15.521) 22.742 40.644 ( -8.467 18.472 -8.073) 21.865 40.875 ( 9.319 23.700 -11.399) 27.901 42.026 ( -3.207 6.085 -1.394) 7.018 42.729 ( -0.690 -23.012 16.728) 28.458 43.425 ( 4.200 -3.238 6.210) 8.166 43.819 ( 1.120 -8.053 10.350) 13.162 45.109 ( 1.261 4.883 0.658) 5.086 45.301 ( 3.951 3.811 -0.581) 5.520 47.948 ( -0.901 0.840 -0.824) 1.482 48.280 ( -0.092 0.246 0.092) 0.278 ======================= Grid point 121 (62/125) ======================= q-point: ( 0.44 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.850 ( -3.819 -1.301 19.532) 19.944 4.503 ( -4.473 -8.891 -1.767) 10.108 4.838 ( 9.463 -9.709 3.196) 13.930 4.966 ( 10.423 5.770 9.921) 15.504 6.033 ( -2.033 -20.838 -10.280) 23.325 6.254 ( -5.140 -10.690 -3.668) 12.416 6.382 ( 0.384 13.424 -0.502) 13.439 6.675 ( -8.030 10.528 -10.746) 17.053 7.243 ( 0.272 -1.504 -1.999) 2.517 7.511 ( 3.458 -12.179 10.482) 16.437 7.813 ( -7.358 2.129 -3.769) 8.537 8.232 ( 0.696 8.548 3.340) 9.204 8.615 ( 7.917 4.868 7.588) 11.998 8.848 ( -3.954 -3.338 -4.497) 6.856 9.004 ( 3.965 1.836 6.782) 8.067 9.605 ( 0.955 1.279 0.287) 1.622 9.798 ( -4.731 -5.381 0.605) 7.191 10.285 ( 3.653 5.019 -4.875) 7.893 10.515 ( 6.501 3.608 -3.012) 8.022 10.628 ( -5.482 0.308 2.330) 5.965 11.189 ( -8.026 -5.907 0.917) 10.007 11.247 ( 6.231 -1.916 -7.540) 9.967 11.906 ( -1.249 -1.716 1.427) 2.557 12.347 ( 1.474 7.695 1.621) 8.001 15.149 ( 0.064 3.814 -4.048) 5.562 16.394 ( -2.792 -3.488 -1.740) 4.795 16.749 ( 2.667 3.916 1.790) 5.065 16.910 ( -0.373 4.947 2.464) 5.539 17.441 ( 1.595 7.701 -0.573) 7.885 17.810 ( -1.662 11.337 -12.055) 16.632 23.360 ( 1.459 -9.104 4.883) 10.433 23.760 ( -2.110 -4.225 -0.940) 4.816 23.973 ( -0.506 -8.476 -3.954) 9.367 24.413 ( -1.083 -7.810 4.938) 9.304 24.905 ( 1.091 2.564 1.422) 3.129 25.201 ( -1.096 -0.553 -0.534) 1.339 25.770 ( 2.800 10.604 0.963) 11.010 25.959 ( 0.690 9.835 3.405) 10.430 26.707 ( -2.894 10.143 1.671) 10.680 27.263 ( 9.402 -7.584 -1.568) 12.181 27.676 ( -3.828 -6.047 -5.776) 9.197 27.997 ( -4.128 -1.055 -9.158) 10.100 29.172 ( -1.007 -4.476 0.762) 4.651 29.386 ( 1.702 -5.994 3.970) 7.389 29.814 ( -2.311 2.895 4.779) 6.047 30.602 ( 0.459 2.407 0.564) 2.514 30.656 ( -4.344 2.146 -3.675) 6.081 30.687 ( 5.727 2.501 2.376) 6.686 38.777 ( 0.607 -7.641 -6.988) 10.372 39.377 ( -0.718 -7.884 -9.115) 12.073 40.590 ( -5.404 20.915 -10.719) 24.115 41.051 ( 5.847 24.606 -9.668) 27.076 42.037 ( 1.825 0.054 0.626) 1.930 42.732 ( -0.039 -24.759 16.226) 29.602 43.476 ( 1.036 -7.627 5.178) 9.276 43.848 ( -3.728 -5.551 7.421) 9.989 45.102 ( 0.453 -0.266 -4.286) 4.318 45.411 ( 0.204 9.031 0.915) 9.080 47.941 ( -0.023 0.642 0.006) 0.642 48.281 ( -0.004 0.253 -0.023) 0.254 ======================= Grid point 122 (63/125) ======================= q-point: (-0.44 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.967 ( 1.232 -6.648 7.902) 10.400 4.316 ( -14.468 -2.659 3.753) 15.181 4.833 ( -9.189 -11.917 8.282) 17.176 5.116 ( 4.356 -9.500 -6.157) 12.130 5.790 ( 5.652 -9.314 -9.125) 14.211 6.140 ( 2.198 -0.360 -3.567) 4.205 6.451 ( -7.037 11.937 -9.227) 16.648 6.591 ( 6.433 8.692 2.602) 11.123 7.231 ( -8.101 5.140 1.774) 9.757 7.614 ( 2.967 -7.432 11.448) 13.968 7.716 ( -0.212 -3.904 -1.082) 4.057 8.310 ( -2.902 6.378 0.064) 7.007 8.671 ( -9.596 0.512 2.983) 10.062 8.841 ( 6.949 -8.871 5.803) 12.675 9.074 ( 0.119 1.972 -2.199) 2.956 9.623 ( -2.492 0.970 -1.539) 3.085 9.650 ( 0.536 -5.093 -4.874) 7.070 10.292 ( 2.988 1.636 -2.822) 4.423 10.602 ( -3.276 4.168 1.692) 5.565 10.688 ( 7.657 4.926 1.250) 9.190 11.103 ( -2.034 -1.346 2.240) 3.312 11.309 ( 11.844 -1.588 -0.098) 11.951 11.868 ( -2.372 -1.593 -1.321) 3.148 12.396 ( -1.597 3.651 -1.055) 4.122 15.204 ( 6.775 4.886 -1.008) 8.413 16.385 ( 1.770 -0.281 4.079) 4.455 16.802 ( 2.625 0.342 -2.566) 3.687 17.001 ( 4.140 2.955 2.635) 5.728 17.504 ( 0.124 5.480 -0.064) 5.482 17.791 ( 1.447 13.477 -7.811) 15.644 23.410 ( 6.076 -9.557 7.347) 13.499 23.731 ( 1.068 -0.984 0.853) 1.684 23.885 ( 0.939 -3.783 -3.046) 4.947 24.351 ( -5.932 -7.209 3.719) 10.050 24.949 ( 2.111 1.680 -0.623) 2.769 25.163 ( -1.022 -0.185 -3.043) 3.216 25.867 ( 1.735 4.374 -0.651) 4.751 26.026 ( -4.064 5.997 2.281) 7.594 26.724 ( -11.193 9.697 0.159) 14.810 27.295 ( 0.845 -6.487 7.889) 10.249 27.429 ( -2.836 -7.311 -14.185) 16.208 28.056 ( 15.249 7.440 -2.663) 17.175 29.122 ( -2.515 -2.472 -0.090) 3.527 29.409 ( 1.086 -6.134 4.569) 7.725 29.832 ( -0.603 1.101 -0.310) 1.293 30.487 ( -9.167 1.236 -6.181) 11.125 30.635 ( 0.415 0.755 1.223) 1.496 30.847 ( 5.452 1.437 3.701) 6.744 38.712 ( 3.409 -1.922 -1.739) 4.282 39.314 ( 7.832 -0.702 -4.234) 8.931 40.583 ( -2.066 19.622 -8.983) 21.679 41.217 ( 4.640 26.657 -9.103) 28.548 42.084 ( 5.503 -6.264 2.340) 8.660 42.691 ( -2.352 -24.999 12.757) 28.164 43.479 ( 0.303 -8.622 4.833) 9.888 43.810 ( -6.099 -5.085 5.417) 9.613 45.054 ( -2.716 1.390 -0.923) 3.187 45.417 ( -3.909 5.419 -6.040) 9.007 47.959 ( 0.971 0.538 0.876) 1.414 48.283 ( 0.127 0.171 -0.138) 0.254 ======================= Grid point 123 (64/125) ======================= q-point: (-0.33 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.968 ( 5.977 -12.047 -3.455) 13.885 4.171 ( -19.415 4.907 11.362) 23.024 4.606 ( -20.925 -13.673 8.917) 26.539 4.838 ( 1.678 -21.118 -18.292) 27.988 5.819 ( 6.510 4.568 -9.144) 12.118 6.123 ( 2.609 1.724 -2.372) 3.925 6.411 ( -8.999 14.088 4.476) 17.306 6.867 ( 14.601 7.496 3.221) 16.726 7.115 ( -19.692 12.930 2.222) 23.662 7.695 ( 8.660 -8.271 -1.351) 12.052 7.748 ( 3.661 -9.244 10.305) 14.319 8.237 ( -6.594 -0.101 -3.809) 7.615 8.599 ( -10.011 5.776 3.635) 12.116 8.926 ( 4.995 -7.073 4.343) 9.687 8.998 ( -0.896 -8.752 -0.678) 8.824 9.520 ( 5.025 -9.651 -4.808) 11.896 9.652 ( 5.372 4.944 -10.318) 12.640 10.358 ( 2.807 5.725 0.943) 6.446 10.572 ( -8.772 1.608 1.611) 9.063 10.814 ( 6.509 2.682 1.718) 7.247 11.169 ( -0.017 6.078 5.264) 8.041 11.511 ( 13.852 0.095 0.452) 13.860 11.796 ( -2.018 -2.144 -1.459) 3.286 12.348 ( -3.233 -0.338 -2.399) 4.040 15.367 ( 10.626 5.231 -0.428) 11.852 16.515 ( 2.911 2.935 8.676) 9.611 16.765 ( 1.521 -3.132 -6.112) 7.034 17.120 ( 7.683 -0.673 1.378) 7.835 17.535 ( -0.435 4.066 -0.523) 4.122 17.897 ( 6.931 15.248 -2.939) 17.006 23.531 ( 7.422 -10.816 9.139) 15.988 23.767 ( -0.652 3.357 0.641) 3.480 23.873 ( 3.774 1.840 -1.814) 4.574 24.236 ( -8.029 -6.273 3.623) 10.814 24.958 ( 0.446 3.240 -6.283) 7.084 25.118 ( 0.504 -0.698 -1.133) 1.423 25.857 ( -1.816 -3.010 -2.372) 4.240 26.048 ( -1.444 3.796 3.443) 5.324 26.539 ( -16.000 -1.612 -2.258) 16.239 27.096 ( -5.708 -12.315 -6.834) 15.197 27.543 ( 8.455 13.561 5.922) 17.042 28.350 ( 18.781 8.978 -2.011) 20.913 29.063 ( -3.031 -0.502 -1.031) 3.240 29.416 ( -2.651 -3.743 4.718) 6.580 29.823 ( 1.525 -1.475 -2.113) 2.994 30.298 ( -6.302 -0.572 -6.284) 8.918 30.644 ( -0.299 -1.042 -0.004) 1.084 30.933 ( -0.110 -0.590 3.599) 3.649 38.795 ( 6.492 3.501 2.578) 7.814 39.469 ( 14.773 7.849 -2.518) 16.917 40.648 ( 1.569 15.906 -2.925) 16.249 41.404 ( 5.886 27.248 -8.241) 29.069 42.131 ( 6.741 -10.458 1.786) 12.570 42.558 ( -5.976 -23.681 7.918) 25.675 43.430 ( -3.658 -7.073 -0.557) 7.982 43.742 ( -5.912 -8.973 7.731) 13.238 45.041 ( -4.624 3.657 4.323) 7.310 45.259 ( -6.661 1.491 -11.172) 13.093 47.992 ( 1.361 0.359 1.037) 1.748 48.284 ( 0.114 0.011 -0.252) 0.277 ======================= Grid point 124 (65/125) ======================= q-point: (-0.22 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.852 ( 5.662 -15.646 -10.605) 19.731 4.122 ( -23.094 9.634 16.517) 29.982 4.313 ( -8.697 -16.119 1.423) 18.371 4.538 ( 2.252 -10.724 -11.318) 15.753 5.624 ( -22.113 -3.707 1.099) 22.449 6.309 ( 14.450 11.645 -2.638) 18.745 6.471 ( -5.361 9.942 5.851) 12.721 6.959 ( -11.064 15.005 -2.865) 18.861 7.174 ( 5.892 5.325 6.042) 9.979 7.762 ( 14.152 -9.850 -1.753) 17.332 7.810 ( -1.026 -8.843 6.425) 10.979 8.095 ( -4.733 0.650 -2.194) 5.257 8.562 ( -6.584 1.873 3.234) 7.571 8.809 ( -1.085 -6.157 -7.186) 9.525 9.120 ( 11.082 -7.022 9.320) 16.093 9.430 ( 7.776 -12.856 -12.359) 19.455 9.676 ( 4.957 9.111 -5.425) 11.705 10.367 ( -9.050 0.228 -3.133) 9.580 10.518 ( -2.634 2.029 7.186) 7.917 10.973 ( 7.743 5.538 1.084) 9.581 11.272 ( -2.829 5.235 6.473) 8.793 11.580 ( 3.984 -1.059 -7.715) 8.747 11.800 ( 1.413 0.895 0.776) 1.843 12.288 ( -0.313 -2.336 0.362) 2.384 15.541 ( 9.826 4.657 -2.324) 11.119 16.613 ( -2.681 -2.652 -1.506) 4.061 16.724 ( 1.671 2.775 3.822) 5.010 17.227 ( 9.909 -4.709 -0.680) 10.992 17.552 ( -0.524 4.847 -1.372) 5.065 18.159 ( 13.254 15.763 0.846) 20.612 23.573 ( -0.556 -8.414 -0.117) 8.433 23.798 ( -2.268 2.694 6.870) 7.720 23.955 ( 1.196 4.002 0.463) 4.202 24.147 ( -1.858 -4.670 3.542) 6.149 24.870 ( 0.971 4.001 -11.860) 12.554 25.148 ( 1.010 2.558 1.447) 3.107 25.721 ( -7.890 -8.387 -0.378) 11.521 26.160 ( 11.382 -1.745 2.667) 11.819 26.267 ( -16.369 -1.002 -1.165) 16.441 26.878 ( -3.644 -9.124 -4.927) 10.991 27.870 ( 10.659 15.011 5.377) 19.179 28.625 ( 13.576 6.981 -3.457) 15.652 29.023 ( -0.639 2.147 -0.540) 2.304 29.381 ( -7.288 0.930 3.099) 7.974 29.770 ( -5.330 -3.753 -0.268) 6.524 30.212 ( 6.035 -2.386 -3.915) 7.579 30.606 ( -1.651 -2.664 -1.446) 3.452 30.917 ( -5.321 -2.777 2.640) 6.557 39.001 ( 9.884 7.497 4.906) 13.340 39.736 ( 16.127 16.062 -8.577) 24.323 40.841 ( 6.898 8.920 9.398) 14.679 41.626 ( 7.311 26.368 -6.584) 28.144 42.128 ( 6.062 -11.679 -3.147) 13.530 42.333 ( -9.530 -21.007 3.175) 23.285 43.240 ( -9.817 -4.855 -5.564) 12.284 43.667 ( -6.698 -14.374 8.390) 17.940 45.047 ( -6.022 0.599 -8.200) 10.192 45.085 ( -3.729 3.509 7.256) 8.881 48.020 ( 0.942 0.103 0.396) 1.027 48.280 ( -0.030 -0.185 -0.282) 0.338 ======================= Grid point 125 (66/125) ======================= q-point: (-0.11 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.613 ( -18.232 -3.240 -1.542) 18.581 4.014 ( -10.226 -5.802 3.880) 12.381 4.210 ( 20.803 -20.135 -6.420) 29.654 4.482 ( -4.890 3.633 4.187) 7.392 5.362 ( -27.753 3.660 20.651) 34.786 6.425 ( -1.579 2.741 -2.301) 3.911 6.681 ( 15.165 14.392 -0.537) 20.914 6.924 ( -2.739 10.615 -4.994) 12.047 7.307 ( 4.508 0.124 2.529) 5.170 7.663 ( -12.969 -9.979 3.058) 16.647 7.856 ( 8.920 0.159 -5.669) 10.570 8.167 ( 7.853 -0.189 3.583) 8.634 8.454 ( -0.210 -13.316 -4.222) 13.971 8.748 ( -3.152 8.701 0.487) 9.267 9.251 ( 5.848 -13.366 -13.686) 20.004 9.342 ( 13.621 -4.720 4.034) 14.969 9.792 ( 4.851 6.502 0.920) 8.165 10.153 ( -12.958 -0.544 -2.667) 13.241 10.585 ( -3.524 1.546 6.132) 7.240 11.110 ( 5.742 6.411 -3.794) 9.405 11.282 ( -6.762 -4.137 5.352) 9.565 11.577 ( 7.394 3.505 -4.561) 9.368 11.777 ( -3.992 2.470 -2.508) 5.322 12.304 ( 0.407 -1.885 2.406) 3.083 15.643 ( 5.844 3.630 -4.804) 8.391 16.487 ( -2.553 -4.715 -4.707) 7.134 16.823 ( -5.138 6.877 7.222) 11.218 17.291 ( 8.937 -6.782 -3.935) 11.889 17.563 ( -0.690 5.746 -2.909) 6.477 18.475 ( 12.719 12.880 -1.229) 18.143 23.456 ( -4.360 0.506 -3.519) 5.626 23.822 ( -10.950 -6.963 8.403) 15.459 23.933 ( 1.068 -2.988 1.738) 3.618 24.243 ( 7.769 4.580 1.280) 9.109 24.826 ( 4.295 8.843 -10.085) 14.084 25.195 ( -1.144 3.458 2.015) 4.163 25.522 ( -9.397 -10.288 1.510) 14.015 26.046 ( -14.888 -0.972 2.384) 15.109 26.396 ( 20.975 -5.751 1.445) 21.797 26.717 ( -2.479 -4.863 -5.023) 7.418 28.180 ( 11.111 11.601 2.327) 16.231 28.701 ( 1.613 -1.359 -4.476) 4.947 29.114 ( 6.374 8.283 0.386) 10.459 29.307 ( -10.167 4.605 2.068) 11.351 29.628 ( -8.751 -3.703 0.016) 9.502 30.308 ( 11.543 -2.813 -0.488) 11.891 30.537 ( -2.359 -3.492 0.280) 4.224 30.815 ( -7.651 -4.223 1.020) 8.798 39.292 ( 11.847 9.500 5.492) 16.148 39.921 ( 12.797 18.751 -18.078) 29.020 41.157 ( 6.106 -1.996 16.565) 17.767 41.864 ( 5.111 21.229 -2.305) 21.957 41.971 ( -4.889 -25.802 -4.488) 26.642 42.112 ( -0.566 6.617 -8.470) 10.763 43.021 ( -7.227 -4.361 -1.279) 8.537 43.497 ( -10.424 -16.613 5.300) 20.316 44.946 ( -2.189 0.441 -0.006) 2.233 45.153 ( -1.689 1.567 6.628) 7.017 48.027 ( 0.082 0.066 -0.499) 0.510 48.274 ( -0.076 -0.311 -0.132) 0.346 ======================= Grid point 128 (67/125) ======================= q-point: ( 0.22 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.642 ( 36.553 -4.847 -9.323) 38.033 4.072 ( -17.972 10.427 23.379) 31.278 4.344 ( 20.041 -12.929 0.652) 23.858 4.705 ( -6.578 -12.809 5.908) 15.564 5.856 ( 24.436 -6.672 4.578) 25.741 6.430 ( 9.940 3.821 -4.244) 11.464 6.693 ( -12.344 -10.370 -9.512) 18.719 6.949 ( -9.305 6.985 -5.103) 12.705 7.376 ( -9.105 0.844 -0.269) 9.148 7.473 ( 11.859 12.979 -8.173) 19.388 7.655 ( 11.762 -16.813 5.324) 21.198 8.129 ( -6.291 9.287 6.705) 13.068 8.482 ( -5.321 -2.495 2.849) 6.531 8.696 ( -2.986 4.309 3.335) 6.213 9.115 ( -2.713 -8.626 -4.221) 9.980 9.496 ( -6.178 6.872 13.878) 16.672 9.829 ( 0.382 1.282 0.195) 1.352 10.188 ( 1.415 2.657 -3.153) 4.359 10.569 ( -1.797 -3.818 0.198) 4.224 10.763 ( 1.067 5.332 -10.976) 12.249 11.296 ( -4.435 1.393 -1.425) 4.862 11.823 ( -9.372 -4.057 0.923) 10.254 11.870 ( 2.826 -5.039 5.056) 7.678 12.098 ( 2.600 7.900 -3.271) 8.937 15.504 ( -12.876 5.349 -3.635) 14.408 16.545 ( 1.678 4.540 2.426) 5.414 16.785 ( -3.193 -6.506 -3.221) 7.931 17.063 ( -10.831 8.044 4.129) 14.109 17.444 ( -6.387 6.710 -4.345) 10.232 18.152 ( -11.361 6.310 -14.270) 19.301 23.502 ( -2.479 -7.084 -0.063) 7.505 23.936 ( 2.831 0.522 1.785) 3.387 24.047 ( 15.467 -4.981 8.308) 18.250 24.180 ( -6.432 -7.220 -4.970) 10.872 24.976 ( -5.098 5.263 -2.225) 7.658 25.264 ( 0.372 -2.983 3.054) 4.285 25.512 ( 3.178 7.370 3.352) 8.698 25.805 ( -1.494 6.432 -2.186) 6.956 26.337 ( 8.687 1.261 1.550) 8.914 26.890 ( 2.580 -7.561 1.775) 8.184 28.125 ( -5.794 -5.673 -9.207) 12.269 28.662 ( -11.821 7.470 -1.960) 14.120 29.134 ( 1.403 -3.150 -0.915) 3.568 29.395 ( -1.590 -4.882 4.130) 6.589 29.553 ( 11.321 6.999 -2.534) 13.549 30.352 ( -0.004 -2.710 2.257) 3.527 30.647 ( -3.697 3.443 4.165) 6.548 30.792 ( 2.864 -0.958 2.024) 3.635 39.089 ( -7.411 -5.920 -8.931) 13.028 40.080 ( -18.156 -11.557 -21.369) 30.329 40.583 ( 9.668 24.536 -1.878) 26.439 41.013 ( -16.257 13.675 -4.176) 21.650 42.139 ( -4.244 2.112 -5.183) 7.024 42.774 ( -1.806 -20.136 12.489) 23.763 43.221 ( 9.455 1.128 6.742) 11.667 43.657 ( 10.183 -2.950 15.117) 18.464 44.988 ( 11.568 -4.766 -10.206) 16.146 45.192 ( -0.880 4.398 6.619) 7.995 47.988 ( -1.753 1.003 -0.483) 2.077 48.283 ( -0.092 0.151 0.334) 0.378 ======================= Grid point 129 (68/125) ======================= q-point: ( 0.33 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.003 ( 18.503 -1.611 4.218) 19.046 4.203 ( 3.003 0.332 12.161) 12.531 4.440 ( 16.232 -25.238 -8.633) 31.224 4.701 ( 0.720 9.104 12.857) 15.770 6.117 ( 2.600 -1.293 -6.399) 7.027 6.308 ( 0.217 -10.322 -4.115) 11.114 6.588 ( 5.724 -0.399 -5.082) 7.665 6.760 ( -13.820 2.779 1.801) 14.211 7.298 ( -4.290 6.602 -3.099) 8.461 7.470 ( -1.403 -5.223 -4.822) 7.246 7.845 ( 17.344 -7.255 6.373) 19.851 8.129 ( -10.515 4.136 4.583) 12.193 8.562 ( 3.418 13.975 1.034) 14.424 8.781 ( 3.153 -1.065 9.597) 10.157 8.941 ( -0.315 -11.843 -5.790) 13.187 9.599 ( -4.839 0.614 10.236) 11.339 9.851 ( -0.609 1.997 1.788) 2.749 10.206 ( 1.989 6.562 -6.531) 9.470 10.503 ( -1.647 1.995 -2.354) 3.497 10.716 ( 0.915 0.750 -5.107) 5.242 11.206 ( -4.523 0.976 -3.832) 6.007 11.559 ( -15.626 -8.911 -0.835) 18.008 11.907 ( 1.210 -2.445 1.856) 3.299 12.248 ( 5.752 8.760 1.470) 10.582 15.319 ( -11.512 4.772 -4.028) 13.097 16.508 ( -3.771 -5.336 -3.935) 7.628 16.755 ( -2.279 4.733 4.801) 7.117 17.036 ( -8.065 5.572 3.319) 10.349 17.404 ( -0.929 8.018 -2.648) 8.495 17.929 ( -7.180 8.811 -11.125) 15.904 23.406 ( -3.018 -7.635 1.305) 8.312 23.910 ( -7.503 -4.192 1.382) 8.705 23.998 ( -0.683 -6.935 -3.554) 7.823 24.295 ( 10.024 -6.604 7.891) 14.366 24.916 ( -2.336 3.596 -4.355) 6.111 25.239 ( -1.639 -3.778 0.484) 4.147 25.685 ( 3.312 11.611 3.483) 12.566 25.886 ( 3.337 9.627 0.542) 10.203 26.534 ( 13.715 3.398 1.515) 14.211 26.904 ( 6.790 -4.595 -0.951) 8.254 27.864 ( -7.403 -9.531 -8.267) 14.628 28.435 ( -20.188 5.573 -3.558) 21.243 29.136 ( 3.496 -4.907 -0.470) 6.043 29.371 ( -1.154 -5.439 2.961) 6.299 29.776 ( 8.545 6.731 2.520) 11.166 30.375 ( 5.892 -0.876 -1.559) 6.157 30.688 ( -3.077 3.626 5.304) 7.124 30.799 ( -1.952 -0.401 -0.747) 2.128 38.859 ( -6.385 -5.230 -5.092) 9.698 39.559 ( -12.035 -8.085 -15.620) 21.312 40.855 ( -1.776 27.840 -11.965) 30.354 40.883 ( -5.595 16.059 2.284) 17.158 42.036 ( -1.335 -1.022 -5.613) 5.860 42.730 ( -0.220 -23.571 13.579) 27.203 43.385 ( 5.668 -4.144 4.221) 8.193 43.873 ( 2.295 -6.508 12.870) 14.604 44.977 ( 8.542 -1.817 -8.628) 12.276 45.350 ( 3.324 8.191 4.601) 9.965 47.966 ( -1.595 0.700 -0.162) 1.749 48.285 ( -0.183 0.201 0.080) 0.283 ======================= Grid point 130 (69/125) ======================= q-point: ( 0.44 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.088 ( -8.959 -10.865 10.464) 17.544 4.387 ( 8.462 -9.402 -0.883) 12.680 4.523 ( 27.229 -3.407 0.872) 27.455 4.952 ( 6.906 4.865 1.833) 8.644 5.882 ( -6.016 -7.978 -4.856) 11.109 6.246 ( -7.722 -10.020 -1.754) 12.771 6.388 ( -4.713 8.293 -11.343) 14.820 6.779 ( -4.140 6.636 -3.153) 8.433 7.246 ( -0.755 4.597 -1.475) 4.887 7.484 ( 4.613 -9.682 12.574) 16.527 7.919 ( -6.373 -2.266 0.304) 6.771 8.241 ( 10.174 5.739 6.313) 13.278 8.647 ( -0.408 -3.496 -1.543) 3.843 8.794 ( 0.154 3.965 -3.584) 5.347 9.000 ( 7.855 -3.483 6.674) 10.880 9.614 ( -1.618 -1.951 1.777) 3.096 9.873 ( -4.391 -0.823 4.008) 6.002 10.161 ( 3.564 0.854 -10.197) 10.836 10.518 ( -2.091 9.178 0.439) 9.423 10.695 ( 0.152 1.059 0.273) 1.104 11.132 ( -0.365 1.800 -2.673) 3.243 11.306 ( -11.418 -6.682 2.715) 13.505 11.903 ( -0.026 -1.959 -1.214) 2.305 12.382 ( 2.808 5.520 0.412) 6.207 15.195 ( -6.149 4.701 -1.568) 7.897 16.394 ( -2.357 -3.127 0.498) 3.947 16.806 ( -2.838 3.724 2.244) 5.192 17.008 ( -4.594 2.657 2.132) 5.719 17.462 ( 2.282 6.233 -0.860) 6.693 17.830 ( -3.655 12.257 -7.401) 14.777 23.343 ( -1.147 -8.023 4.265) 9.158 23.785 ( -5.388 -3.082 1.014) 6.289 23.917 ( -2.602 -3.900 0.057) 4.689 24.406 ( 2.602 -8.416 6.483) 10.937 24.876 ( 2.279 1.303 -5.484) 6.080 25.191 ( -0.945 -0.968 -2.331) 2.695 25.838 ( 0.852 8.109 2.834) 8.632 26.008 ( 3.829 6.688 -1.231) 7.805 26.791 ( 11.234 9.026 2.071) 14.559 26.983 ( 11.788 -3.727 -3.312) 12.800 27.591 ( -7.752 -7.910 -6.473) 12.828 28.171 ( -18.472 4.670 0.445) 19.058 29.135 ( 2.024 -3.580 -0.394) 4.131 29.351 ( 0.852 -5.672 1.826) 6.019 29.877 ( -0.916 -0.476 0.593) 1.190 30.492 ( 11.938 3.269 -2.361) 12.601 30.707 ( -4.381 2.021 -3.983) 6.257 30.753 ( -3.225 0.152 6.695) 7.433 38.726 ( -4.282 -1.099 0.360) 4.436 39.259 ( -3.890 -1.889 -9.372) 10.322 40.767 ( -11.097 19.933 -6.885) 23.830 41.103 ( 3.552 26.438 -4.737) 27.092 41.965 ( 2.811 -5.557 -3.290) 7.043 42.709 ( 0.906 -24.504 13.933) 28.203 43.430 ( 3.090 -7.673 2.438) 8.624 43.936 ( -2.674 -7.830 8.815) 12.090 45.002 ( 6.482 1.596 -5.165) 8.441 45.463 ( 0.609 6.184 -1.643) 6.427 47.956 ( -0.793 0.466 0.644) 1.123 48.284 ( -0.152 0.174 -0.109) 0.256 ======================= Grid point 131 (70/125) ======================= q-point: (-0.44 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.924 ( -4.423 -19.933 -0.199) 20.418 4.426 ( 1.140 -1.862 2.903) 3.632 4.800 ( 3.576 -9.510 -4.036) 10.933 4.921 ( 7.448 -4.736 -5.541) 10.421 5.743 ( -10.009 0.713 1.965) 10.225 6.060 ( -0.481 2.390 -4.082) 4.755 6.434 ( 10.321 9.269 -1.847) 13.994 6.670 ( -6.649 6.579 -6.633) 11.467 7.288 ( 2.876 2.086 -1.977) 4.066 7.657 ( 3.049 -12.774 18.370) 22.582 7.809 ( -9.049 6.442 -0.514) 11.120 8.404 ( -4.237 -0.125 2.754) 5.055 8.574 ( 11.404 -12.306 -3.477) 17.134 8.862 ( 0.241 4.448 4.595) 6.399 9.057 ( -0.806 -1.256 -1.436) 2.071 9.572 ( -0.940 1.095 -5.163) 5.360 9.723 ( -14.906 -4.617 -0.308) 15.607 10.167 ( 8.795 2.947 -6.234) 11.176 10.625 ( 6.701 3.176 3.032) 8.012 10.741 ( -1.596 4.974 4.416) 6.841 11.143 ( 0.391 -2.097 3.007) 3.687 11.252 ( -0.174 4.814 4.354) 6.493 11.846 ( -1.078 -2.764 -3.479) 4.572 12.412 ( -0.872 1.039 -2.191) 2.577 15.197 ( 0.593 5.269 1.662) 5.557 16.427 ( 2.056 1.076 6.626) 7.020 16.780 ( -2.872 -0.207 -2.018) 3.516 17.012 ( -0.395 0.100 2.367) 2.402 17.519 ( 1.750 3.463 -1.039) 4.017 17.842 ( -1.292 15.178 -3.677) 15.670 23.353 ( 2.974 -8.687 6.356) 11.168 23.760 ( -0.836 0.737 3.966) 4.119 23.870 ( -2.831 0.290 1.042) 3.030 24.401 ( -2.825 -7.436 4.442) 9.111 24.867 ( 5.190 -0.325 -6.204) 8.095 25.138 ( -1.067 -0.048 -3.257) 3.428 25.890 ( -1.988 1.698 0.276) 2.629 26.058 ( 2.232 1.954 -3.392) 4.506 26.848 ( -5.203 -4.486 -5.964) 9.097 27.179 ( 20.332 6.328 -1.317) 21.335 27.400 ( -11.781 2.469 -0.521) 12.048 28.086 ( -4.914 7.635 7.063) 11.504 29.118 ( -0.589 -1.721 -0.995) 2.073 29.353 ( 4.274 -6.774 1.245) 8.106 29.802 ( -1.903 -3.563 -4.619) 6.136 30.559 ( -8.378 0.373 -4.180) 9.370 30.638 ( 3.828 2.286 -0.049) 4.458 30.834 ( 3.823 0.668 5.042) 6.363 38.737 ( -2.041 4.312 6.167) 7.797 39.193 ( 4.394 5.299 -4.775) 8.378 40.722 ( -7.406 17.762 -4.186) 19.694 41.288 ( 2.416 29.016 -8.680) 30.382 41.948 ( 6.024 -11.030 1.156) 12.620 42.669 ( -1.455 -23.551 11.947) 26.448 43.427 ( 2.668 -8.913 1.726) 9.462 43.902 ( -4.711 -8.658 6.175) 11.632 45.053 ( 3.411 4.048 -2.004) 5.660 45.413 ( -3.424 1.941 -8.468) 9.338 47.968 ( 0.204 0.348 1.367) 1.425 48.282 ( -0.030 0.109 -0.181) 0.214 ======================= Grid point 132 (71/125) ======================= q-point: (-0.33 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.644 ( 0.897 -27.163 -9.759) 28.876 4.283 ( -1.769 -20.779 -25.375) 32.845 4.580 ( -6.153 7.655 8.365) 12.900 4.984 ( -11.601 -6.702 11.905) 17.922 5.689 ( 2.097 10.102 -7.935) 13.016 6.132 ( 1.966 8.739 3.085) 9.474 6.563 ( -0.800 0.212 -7.882) 7.926 6.752 ( 17.418 10.109 5.682) 20.926 7.299 ( 2.966 -0.572 -2.797) 4.117 7.675 ( -6.119 5.884 -2.919) 8.977 7.820 ( -7.910 -7.234 16.337) 19.540 8.293 ( -4.001 -6.509 -0.726) 7.674 8.634 ( 6.036 -4.348 0.653) 7.468 8.918 ( -8.043 -4.851 -5.502) 10.885 8.955 ( 0.727 -2.203 7.684) 8.026 9.471 ( -12.514 -4.689 -1.132) 13.411 9.542 ( 2.870 6.875 -5.693) 9.376 10.285 ( 11.088 6.722 -4.268) 13.651 10.669 ( -3.409 -5.274 0.304) 6.288 10.861 ( 0.049 7.302 7.875) 10.739 11.270 ( 8.679 0.222 7.359) 11.381 11.371 ( 2.921 8.781 -0.350) 9.261 11.768 ( -0.413 -4.229 -1.384) 4.469 12.335 ( -2.664 -2.929 -4.180) 5.757 15.321 ( 4.977 6.142 3.724) 8.738 16.604 ( 5.066 3.626 10.045) 11.820 16.683 ( -2.708 -3.292 -4.824) 6.438 17.047 ( 2.554 -2.840 2.493) 4.562 17.550 ( 0.922 2.564 -0.503) 2.770 17.957 ( 2.042 17.889 0.259) 18.007 23.413 ( 6.693 -10.432 3.890) 12.990 23.845 ( -2.147 1.719 6.159) 6.745 23.891 ( 2.348 8.091 2.999) 8.942 24.324 ( -6.462 -5.869 2.846) 9.182 24.831 ( 4.111 -2.654 -10.667) 11.736 25.109 ( 0.480 0.376 0.294) 0.677 25.818 ( -3.113 -4.307 -3.832) 6.552 26.022 ( 1.389 -4.948 -4.806) 7.036 26.618 ( -7.226 -5.959 -5.616) 10.920 27.226 ( -17.198 6.806 -0.077) 18.496 27.531 ( 15.325 11.238 3.819) 19.384 28.288 ( 6.267 10.535 8.786) 15.082 29.063 ( -1.822 -0.532 -3.342) 3.843 29.397 ( 6.958 -7.538 2.522) 10.564 29.702 ( 1.689 -2.901 -6.260) 7.103 30.373 ( -11.145 0.611 -3.787) 11.786 30.654 ( -1.323 -1.703 0.380) 2.190 30.952 ( 3.348 -0.181 3.856) 5.110 38.863 ( -0.227 8.171 8.588) 11.857 39.344 ( 11.029 13.738 -2.507) 17.795 40.762 ( -2.052 13.443 1.874) 13.727 41.444 ( 4.711 28.922 -12.143) 31.720 41.966 ( 5.663 -14.170 4.270) 15.845 42.560 ( -5.993 -20.183 7.976) 22.514 43.387 ( -0.119 -8.781 -0.817) 8.820 43.828 ( -5.018 -11.318 6.978) 14.212 45.067 ( -0.466 0.734 -8.302) 8.347 45.269 ( -3.583 3.059 -3.366) 5.790 47.994 ( 0.707 0.188 1.355) 1.539 48.280 ( 0.008 0.003 -0.156) 0.156 ======================= Grid point 133 (72/125) ======================= q-point: (-0.22 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.336 ( 11.423 -27.761 -15.742) 33.896 3.788 ( 7.619 -24.908 -27.815) 38.107 4.690 ( -20.159 9.794 11.643) 25.256 4.839 ( -14.129 2.536 12.838) 19.258 5.713 ( 1.516 3.450 -3.676) 5.264 6.275 ( 3.624 8.440 -2.027) 9.406 6.460 ( 7.730 -7.552 -8.420) 13.699 7.077 ( 4.101 8.704 2.384) 9.913 7.385 ( 10.105 5.131 4.461) 12.179 7.562 ( -15.035 8.106 -0.429) 17.086 7.818 ( -0.779 -7.973 6.364) 10.231 8.198 ( -5.354 -2.879 1.326) 6.222 8.544 ( -6.361 -10.624 -7.739) 14.602 8.821 ( 0.472 3.031 6.529) 7.214 9.070 ( 4.324 -1.604 6.625) 8.072 9.247 ( -9.368 -3.806 -4.128) 10.922 9.638 ( 5.647 6.880 0.300) 8.906 10.454 ( 5.073 7.989 -1.499) 9.581 10.529 ( -3.906 -9.282 -0.051) 10.070 10.997 ( 0.359 7.428 4.199) 8.541 11.411 ( 4.876 -3.120 -4.439) 7.295 11.440 ( -2.039 8.164 2.876) 8.893 11.777 ( 3.459 -2.411 2.782) 5.051 12.238 ( 1.214 -4.226 -2.824) 5.226 15.493 ( 4.621 6.765 3.994) 9.114 16.548 ( -2.685 -4.736 -5.095) 7.456 16.826 ( 5.981 3.271 7.664) 10.257 17.093 ( 2.429 -3.554 3.946) 5.840 17.581 ( 0.178 3.681 -0.035) 3.685 18.195 ( 6.251 19.363 3.801) 20.699 23.431 ( 5.986 -9.967 -2.558) 11.904 23.882 ( -1.408 4.159 2.287) 4.951 24.098 ( 3.485 8.133 9.280) 12.823 24.182 ( -10.381 -7.316 1.030) 12.742 24.709 ( 3.738 -0.321 -12.786) 13.325 25.160 ( 2.487 0.937 2.297) 3.513 25.678 ( -1.421 -10.109 -3.593) 10.822 25.933 ( 6.945 -11.163 -6.048) 14.471 26.458 ( -11.100 4.086 0.427) 11.836 27.042 ( -16.980 4.819 2.323) 17.803 27.851 ( 11.958 12.075 1.285) 17.043 28.550 ( 6.399 7.218 4.923) 10.830 29.015 ( 0.927 1.984 -2.502) 3.325 29.458 ( 1.695 -4.411 3.680) 5.989 29.678 ( 8.211 -3.544 -4.721) 10.113 30.192 ( -9.177 0.861 -1.911) 9.413 30.602 ( -2.325 -3.650 -0.531) 4.360 30.989 ( -2.716 -2.367 2.942) 4.651 39.066 ( 3.284 11.536 8.867) 14.916 39.594 ( 10.746 19.628 -7.400) 23.569 40.951 ( 5.239 6.968 12.962) 15.621 41.610 ( 10.028 23.845 -13.209) 29.045 41.956 ( 1.119 -12.251 3.282) 12.732 42.370 ( -10.324 -13.895 3.178) 17.599 43.245 ( -5.902 -7.566 -4.135) 10.449 43.739 ( -6.245 -15.614 8.237) 18.726 44.872 ( 1.006 -3.868 -15.365) 15.876 45.312 ( -3.074 5.573 6.763) 9.287 48.017 ( 0.514 0.082 0.746) 0.909 48.278 ( -0.109 -0.145 -0.046) 0.187 ======================= Grid point 134 (73/125) ======================= q-point: (-0.11 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.214 ( 24.113 -18.879 -15.450) 34.301 3.492 ( 23.003 -24.980 -20.957) 39.904 4.436 ( -29.399 6.335 5.566) 30.585 4.912 ( -15.561 1.849 17.588) 23.556 5.755 ( -0.768 7.724 6.445) 10.089 6.170 ( 12.699 -23.177 -18.365) 32.182 6.596 ( 9.710 13.481 -0.089) 16.614 7.105 ( -7.935 9.619 -0.186) 12.471 7.421 ( -12.656 5.053 3.712) 14.124 7.664 ( 6.798 4.775 2.819) 8.772 7.767 ( -1.472 -6.061 -1.817) 6.496 8.139 ( -2.427 -0.322 -4.099) 4.775 8.339 ( -1.935 -6.618 4.083) 8.014 8.975 ( -3.952 11.015 8.668) 14.563 9.015 ( -2.582 -1.872 -8.893) 9.447 9.235 ( 4.717 -5.080 9.053) 11.402 9.783 ( 5.155 3.616 2.671) 6.839 10.303 ( -11.865 -2.778 -1.198) 12.245 10.616 ( 5.749 -1.460 1.508) 6.120 11.086 ( 1.083 8.380 -2.009) 8.685 11.341 ( -2.994 -8.227 0.339) 8.761 11.483 ( 2.483 6.498 -3.683) 7.871 11.814 ( -0.624 0.933 0.774) 1.364 12.256 ( 5.656 -3.432 0.586) 6.642 15.630 ( 0.523 6.879 3.070) 7.551 16.430 ( -1.745 -3.398 -3.243) 5.011 16.979 ( 6.526 -1.571 1.772) 6.942 17.147 ( -2.468 1.010 6.145) 6.699 17.604 ( -1.508 5.045 -0.795) 5.325 18.479 ( 5.138 17.145 2.374) 18.055 23.387 ( 4.344 -4.492 -4.672) 7.802 23.902 ( -2.477 -4.998 -2.447) 6.091 23.942 ( -5.504 -7.832 -0.928) 9.617 24.295 ( -1.115 7.736 8.376) 11.456 24.715 ( 8.102 9.840 -6.493) 14.306 25.221 ( 2.173 0.424 1.452) 2.648 25.520 ( -3.982 -13.195 -0.772) 13.805 25.950 ( 17.964 -14.667 -3.899) 23.517 26.344 ( -15.942 9.887 1.859) 18.851 26.902 ( -14.200 4.518 5.180) 15.776 28.092 ( 11.855 9.748 -2.721) 15.588 28.642 ( 0.622 -0.746 -1.431) 1.730 29.098 ( 5.616 5.791 1.824) 8.271 29.443 ( -4.560 1.246 -0.075) 4.728 29.692 ( -0.420 -5.562 -0.019) 5.578 30.156 ( 5.120 1.932 0.523) 5.497 30.538 ( -1.336 -4.681 0.844) 4.940 30.911 ( -7.973 -3.999 1.601) 9.062 39.348 ( 5.843 13.860 9.290) 17.679 39.734 ( 6.855 19.964 -16.176) 26.593 41.276 ( 4.856 -2.218 19.400) 20.121 41.714 ( 6.749 -5.619 -11.648) 14.588 41.937 ( 0.820 8.053 2.497) 8.471 42.175 ( -7.746 5.391 -2.994) 9.901 43.046 ( -6.084 -7.566 -2.235) 9.963 43.568 ( -10.262 -17.999 5.570) 21.455 44.759 ( 9.879 -3.932 -10.541) 14.972 45.367 ( -6.503 2.108 7.289) 9.993 48.026 ( -0.127 0.249 0.066) 0.287 48.274 ( -0.198 -0.246 0.175) 0.361 ======================= Grid point 137 (74/125) ======================= q-point: ( 0.22 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.930 ( 43.032 -2.724 -7.883) 43.833 3.672 ( 32.588 -28.660 -10.865) 44.737 4.660 ( -17.346 8.776 17.707) 26.296 4.958 ( -14.160 -3.193 8.845) 16.998 5.342 ( 46.319 -10.139 10.083) 48.476 6.151 ( 8.452 -1.310 -14.627) 16.944 6.744 ( -13.155 -1.167 -8.172) 15.530 7.108 ( -9.817 4.395 -1.852) 10.914 7.307 ( 9.786 14.457 -4.139) 17.942 7.486 ( 5.778 -12.952 11.384) 18.186 7.645 ( -17.181 3.475 -1.745) 17.616 8.337 ( -1.856 8.146 4.201) 9.351 8.546 ( -5.730 -6.565 0.839) 8.754 8.777 ( -1.450 2.249 0.637) 2.751 9.125 ( -10.439 -4.808 -0.608) 11.509 9.742 ( -2.860 7.109 7.042) 10.407 9.916 ( -3.938 1.481 -0.088) 4.208 10.208 ( -3.200 7.038 4.982) 9.198 10.555 ( -0.305 -6.968 2.724) 7.488 10.601 ( 1.858 2.832 -15.603) 15.966 11.395 ( -5.706 2.286 1.148) 6.253 11.823 ( 5.036 -1.608 1.823) 5.592 11.899 ( -4.922 -8.387 1.967) 9.922 12.047 ( 5.842 6.857 -5.103) 10.353 15.731 ( -16.760 6.395 -2.697) 18.140 16.512 ( 3.551 -2.270 -1.525) 4.482 16.786 ( 2.054 0.135 2.901) 3.558 17.330 ( -12.514 6.369 2.843) 14.326 17.544 ( -8.090 4.008 -3.476) 9.674 18.288 ( -19.417 9.835 -9.570) 23.777 23.422 ( 3.168 -8.077 -2.101) 8.927 23.865 ( 17.546 -6.224 8.252) 20.364 23.901 ( 4.824 -1.263 3.389) 6.029 24.236 ( -10.913 -0.744 -2.755) 11.281 24.983 ( -0.727 4.375 -10.931) 11.797 25.238 ( 2.889 -3.511 2.381) 5.133 25.494 ( 9.332 2.377 4.152) 10.487 25.767 ( 5.799 2.264 -4.377) 7.610 26.475 ( -11.208 7.328 9.617) 16.486 26.870 ( -6.858 -6.031 -0.632) 9.155 28.083 ( -7.418 -2.697 -7.130) 10.637 28.832 ( -1.410 8.719 2.976) 9.320 29.022 ( 2.334 -7.420 -7.204) 10.602 29.398 ( 9.357 10.117 -2.211) 13.957 29.460 ( -2.743 -5.788 2.567) 6.900 30.349 ( -1.182 -2.802 -0.128) 3.044 30.673 ( 5.527 0.530 -1.341) 5.712 30.877 ( -5.206 0.529 9.450) 10.802 39.114 ( -11.309 -0.124 -5.063) 12.391 40.018 ( -20.014 -8.725 -20.321) 29.827 40.687 ( 5.397 28.002 1.392) 28.551 41.352 ( -19.195 12.762 0.911) 23.068 42.088 ( -2.108 -4.733 -8.507) 9.960 42.747 ( -0.204 -20.406 8.013) 21.924 43.165 ( 9.296 0.986 3.729) 10.065 43.704 ( 9.730 -2.208 19.615) 22.006 44.629 ( 15.662 -5.695 -10.492) 19.694 45.279 ( 1.429 3.756 3.852) 5.566 48.018 ( -1.859 0.744 -0.067) 2.003 48.288 ( -0.044 0.064 0.193) 0.208 ======================= Grid point 138 (75/125) ======================= q-point: ( 0.33 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.482 ( 41.533 2.597 -0.341) 41.615 3.778 ( 31.041 -24.377 -7.608) 40.195 4.552 ( -18.766 -11.082 12.056) 24.906 4.966 ( -8.189 15.138 5.061) 17.939 5.942 ( 16.592 -1.072 -1.502) 16.694 6.094 ( 14.530 -2.798 -2.247) 14.967 6.498 ( -4.209 -3.889 -4.514) 7.295 6.970 ( -12.779 0.470 0.207) 12.789 7.425 ( -12.043 6.388 -3.937) 14.189 7.444 ( 0.952 5.651 -1.517) 5.928 7.662 ( 12.652 -9.882 11.819) 19.936 8.345 ( -10.346 -1.674 3.675) 11.106 8.517 ( 10.998 -1.513 -0.746) 11.126 8.801 ( -0.940 6.041 -1.937) 6.413 8.912 ( -9.178 -6.766 1.092) 11.454 9.792 ( -6.099 2.960 3.111) 7.459 9.828 ( -0.104 -5.702 -6.033) 8.302 10.268 ( -6.245 10.417 0.650) 12.163 10.519 ( 1.369 -2.230 3.838) 4.645 10.602 ( 5.845 7.217 -5.048) 10.570 11.310 ( -8.985 2.135 -0.474) 9.247 11.653 ( -11.014 -10.625 -2.512) 15.508 11.870 ( 2.202 -2.461 -0.063) 3.303 12.228 ( 8.309 7.558 0.854) 11.264 15.506 ( -14.909 5.068 -3.830) 16.206 16.468 ( -1.409 -5.307 -1.275) 5.637 16.881 ( 0.009 5.329 4.434) 6.933 17.231 ( -10.682 2.429 0.932) 10.995 17.452 ( -3.234 4.892 -2.710) 6.461 18.042 ( -13.340 11.113 -6.501) 18.540 23.383 ( 0.542 -6.329 1.217) 6.468 23.941 ( -0.547 -3.403 -0.957) 3.577 24.011 ( -3.343 -4.787 4.314) 7.259 24.199 ( 7.532 -3.378 8.236) 11.661 24.854 ( -0.430 2.197 -13.172) 13.361 25.225 ( -0.870 -2.582 -0.777) 2.833 25.731 ( 9.989 3.599 6.804) 12.611 25.869 ( 7.094 10.445 -4.725) 13.481 26.456 ( -2.539 -8.234 5.670) 10.315 26.835 ( 2.637 6.609 -1.426) 7.257 27.851 ( -10.153 -5.579 -3.931) 12.234 28.701 ( -15.611 5.363 -5.117) 17.281 29.016 ( 5.523 -2.921 -1.561) 6.439 29.394 ( -3.424 -6.286 3.779) 8.095 29.690 ( 15.109 10.127 1.052) 18.219 30.287 ( 0.111 -3.585 -3.206) 4.810 30.719 ( 3.126 0.942 -2.599) 4.173 30.898 ( -5.758 -1.029 7.264) 9.326 38.937 ( -10.402 1.752 0.501) 10.560 39.516 ( -14.015 -3.454 -14.580) 20.517 40.976 ( 2.403 28.881 -2.039) 29.052 41.221 ( -17.412 16.287 1.398) 23.883 41.924 ( 0.273 -6.615 -8.567) 10.827 42.664 ( 1.632 -23.745 8.664) 25.329 43.298 ( 6.687 -4.630 1.276) 8.233 43.948 ( 2.111 -9.458 14.564) 17.494 44.697 ( 14.874 0.209 -8.339) 17.053 45.408 ( 2.736 6.419 2.487) 7.408 47.996 ( -1.857 0.433 0.211) 1.919 48.288 ( -0.109 0.049 -0.094) 0.152 ======================= Grid point 139 (76/125) ======================= q-point: ( 0.44 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.945 ( 19.815 -16.448 -1.510) 25.797 4.092 ( 35.717 5.082 5.071) 36.431 4.329 ( -8.743 -15.673 5.672) 18.821 4.950 ( -6.926 5.664 -8.826) 12.568 5.912 ( -1.597 5.700 -2.342) 6.366 6.192 ( 1.610 -3.026 -1.732) 3.840 6.454 ( -9.066 1.104 -4.510) 10.186 6.814 ( -4.284 -2.039 -1.040) 4.857 7.283 ( -4.912 5.986 -5.469) 9.480 7.541 ( 3.084 -1.355 11.572) 12.053 7.888 ( 8.979 -8.522 8.862) 15.224 8.289 ( -1.916 4.365 1.768) 5.084 8.496 ( 1.708 -15.422 -4.842) 16.255 8.834 ( -0.349 11.690 -4.284) 12.455 8.935 ( 7.930 -1.889 7.577) 11.129 9.644 ( -5.005 -4.136 -3.313) 7.289 9.833 ( 8.522 0.259 -4.631) 9.703 10.153 ( -12.477 -1.916 -1.352) 12.696 10.622 ( 1.514 6.160 1.278) 6.471 10.717 ( 0.468 9.815 2.764) 10.208 11.205 ( -6.415 4.160 0.127) 7.647 11.431 ( -8.995 -8.543 3.377) 12.857 11.851 ( 0.546 -2.787 -2.967) 4.107 12.369 ( 4.307 3.991 -0.454) 5.890 15.340 ( -9.965 4.937 -0.627) 11.139 16.416 ( -0.959 -2.664 2.737) 3.938 16.916 ( -5.551 2.925 0.149) 6.276 17.126 ( -6.465 0.278 2.405) 6.903 17.457 ( 1.403 3.696 -1.829) 4.356 17.945 ( -7.181 13.848 -2.986) 15.883 23.362 ( -1.730 -5.785 4.672) 7.635 23.853 ( -4.758 1.485 -1.427) 5.185 23.994 ( -5.064 -3.685 7.238) 9.571 24.359 ( 6.059 -7.413 7.430) 12.119 24.726 ( 3.751 0.725 -13.331) 13.867 25.177 ( -1.991 0.138 -2.022) 2.841 25.904 ( 5.420 -0.541 0.950) 5.529 25.979 ( -0.359 7.130 0.562) 7.161 26.539 ( 19.800 -2.585 -1.044) 19.995 26.889 ( 0.471 0.316 -3.330) 3.378 27.678 ( -9.323 3.956 1.816) 10.289 28.472 ( -16.538 6.151 -1.243) 17.689 29.051 ( 4.523 -1.776 -1.101) 4.982 29.338 ( -2.892 -5.294 1.617) 6.245 29.858 ( 0.878 -3.028 -0.871) 3.271 30.319 ( 12.171 4.460 -2.578) 13.216 30.703 ( -0.569 0.043 -3.901) 3.942 30.882 ( -4.875 -2.471 5.366) 7.659 38.883 ( -8.077 6.724 7.021) 12.639 39.233 ( -6.890 2.883 -8.496) 11.312 41.053 ( -14.337 21.193 -3.380) 25.809 41.270 ( -2.141 26.829 -1.819) 26.975 41.806 ( 3.987 -10.457 -3.679) 11.781 42.626 ( 4.184 -24.656 10.675) 27.191 43.322 ( 4.610 -7.717 -1.050) 9.050 43.983 ( -0.888 -12.919 7.264) 14.848 44.844 ( 11.460 4.941 -3.017) 12.839 45.459 ( -0.210 2.904 -4.493) 5.354 47.983 ( -1.230 0.244 0.945) 1.570 48.285 ( -0.121 0.016 -0.231) 0.261 ======================= Grid point 140 (77/125) ======================= q-point: (-0.44 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.794 ( -8.543 -27.456 -3.300) 28.943 4.379 ( 9.189 0.017 3.950) 10.002 4.584 ( -5.331 -10.470 -18.386) 21.819 4.674 ( 23.728 2.981 4.125) 24.268 6.008 ( -6.319 10.645 7.887) 14.678 6.124 ( -11.492 2.663 -3.015) 12.175 6.255 ( 9.814 -2.730 -9.531) 13.950 6.698 ( -5.659 4.422 -7.427) 10.332 7.247 ( 0.117 3.675 -2.822) 4.635 7.725 ( 2.014 -10.236 13.549) 17.100 7.979 ( -2.199 5.604 6.621) 8.948 8.227 ( 6.711 -14.767 -8.350) 18.243 8.525 ( 1.208 -0.459 9.899) 9.983 8.849 ( 5.474 4.883 -6.673) 9.916 9.081 ( -0.228 0.354 5.538) 5.554 9.568 ( -2.305 4.415 -3.034) 5.832 9.923 ( -15.095 -4.551 2.400) 15.948 9.952 ( 14.332 -0.606 -4.271) 14.967 10.608 ( -2.047 1.786 -3.335) 4.301 10.850 ( 1.382 7.923 5.608) 9.804 11.210 ( -3.946 2.843 2.665) 5.545 11.381 ( -2.203 2.142 7.574) 8.173 11.778 ( -0.243 -4.161 -4.109) 5.853 12.392 ( -0.445 -0.721 -2.695) 2.825 15.307 ( -4.076 6.251 4.168) 8.547 16.482 ( 3.097 -0.041 7.134) 7.778 16.803 ( -5.743 -2.040 -3.987) 7.283 17.099 ( -5.803 0.099 5.693) 8.130 17.493 ( 3.078 2.980 -1.694) 4.607 17.981 ( -3.388 16.736 0.214) 17.077 23.344 ( -1.636 -7.808 5.120) 9.479 23.842 ( -1.281 5.877 2.410) 6.480 23.980 ( -5.187 -1.744 6.549) 8.535 24.419 ( 0.344 -6.634 5.179) 8.424 24.652 ( 6.977 -0.730 -12.750) 14.553 25.126 ( -1.817 0.766 -2.258) 2.998 25.928 ( 2.013 -2.833 -3.255) 4.762 25.969 ( -2.563 -3.298 -0.592) 4.219 26.692 ( 1.895 -6.213 -11.756) 13.431 26.958 ( 20.895 5.941 5.507) 22.410 27.669 ( -11.455 13.833 3.448) 18.288 28.367 ( -10.182 8.979 7.280) 15.404 29.082 ( 2.905 -1.096 -1.111) 3.298 29.251 ( -1.569 -6.399 -3.241) 7.342 29.743 ( -3.035 -7.364 -3.362) 8.645 30.541 ( 11.743 4.013 0.317) 12.413 30.615 ( -4.752 0.122 -4.198) 6.342 30.865 ( -0.927 -3.272 3.773) 5.080 38.982 ( -6.925 11.140 13.451) 18.788 39.163 ( 1.094 10.068 -4.613) 11.129 40.982 ( -13.544 16.763 0.078) 21.550 41.387 ( -0.642 29.668 -15.048) 33.272 41.806 ( 5.797 -12.904 8.141) 16.321 42.619 ( 2.709 -23.609 11.873) 26.565 43.297 ( 4.865 -8.603 -2.648) 10.232 43.923 ( -1.238 -13.467 4.066) 14.122 44.993 ( 6.450 5.896 -2.067) 8.980 45.345 ( -2.742 -1.108 -10.534) 10.942 47.989 ( -0.385 0.145 1.488) 1.544 48.281 ( -0.053 -0.001 -0.161) 0.169 ======================= Grid point 141 (78/125) ======================= q-point: (-0.33 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.335 ( -9.458 -35.161 -8.258) 37.335 3.864 ( -13.885 -20.525 -33.489) 41.660 4.717 ( 10.947 10.935 8.211) 17.516 5.098 ( 11.570 -0.192 12.734) 17.206 5.763 ( -14.173 3.222 -8.722) 16.951 6.137 ( 10.767 -21.794 -23.700) 33.950 6.304 ( -0.205 15.924 9.292) 18.438 6.757 ( 8.904 15.032 4.182) 17.964 7.263 ( 0.014 3.956 -0.119) 3.958 7.710 ( -2.799 -5.343 1.685) 6.263 8.105 ( -5.354 4.827 9.834) 12.193 8.155 ( 6.315 -10.092 -3.335) 12.363 8.547 ( 1.621 -3.714 -2.802) 4.927 8.957 ( 2.677 -3.929 9.695) 10.798 9.089 ( -8.411 9.608 1.839) 12.901 9.547 ( -1.705 4.857 -0.366) 5.160 9.701 ( -18.055 -0.532 2.769) 18.274 10.092 ( 12.553 1.109 -4.497) 13.381 10.621 ( 5.776 -3.617 -0.238) 6.819 10.993 ( 0.566 8.323 3.686) 9.120 11.216 ( 2.047 -0.889 2.679) 3.487 11.487 ( -1.891 7.899 3.417) 8.812 11.720 ( 1.389 -4.668 1.378) 5.062 12.289 ( -3.716 -5.213 -4.870) 8.044 15.418 ( 0.158 8.594 8.334) 11.972 16.623 ( 4.757 -2.096 2.673) 5.846 16.658 ( -3.274 -5.030 -0.985) 6.082 17.115 ( -3.724 1.559 8.870) 9.746 17.552 ( 2.249 4.129 0.220) 4.707 18.123 ( -0.557 20.149 3.607) 20.477 23.305 ( 0.669 -10.389 1.671) 10.544 23.961 ( 1.276 0.161 7.036) 7.152 23.983 ( -1.556 7.704 2.860) 8.364 24.391 ( -2.878 -5.836 1.437) 6.664 24.583 ( 4.342 -1.658 -10.723) 11.687 25.104 ( 0.843 0.042 0.013) 0.844 25.789 ( -7.070 -7.580 -6.767) 12.379 25.866 ( 1.064 -9.912 -5.834) 11.550 26.576 ( 1.542 -0.436 -2.137) 2.671 27.388 ( 14.397 16.969 -0.599) 22.262 27.606 ( -12.912 7.426 6.633) 16.305 28.498 ( -2.937 10.862 12.714) 16.978 29.040 ( -3.129 -0.742 -5.052) 5.988 29.179 ( 9.652 -8.069 -4.888) 13.497 29.632 ( -1.466 -4.871 -1.587) 5.328 30.480 ( -8.228 -0.261 -2.595) 8.631 30.638 ( 1.444 -1.946 -1.144) 2.680 30.929 ( 5.506 -1.427 3.858) 6.873 39.121 ( -6.070 11.451 10.452) 16.650 39.341 ( 6.307 19.526 2.710) 20.697 40.973 ( -7.748 12.741 4.732) 15.644 41.403 ( 4.291 21.463 -19.422) 29.262 41.910 ( 2.168 -7.332 11.650) 13.934 42.580 ( -3.171 -19.167 10.388) 22.030 43.258 ( 4.690 -9.123 -3.808) 10.942 43.842 ( -1.150 -15.032 5.006) 15.885 44.931 ( -3.850 -4.150 -15.797) 16.781 45.278 ( 4.126 5.959 -1.071) 7.326 48.006 ( 0.130 0.070 1.436) 1.443 48.280 ( -0.025 -0.028 0.019) 0.042 ======================= Grid point 142 (79/125) ======================= q-point: (-0.22 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.805 ( -1.493 -37.355 -14.715) 40.177 3.170 ( -0.019 -24.831 -32.439) 40.852 5.058 ( 3.897 14.870 10.802) 18.788 5.171 ( -16.659 -1.918 7.237) 18.264 5.656 ( 6.652 3.270 -3.660) 8.266 5.729 ( 12.980 -32.964 -30.852) 46.978 6.512 ( -2.196 15.418 7.498) 17.284 7.116 ( 10.236 13.325 5.053) 17.546 7.314 ( 3.700 2.976 2.130) 5.204 7.689 ( 1.521 0.294 0.177) 1.559 8.005 ( -12.626 2.634 -4.346) 13.610 8.182 ( 1.011 -3.282 3.344) 4.793 8.503 ( -2.486 -2.687 -0.865) 3.761 9.016 ( -6.942 2.217 13.428) 15.278 9.139 ( -2.707 7.149 3.945) 8.603 9.439 ( -15.777 4.215 -1.885) 16.439 9.654 ( 1.282 -0.269 9.491) 9.581 10.245 ( 15.862 0.253 -4.701) 16.546 10.606 ( -5.509 -2.600 1.129) 6.195 11.070 ( 1.795 9.935 -5.441) 11.468 11.293 ( 3.708 -3.049 2.564) 5.442 11.547 ( -0.166 1.300 3.837) 4.054 11.763 ( 0.810 -1.980 4.839) 5.291 12.133 ( -0.046 -6.209 -5.721) 8.443 15.618 ( 0.178 10.580 10.352) 14.803 16.503 ( -3.352 -5.511 -3.610) 7.392 16.724 ( 8.000 -8.148 1.045) 11.466 17.242 ( -2.678 6.264 12.929) 14.614 17.621 ( 0.313 5.581 1.420) 5.767 18.375 ( 1.883 22.861 6.949) 23.968 23.240 ( 3.549 -10.665 -2.560) 11.528 23.955 ( -2.604 -1.377 0.580) 3.002 24.076 ( -0.607 -6.301 -5.232) 8.212 24.361 ( 3.355 3.601 6.117) 7.851 24.516 ( -0.726 3.188 -4.713) 5.736 25.153 ( 3.063 -0.866 3.066) 4.419 25.551 ( -1.748 -10.136 -6.526) 12.182 25.701 ( 0.505 -12.614 -7.296) 14.581 26.652 ( -1.823 8.783 6.233) 10.923 27.346 ( -17.275 15.211 -6.368) 23.882 27.834 ( 8.135 6.964 8.545) 13.700 28.637 ( -2.704 1.837 5.251) 6.186 28.996 ( 1.965 5.047 -0.612) 5.450 29.259 ( 17.178 -7.303 -2.556) 18.840 29.571 ( -0.843 -2.517 -1.634) 3.117 30.331 ( -9.708 0.414 -0.713) 9.743 30.584 ( -1.385 -4.650 -1.571) 5.100 31.018 ( 1.502 -2.504 3.622) 4.652 39.287 ( -1.431 15.685 8.799) 18.041 39.603 ( 2.356 21.205 -0.301) 21.337 41.118 ( 2.056 8.409 13.017) 15.633 41.419 ( 9.417 10.921 -15.884) 21.453 41.994 ( -2.275 -0.091 7.297) 7.644 42.465 ( -9.351 -11.464 6.285) 16.074 43.168 ( 0.146 -9.202 -5.200) 10.570 43.768 ( -2.553 -18.576 8.661) 20.654 44.606 ( -0.530 -7.576 -20.513) 21.874 45.410 ( 3.567 6.979 2.108) 8.116 48.024 ( 0.141 0.123 1.032) 1.048 48.280 ( -0.122 -0.080 0.195) 0.244 ======================= Grid point 143 (80/125) ======================= q-point: (-0.11 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.506 ( 23.730 -29.364 -11.873) 39.577 2.718 ( 16.499 -26.335 -26.365) 40.754 4.932 ( -24.624 7.785 3.167) 26.019 5.133 ( 7.084 -29.202 -13.037) 32.755 5.429 ( 9.651 -12.369 -6.680) 17.052 5.796 ( 8.799 7.099 0.882) 11.340 6.684 ( -0.593 15.235 4.471) 15.889 7.243 ( -3.441 5.697 2.209) 7.013 7.472 ( 5.519 0.695 -0.864) 5.629 7.686 ( -2.172 -4.394 -6.262) 7.952 7.853 ( -5.627 13.975 1.711) 15.162 8.172 ( -5.969 0.997 1.831) 6.322 8.456 ( -4.834 0.878 6.205) 7.914 9.053 ( -10.601 1.190 -2.140) 10.880 9.191 ( -1.649 12.571 8.294) 15.151 9.369 ( -4.283 2.945 8.586) 10.037 9.798 ( 2.221 -1.460 10.073) 10.418 10.326 ( 1.707 -9.357 -2.655) 9.875 10.555 ( 1.051 5.854 -0.113) 5.949 11.086 ( 1.927 9.935 -9.470) 13.860 11.335 ( -0.113 -5.920 7.281) 9.384 11.496 ( -6.563 -3.550 -2.023) 7.731 11.814 ( 3.106 -1.594 1.740) 3.901 12.119 ( 8.328 -2.532 -1.956) 8.921 15.805 ( -3.746 10.877 9.749) 15.079 16.399 ( -1.231 -3.649 -1.623) 4.179 16.775 ( 10.015 -10.362 -0.816) 14.434 17.395 ( -5.843 8.560 11.165) 15.234 17.675 ( -2.007 6.490 1.241) 6.906 18.658 ( -0.812 21.740 5.976) 22.561 23.197 ( 7.165 -7.465 -3.500) 10.922 23.790 ( -2.834 -15.368 -10.124) 18.620 23.915 ( -2.222 -3.063 -3.030) 4.848 24.499 ( -4.287 7.325 0.750) 8.520 24.632 ( 10.695 9.375 6.651) 15.701 25.203 ( 1.321 -0.950 0.877) 1.849 25.419 ( -0.891 -15.652 -1.448) 15.744 25.596 ( 11.479 -9.250 -3.114) 15.068 26.727 ( -15.478 14.610 6.695) 22.312 27.182 ( -11.891 11.060 -1.603) 16.319 28.015 ( 4.110 6.146 0.864) 7.444 28.620 ( -1.055 -3.205 -0.640) 3.435 29.095 ( 3.840 3.753 1.268) 5.517 29.447 ( 10.402 -4.145 2.354) 11.442 29.531 ( 4.871 -1.764 -4.156) 6.641 30.227 ( -6.324 2.270 2.124) 7.047 30.515 ( -0.524 -5.180 -0.119) 5.208 31.000 ( -5.429 -3.843 2.708) 7.182 39.555 ( 4.269 22.030 7.438) 23.640 39.691 ( -4.644 15.661 -7.261) 17.876 41.429 ( 4.536 -4.276 -6.673) 9.132 41.451 ( 9.385 4.155 16.349) 19.303 42.043 ( -1.873 9.190 2.221) 9.638 42.315 ( -9.871 2.549 0.143) 10.196 43.007 ( -2.814 -10.135 -3.349) 11.038 43.624 ( -9.648 -20.812 6.748) 23.912 44.403 ( 12.272 -7.753 -15.163) 20.991 45.491 ( -1.373 3.066 0.610) 3.414 48.036 ( -0.232 0.377 0.634) 0.773 48.279 ( -0.230 -0.112 0.358) 0.440 ======================= Grid point 146 (81/125) ======================= q-point: ( 0.22 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( 42.596 -1.842 4.096) 42.832 2.793 ( 37.881 -32.881 -8.952) 50.953 4.629 ( 60.491 -9.537 24.510) 65.960 5.116 ( -19.526 -7.913 8.806) 22.835 5.280 ( -9.852 14.325 1.487) 17.449 5.867 ( 7.605 -0.964 -11.647) 13.943 6.820 ( -13.190 0.340 -9.385) 16.192 7.231 ( -7.056 2.760 -0.966) 7.638 7.312 ( 2.623 11.771 0.868) 12.090 7.532 ( -2.691 -3.440 9.747) 10.681 7.890 ( -16.673 2.552 -3.297) 17.186 8.359 ( 0.645 -1.066 -5.211) 5.358 8.558 ( -1.350 -3.467 -0.097) 3.722 8.891 ( -5.095 3.833 8.877) 10.929 9.259 ( -14.753 -5.660 -0.489) 15.809 9.754 ( 1.432 -0.665 -13.033) 13.128 10.004 ( -1.581 10.347 3.231) 10.954 10.343 ( -0.155 -2.267 -15.948) 16.109 10.452 ( -1.772 -2.711 11.901) 12.334 10.675 ( -9.233 7.920 6.728) 13.901 11.456 ( -0.314 -0.143 -1.717) 1.751 11.759 ( 5.778 0.552 0.736) 5.850 11.850 ( -1.438 -13.967 -3.311) 14.426 11.955 ( 8.829 7.888 -0.255) 11.842 15.969 ( -17.203 5.112 -6.690) 19.153 16.419 ( 4.486 -3.640 0.497) 5.798 16.727 ( 10.340 0.261 1.052) 10.397 17.568 ( -12.673 3.056 -0.610) 13.050 17.652 ( -9.379 3.863 -3.746) 10.813 18.610 ( -25.765 11.899 -6.220) 29.054 23.239 ( 9.211 -6.857 -3.272) 11.940 23.675 ( 17.038 -6.776 10.074) 20.922 23.874 ( 4.285 -2.389 5.183) 7.136 24.367 ( -8.381 3.836 -1.021) 9.273 24.840 ( 2.442 2.188 -11.984) 12.424 25.211 ( 0.975 -3.574 2.371) 4.398 25.443 ( 7.219 0.991 4.762) 8.705 25.584 ( 10.937 -2.009 -6.441) 12.851 26.865 ( -10.027 19.350 3.798) 22.123 26.996 ( -25.498 -13.847 2.784) 29.149 28.111 ( -7.386 -0.290 -5.006) 8.927 28.797 ( 5.708 -9.171 -7.554) 13.182 28.916 ( 7.594 8.921 7.181) 13.741 29.327 ( 4.950 11.559 -6.713) 14.254 29.506 ( -2.823 -5.352 3.101) 6.799 30.343 ( -2.416 -3.569 -0.781) 4.380 30.561 ( 6.803 -1.840 -0.428) 7.061 31.047 ( -4.311 0.939 4.268) 6.138 39.284 ( -13.940 5.731 0.727) 15.089 40.013 ( -20.843 -6.811 -18.349) 28.592 40.905 ( 1.789 24.777 6.919) 25.787 41.733 ( -15.708 17.714 -6.221) 24.479 41.961 ( -4.661 -11.340 -2.730) 12.560 42.642 ( 0.024 -20.098 1.840) 20.182 43.045 ( 11.269 0.158 -0.696) 11.292 43.801 ( 8.768 -5.319 22.455) 24.686 44.213 ( 18.629 -5.155 -12.048) 22.776 45.338 ( 1.857 5.631 5.405) 8.023 48.044 ( -1.315 0.336 -0.238) 1.378 48.289 ( 0.003 -0.050 -0.114) 0.125 ======================= Grid point 147 (82/125) ======================= q-point: ( 0.33 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.972 ( 42.370 6.172 7.533) 43.475 3.061 ( 36.842 -18.910 2.026) 41.461 4.798 ( -19.855 -16.981 3.505) 26.360 5.246 ( -11.680 13.967 -5.758) 19.096 5.601 ( 39.520 -3.198 18.553) 43.775 5.869 ( 11.482 1.395 -3.731) 12.154 6.536 ( -11.804 0.886 -6.368) 13.442 7.132 ( -9.809 1.521 -0.705) 9.951 7.460 ( 4.121 8.699 -0.125) 9.626 7.628 ( -12.357 5.533 -2.827) 13.832 7.641 ( -1.167 -8.920 12.755) 15.608 8.296 ( 5.677 -9.406 -4.892) 12.026 8.458 ( -6.039 -2.475 -1.041) 6.609 8.945 ( -6.263 7.548 4.026) 10.602 9.001 ( -11.544 -4.714 -0.807) 12.495 9.594 ( 3.997 -6.124 -13.823) 15.639 9.907 ( -7.032 0.078 -9.498) 11.819 10.396 ( 4.245 15.955 0.839) 16.532 10.456 ( -0.347 -12.486 3.501) 12.972 10.766 ( -5.994 12.773 11.457) 18.175 11.401 ( -3.763 1.431 -3.571) 5.381 11.617 ( -3.195 -13.353 -4.130) 14.338 11.832 ( 0.804 -0.524 0.103) 0.965 12.167 ( 9.540 6.567 1.124) 11.637 15.694 ( -14.499 3.954 -6.378) 16.326 16.433 ( 0.879 -4.147 1.113) 4.383 16.898 ( 8.356 3.955 1.527) 9.370 17.362 ( -10.813 -1.127 -5.964) 12.400 17.544 ( -7.533 3.744 0.273) 8.417 18.324 ( -20.102 12.649 -3.320) 23.981 23.308 ( 7.228 -3.026 1.455) 7.970 23.911 ( 4.094 -3.724 1.744) 5.803 23.947 ( 8.558 -8.240 8.236) 14.455 24.319 ( -7.287 3.704 6.167) 10.240 24.691 ( -0.960 3.462 -16.524) 16.910 25.214 ( 0.041 -0.683 0.058) 0.687 25.630 ( 12.075 -7.933 6.225) 15.732 25.741 ( 15.261 12.018 -4.298) 19.895 26.577 ( -19.093 -13.806 -0.315) 23.564 26.935 ( -6.139 11.253 3.140) 13.198 27.935 ( -8.519 -0.535 -1.772) 8.718 28.718 ( 1.643 -4.064 -5.927) 7.372 29.017 ( -3.460 7.049 -0.506) 7.868 29.453 ( -4.469 -5.457 4.103) 8.160 29.572 ( 15.500 12.838 0.418) 20.130 30.237 ( -3.409 -5.022 -3.187) 6.856 30.621 ( 5.529 -1.804 -1.948) 6.134 31.019 ( -4.078 -3.227 2.524) 5.781 39.188 ( -13.688 9.530 5.605) 17.596 39.548 ( -15.110 -0.188 -12.005) 19.299 41.198 ( 0.507 24.771 5.526) 25.385 41.604 ( -11.252 22.820 -11.829) 28.058 41.773 ( -6.835 -13.700 2.799) 15.564 42.496 ( 3.603 -22.767 0.850) 23.066 43.155 ( 7.800 -5.933 -0.210) 9.803 43.939 ( 4.478 -18.495 5.510) 19.811 44.434 ( 17.325 7.388 1.565) 18.899 45.448 ( 0.506 4.339 1.058) 4.495 48.025 ( -1.437 0.145 0.052) 1.445 48.286 ( 0.034 -0.142 -0.321) 0.353 ======================= Grid point 148 (83/125) ======================= q-point: ( 0.44 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.494 ( 31.166 -5.574 5.875) 32.201 3.729 ( 37.593 7.842 12.839) 40.491 4.392 ( -16.734 -21.569 -0.697) 27.308 4.994 ( -14.657 0.946 -16.499) 22.089 5.836 ( 7.662 0.518 -5.048) 9.190 6.215 ( 2.189 6.051 4.416) 7.805 6.482 ( 4.758 4.243 3.121) 7.098 6.916 ( -16.589 -6.066 -0.659) 17.675 7.358 ( -9.722 1.815 -5.321) 11.231 7.605 ( 3.343 6.504 3.541) 8.125 7.837 ( 8.085 -6.245 11.715) 15.544 8.211 ( 1.432 -11.725 -6.141) 13.313 8.415 ( 2.551 0.795 2.846) 3.904 8.883 ( -7.655 5.558 -7.141) 11.853 8.946 ( 2.391 -2.925 8.946) 9.711 9.494 ( 9.158 -4.308 -8.590) 13.275 9.757 ( -3.473 6.419 -7.451) 10.429 10.283 ( -10.022 -9.124 1.549) 13.642 10.631 ( 5.715 7.897 1.141) 9.814 10.892 ( -5.374 7.714 5.985) 11.145 11.328 ( -4.226 6.358 0.001) 7.634 11.471 ( -2.315 -9.423 1.088) 9.764 11.804 ( -1.729 -2.115 -1.543) 3.137 12.321 ( 5.693 3.363 -0.715) 6.650 15.511 ( -9.517 4.659 -1.205) 10.665 16.434 ( 0.695 -2.947 3.535) 4.654 16.984 ( -3.937 2.622 -3.704) 6.008 17.198 ( -0.044 -1.005 0.008) 1.006 17.489 ( -5.223 1.978 0.785) 5.640 18.187 ( -12.498 15.232 -0.163) 19.704 23.393 ( 1.395 -2.885 5.095) 6.019 23.903 ( -1.281 2.950 -0.829) 3.322 24.058 ( 2.797 -9.776 5.889) 11.750 24.329 ( 0.763 -2.678 0.196) 2.792 24.559 ( -0.881 6.021 -7.001) 9.276 25.201 ( -2.202 1.976 -1.003) 3.124 25.739 ( 9.425 -8.268 -1.155) 12.591 26.078 ( 9.061 12.466 4.417) 16.032 26.292 ( 1.604 -9.811 -2.093) 10.159 26.874 ( -6.681 -4.542 -3.152) 8.672 27.892 ( -5.693 11.801 3.626) 13.595 28.635 ( -4.309 2.971 -3.198) 6.134 29.019 ( -1.379 4.562 -0.520) 4.794 29.385 ( -5.605 -5.151 2.726) 8.086 29.788 ( 3.858 -3.302 -0.828) 5.145 30.187 ( 7.077 4.787 -2.306) 8.849 30.635 ( 2.892 -1.970 -3.064) 4.651 30.949 ( -3.452 -6.187 1.452) 7.232 39.188 ( -9.094 14.918 3.150) 17.754 39.318 ( -10.735 5.818 1.535) 12.306 41.393 ( -7.891 23.139 -1.748) 24.510 41.493 ( -7.356 23.102 -16.275) 29.201 41.686 ( -2.279 -11.772 15.709) 19.763 42.417 ( 9.529 -24.829 3.062) 26.771 43.170 ( 4.523 -8.056 -1.760) 9.405 43.876 ( 4.959 -17.979 -0.557) 18.659 44.739 ( 10.997 7.786 4.542) 14.219 45.419 ( -2.397 -0.689 -6.490) 6.953 48.012 ( -1.068 0.046 0.692) 1.273 48.281 ( 0.064 -0.178 -0.312) 0.365 ======================= Grid point 149 (84/125) ======================= q-point: (-0.44 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.671 ( -8.359 -24.944 -0.785) 26.319 4.211 ( 16.095 -3.177 1.176) 16.448 4.438 ( 25.016 7.055 6.859) 26.882 4.464 ( -15.618 -6.288 -14.598) 22.284 5.759 ( 7.502 -20.712 -20.138) 29.846 6.285 ( -6.479 8.735 1.244) 10.947 6.398 ( -14.713 10.840 2.721) 18.477 6.763 ( -5.096 5.224 -0.898) 7.353 7.279 ( -1.452 5.943 -1.207) 6.236 7.761 ( 2.413 -6.400 9.421) 11.642 7.933 ( 6.986 -11.004 -4.884) 13.919 8.123 ( -0.012 6.197 4.227) 7.501 8.613 ( 5.167 0.186 11.103) 12.248 8.681 ( 1.075 -1.866 -12.265) 12.452 9.176 ( 6.085 3.405 13.774) 15.438 9.591 ( 11.373 1.082 0.193) 11.426 9.703 ( 0.998 8.300 -9.616) 12.741 10.096 ( -9.651 -9.204 4.830) 14.184 10.614 ( -5.839 -1.181 -6.584) 8.879 10.966 ( 0.159 7.021 5.912) 9.180 11.323 ( -6.169 2.122 -1.938) 6.806 11.486 ( 3.281 3.523 6.899) 8.413 11.727 ( -3.153 -3.891 -0.780) 5.068 12.354 ( 0.336 -1.147 -2.426) 2.704 15.486 ( -4.411 7.122 5.572) 10.061 16.500 ( 3.348 -2.934 5.760) 7.280 16.810 ( -7.165 -2.565 -6.277) 9.865 17.271 ( -2.570 1.680 7.696) 8.286 17.464 ( 0.601 3.060 -0.340) 3.137 18.213 ( -6.093 18.687 2.820) 19.856 23.391 ( -4.678 -6.255 4.422) 8.976 23.927 ( -0.561 3.439 1.493) 3.791 24.036 ( 1.582 -6.079 -0.642) 6.314 24.298 ( 5.569 -2.453 -8.648) 10.574 24.587 ( -3.374 5.523 6.400) 9.102 25.150 ( -4.019 1.184 -2.008) 4.646 25.738 ( 5.943 -11.495 -4.123) 13.582 26.032 ( -7.398 -7.133 0.988) 10.324 26.512 ( 6.932 8.983 -9.254) 14.642 26.801 ( 15.081 -3.108 8.523) 17.600 27.968 ( -8.097 16.763 1.492) 18.676 28.617 ( -3.663 8.435 4.054) 10.050 29.030 ( -0.183 1.404 -0.794) 1.623 29.248 ( -8.840 -6.008 -2.308) 10.935 29.687 ( -2.457 -9.588 -1.190) 9.969 30.401 ( 13.133 6.834 -0.426) 14.811 30.600 ( -0.272 -2.193 -2.897) 3.643 30.871 ( -1.371 -7.028 0.988) 7.228 39.207 ( -1.131 13.812 -4.609) 14.604 39.407 ( -9.717 16.802 18.238) 26.634 41.337 ( -2.871 8.445 -10.392) 13.695 41.388 ( -15.640 23.700 -6.673) 29.168 41.855 ( 0.956 0.316 16.111) 16.142 42.436 ( 13.571 -25.937 7.177) 30.140 43.122 ( 2.999 -7.438 -4.328) 9.113 43.791 ( 5.013 -17.064 -1.476) 17.846 44.946 ( 4.359 5.029 0.042) 6.655 45.238 ( -3.112 -2.934 -10.667) 11.492 48.012 ( -0.500 0.017 1.160) 1.263 48.279 ( 0.115 -0.142 -0.083) 0.201 ======================= Grid point 150 (85/125) ======================= q-point: (-0.33 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.156 ( -17.170 -38.020 -4.492) 41.958 3.579 ( -27.563 -19.021 -35.386) 48.721 4.690 ( 18.917 13.611 8.232) 24.716 5.026 ( 22.568 2.931 12.376) 25.905 5.268 ( 8.197 -39.602 -31.280) 51.127 6.056 ( -19.267 2.891 -6.657) 20.588 6.595 ( -2.336 20.348 9.692) 22.659 6.821 ( 4.426 15.083 2.057) 15.852 7.333 ( -1.017 7.820 1.181) 7.974 7.694 ( -0.607 -9.053 -2.090) 9.311 7.978 ( 6.300 -5.900 4.176) 9.589 8.278 ( -0.834 5.367 5.840) 7.975 8.450 ( -0.706 -0.860 -8.691) 8.762 8.950 ( 13.025 2.020 9.451) 16.219 9.378 ( -9.740 9.395 10.318) 17.017 9.629 ( -2.189 6.715 -2.157) 7.385 9.794 ( 11.300 -3.420 -0.709) 11.827 10.019 ( -7.446 -2.441 7.290) 10.702 10.473 ( 4.750 -4.138 -4.321) 7.639 11.088 ( -1.262 7.732 0.318) 7.841 11.216 ( -1.121 -2.147 -1.524) 2.862 11.599 ( -3.920 -0.148 3.051) 4.969 11.706 ( 3.413 2.173 3.962) 5.663 12.254 ( -5.244 -5.934 -3.637) 8.714 15.627 ( -0.743 10.748 11.327) 15.633 16.546 ( 1.354 -6.195 -1.017) 6.422 16.652 ( -3.408 -6.373 -0.189) 7.230 17.335 ( -4.751 4.431 11.390) 13.112 17.560 ( 4.341 6.408 1.689) 7.922 18.379 ( -1.974 22.784 6.324) 23.728 23.282 ( -6.191 -9.373 1.565) 11.341 23.919 ( 5.015 -9.934 -3.632) 11.706 24.039 ( 2.578 0.269 -3.859) 4.648 24.256 ( 0.857 3.168 -3.821) 5.037 24.663 ( -6.050 6.207 8.134) 11.887 25.095 ( -0.702 -0.776 -0.107) 1.052 25.607 ( 1.480 -15.800 -8.337) 17.926 25.827 ( -9.238 -9.138 -3.479) 13.452 26.546 ( 4.876 10.036 -0.851) 11.190 27.286 ( 23.697 8.946 10.738) 27.511 27.926 ( -14.296 15.245 -2.811) 21.087 28.769 ( 0.679 8.997 10.470) 13.821 28.969 ( -4.673 -9.714 -4.927) 11.852 29.041 ( -4.102 1.558 -4.434) 6.238 29.598 ( -0.869 -6.983 0.733) 7.075 30.517 ( -1.661 1.056 -4.695) 5.091 30.563 ( 3.498 -3.967 0.432) 5.306 30.870 ( 5.685 -3.547 2.888) 7.297 39.298 ( 1.517 16.104 -1.413) 16.237 39.680 ( -7.311 21.567 19.465) 29.958 41.242 ( 1.695 15.865 -21.758) 26.981 41.311 ( -14.190 9.659 9.280) 19.513 42.036 ( -1.064 1.778 12.260) 12.434 42.526 ( 9.753 -23.351 12.341) 28.154 43.041 ( 4.105 -6.149 -7.980) 10.879 43.714 ( 5.510 -17.682 0.329) 18.524 44.762 ( -8.449 -9.424 -16.878) 21.096 45.241 ( 6.381 8.070 -1.200) 10.358 48.023 ( -0.110 0.047 1.263) 1.269 48.280 ( 0.104 -0.078 0.175) 0.218 ======================= Grid point 151 (86/125) ======================= q-point: (-0.22 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( -22.468 -41.977 -12.078) 49.120 2.647 ( -11.410 -26.900 -32.419) 43.644 4.637 ( 17.754 -52.035 -36.993) 66.267 5.155 ( 15.102 16.469 5.615) 23.040 5.414 ( 5.214 -1.025 12.583) 13.659 5.721 ( -15.704 5.306 -8.094) 18.447 6.787 ( -4.348 15.898 7.606) 18.153 7.133 ( 11.079 15.933 4.742) 19.977 7.354 ( -2.115 3.321 -1.103) 4.088 7.668 ( 2.020 1.411 -0.115) 2.467 8.017 ( -1.915 -3.098 1.049) 3.790 8.249 ( -2.460 2.699 1.069) 3.805 8.510 ( 4.057 2.094 2.365) 5.141 9.210 ( 7.903 10.602 -3.435) 13.663 9.320 ( -12.944 0.325 11.305) 17.189 9.633 ( -9.730 7.580 -2.268) 12.541 9.882 ( -6.429 -4.042 17.788) 19.341 9.998 ( 7.442 0.412 -2.156) 7.759 10.591 ( 9.424 -2.311 2.658) 10.060 11.007 ( -0.698 9.766 -14.003) 17.086 11.291 ( 3.340 -4.486 7.999) 9.760 11.566 ( -0.346 -6.185 4.314) 7.549 11.831 ( 1.508 6.330 1.996) 6.806 12.037 ( -7.534 -10.041 -5.389) 13.661 15.875 ( -0.760 13.501 13.848) 19.355 16.446 ( -1.364 -6.013 -3.948) 7.321 16.579 ( 1.629 -11.781 1.197) 11.953 17.496 ( -2.002 8.068 13.142) 15.551 17.689 ( 1.643 8.012 2.572) 8.573 18.665 ( 0.028 26.179 9.706) 27.921 23.130 ( -3.653 -11.097 -0.441) 11.691 23.799 ( 4.309 -15.571 -12.966) 20.716 23.960 ( 0.448 -5.454 -5.281) 7.605 24.338 ( 3.348 8.621 2.818) 9.668 24.693 ( -7.044 4.525 5.784) 10.176 25.141 ( 3.516 -1.147 5.108) 6.306 25.380 ( 0.347 -13.639 -8.099) 15.866 25.593 ( -7.258 -8.978 -3.675) 12.116 26.776 ( 7.254 16.121 5.335) 18.465 27.637 ( -11.818 19.215 -3.186) 22.782 27.899 ( 7.066 5.521 8.243) 12.180 28.723 ( -8.173 -7.747 -1.103) 11.315 28.939 ( 9.570 -6.331 -5.873) 12.890 29.062 ( 2.048 9.551 6.505) 11.736 29.544 ( -0.747 -6.053 0.352) 6.109 30.424 ( -5.336 -0.447 -1.620) 5.594 30.529 ( 0.194 -5.037 -2.124) 5.470 30.992 ( 6.059 -2.657 4.622) 8.070 39.461 ( 2.831 19.655 -1.094) 19.888 39.945 ( -11.590 20.434 15.952) 28.396 41.151 ( 5.200 14.122 -20.012) 25.039 41.397 ( -3.244 4.122 16.865) 17.662 42.139 ( -3.110 3.900 6.237) 7.986 42.577 ( -3.602 -14.772 13.272) 20.182 42.955 ( 6.755 -7.540 -9.971) 14.209 43.683 ( 6.687 -20.505 6.561) 22.544 44.317 ( -7.674 -12.227 -21.625) 26.000 45.389 ( 7.082 8.812 -2.849) 11.658 48.038 ( -0.019 0.156 1.133) 1.144 48.283 ( -0.009 -0.014 0.308) 0.308 ======================= Grid point 152 (87/125) ======================= q-point: (-0.11 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.832 ( 12.199 -35.349 -14.708) 40.183 2.045 ( 1.622 -37.412 -17.873) 41.494 4.042 ( 25.566 -58.831 -36.957) 74.031 5.323 ( -19.543 6.823 -0.212) 20.701 5.494 ( 6.212 8.782 6.087) 12.360 5.709 ( 7.247 1.196 0.426) 7.357 6.920 ( -5.484 12.970 6.613) 15.557 7.333 ( -1.065 3.590 -0.922) 3.857 7.416 ( 5.976 9.217 0.733) 11.009 7.667 ( -4.197 3.917 -3.628) 6.791 8.006 ( -2.338 5.208 6.751) 8.841 8.299 ( -1.852 3.248 4.213) 5.633 8.548 ( -1.912 0.246 0.110) 1.930 9.144 ( -4.250 5.617 -14.021) 15.691 9.434 ( -4.772 14.593 5.505) 16.311 9.539 ( -5.970 -1.958 11.765) 13.338 9.990 ( -6.420 -1.961 17.181) 18.446 10.147 ( 11.457 -3.530 2.279) 12.203 10.616 ( -3.630 4.934 -3.649) 7.130 11.001 ( 5.339 12.488 -10.155) 16.958 11.363 ( 1.507 -5.877 5.929) 8.484 11.569 ( -5.856 -11.763 7.199) 14.983 11.738 ( -2.195 -8.590 -3.756) 9.629 11.972 ( 7.686 3.430 -3.725) 9.204 16.104 ( -5.032 12.513 11.946) 18.017 16.354 ( -0.022 -4.216 -1.861) 4.608 16.553 ( 7.460 -12.027 0.155) 14.154 17.668 ( -4.458 9.021 9.977) 14.170 17.788 ( -1.444 8.682 2.450) 9.136 18.977 ( -3.735 25.546 8.882) 27.303 23.026 ( 2.879 -10.056 -0.019) 10.460 23.527 ( 1.301 -16.944 -12.549) 21.125 23.860 ( -0.806 -4.536 -5.445) 7.132 24.490 ( 5.283 5.908 -0.662) 7.954 24.729 ( 1.179 1.198 6.060) 6.289 25.203 ( -2.213 -0.972 -1.177) 2.689 25.297 ( 5.703 -13.401 7.543) 16.402 25.419 ( -0.500 -3.945 -3.643) 5.393 27.091 ( 1.428 19.365 9.946) 21.817 27.419 ( -20.449 19.070 -10.797) 29.974 28.110 ( -2.793 1.842 7.984) 8.657 28.605 ( -2.058 -5.710 1.194) 6.186 28.958 ( 13.693 -3.700 -8.902) 16.746 29.273 ( 8.736 1.034 6.551) 10.969 29.485 ( -0.621 -5.662 -0.532) 5.721 30.343 ( -5.006 0.973 0.718) 5.150 30.472 ( 0.107 -4.070 -0.953) 4.181 31.062 ( -1.071 -3.137 4.595) 5.666 39.638 ( 2.963 22.967 -8.198) 24.566 40.051 ( -15.816 14.434 14.894) 26.083 41.163 ( 11.405 4.825 -11.993) 17.240 41.668 ( 2.503 2.709 21.655) 21.966 42.175 ( -3.202 11.403 -1.123) 11.897 42.497 ( -12.402 -2.514 4.395) 13.396 42.871 ( 4.583 -11.301 -3.162) 12.599 43.667 ( -7.448 -24.247 11.240) 27.744 43.942 ( 12.342 -10.689 -20.012) 25.828 45.472 ( 3.231 5.837 -7.290) 9.882 48.051 ( -0.155 0.315 0.894) 0.960 48.286 ( -0.147 0.049 0.327) 0.362 ======================= Grid point 182 (88/125) ======================= q-point: ( 0.22 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.148 ( 0.000 -0.000 38.078) 38.078 3.148 ( 0.000 -0.000 38.078) 38.078 4.879 ( 0.000 -0.000 45.066) 45.066 5.116 ( -0.000 0.000 -6.973) 6.973 5.876 ( 0.000 -0.000 1.280) 1.280 5.876 ( -0.000 0.000 1.280) 1.280 7.124 ( -0.000 0.000 -6.354) 6.354 7.124 ( -0.000 0.000 -6.354) 6.354 7.566 ( -0.000 0.000 -0.109) 0.109 7.878 ( 0.000 -0.000 -1.979) 1.979 7.878 ( -0.000 0.000 -1.979) 1.979 8.269 ( -0.000 0.000 -4.263) 4.263 8.409 ( -0.000 0.000 -0.524) 0.524 8.660 ( -0.000 0.000 -15.340) 15.340 8.660 ( -0.000 0.000 -15.340) 15.340 9.973 ( -0.000 0.000 -4.158) 4.158 9.973 ( -0.000 0.000 -4.158) 4.158 10.320 ( 0.000 -0.000 17.109) 17.109 10.394 ( -0.000 0.000 -5.925) 5.925 10.394 ( -0.000 0.000 -5.925) 5.925 11.507 ( 0.000 -0.000 4.913) 4.913 11.532 ( 0.000 -0.000 0.807) 0.807 11.532 ( -0.000 0.000 0.807) 0.807 12.172 ( -0.000 0.000 -2.827) 2.827 15.530 ( -0.000 0.000 -20.467) 20.467 16.302 ( 0.000 -0.000 5.356) 5.356 16.302 ( 0.000 -0.000 5.356) 5.356 17.281 ( -0.000 0.000 -12.918) 12.918 17.281 ( -0.000 0.000 -12.918) 12.918 18.315 ( -0.000 0.000 -31.770) 31.770 23.528 ( 0.000 -0.000 11.131) 11.131 23.528 ( 0.000 -0.000 11.131) 11.131 24.401 ( 0.000 -0.000 11.607) 11.607 24.640 ( 0.000 -0.000 1.367) 1.367 24.640 ( 0.000 -0.000 1.367) 1.367 25.196 ( 0.000 0.000 -1.929) 1.929 25.196 ( -0.000 0.000 -1.929) 1.929 25.279 ( 0.000 -0.000 11.896) 11.896 27.430 ( -0.000 0.000 -3.988) 3.988 27.430 ( -0.000 0.000 -3.988) 3.988 27.440 ( -0.000 0.000 -19.526) 19.526 28.717 ( -0.000 0.000 -11.668) 11.668 29.246 ( 0.000 -0.000 5.536) 5.536 29.354 ( 0.000 -0.000 11.020) 11.020 29.354 ( 0.000 -0.000 11.020) 11.020 30.512 ( 0.000 -0.000 1.678) 1.678 30.512 ( 0.000 -0.000 1.678) 1.678 30.608 ( -0.000 0.000 -2.074) 2.074 40.013 ( -0.000 0.000 -17.771) 17.771 40.013 ( -0.000 0.000 -17.771) 17.771 40.750 ( -0.000 0.000 -22.551) 22.551 40.750 ( -0.000 0.000 -22.551) 22.551 41.448 ( 0.000 -0.000 14.689) 14.689 43.011 ( 0.000 -0.000 14.881) 14.881 43.011 ( 0.000 -0.000 14.881) 14.881 44.232 ( 0.000 -0.000 14.398) 14.398 44.232 ( 0.000 -0.000 14.398) 14.398 45.583 ( -0.000 0.000 -9.264) 9.264 47.952 ( -0.000 0.000 -2.030) 2.030 48.275 ( -0.000 0.000 -0.211) 0.211 ======================= Grid point 183 (89/125) ======================= q-point: ( 0.33 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.352 ( -5.703 -7.556 34.908) 36.169 3.867 ( 10.162 15.434 32.371) 37.274 4.922 ( -11.772 -8.360 -6.663) 15.902 5.440 ( 11.383 -1.050 27.296) 29.593 5.604 ( -13.698 -6.457 -0.128) 15.144 6.093 ( 6.727 7.555 1.747) 10.265 6.900 ( -4.064 -5.845 -7.940) 10.664 7.197 ( 3.927 7.543 -6.813) 10.896 7.540 ( -8.242 -8.138 0.144) 11.583 7.628 ( -6.548 7.504 -2.793) 10.344 7.821 ( -1.527 -21.564 -15.612) 26.666 8.262 ( 3.863 11.258 1.023) 11.946 8.362 ( -6.427 -7.532 6.812) 12.019 8.492 ( 0.991 9.372 -10.957) 14.453 8.798 ( 15.385 4.357 1.308) 16.043 9.710 ( -14.387 -6.653 -4.536) 16.487 10.068 ( 4.027 1.632 -1.663) 4.653 10.171 ( -5.470 -1.858 -5.611) 8.053 10.438 ( 1.135 3.154 3.715) 5.003 10.559 ( 8.562 1.032 1.297) 8.721 11.346 ( -6.092 -6.340 -2.233) 9.072 11.631 ( 4.753 0.869 4.034) 6.294 11.714 ( 8.718 10.453 -0.955) 13.645 12.108 ( -3.538 -2.751 -0.825) 4.557 15.316 ( 1.480 0.862 -15.971) 16.062 16.359 ( 1.113 -0.300 5.388) 5.510 16.463 ( 7.137 4.593 6.286) 10.561 17.071 ( -2.848 -1.964 -9.845) 10.435 17.221 ( 2.781 2.676 -9.151) 9.931 17.993 ( 5.093 2.569 -28.338) 28.907 23.555 ( -3.004 0.129 6.600) 7.252 23.742 ( 6.026 0.503 6.574) 8.932 24.428 ( -8.063 -7.378 9.262) 14.325 24.555 ( -6.588 -1.284 -1.175) 6.814 24.742 ( 3.201 4.329 0.771) 5.439 25.131 ( 2.009 -3.058 2.956) 4.704 25.284 ( 2.800 4.169 1.549) 5.255 25.475 ( 6.142 4.855 7.440) 10.801 26.983 ( -13.863 -12.475 -14.163) 23.418 27.280 ( -9.825 -0.415 0.830) 9.869 27.722 ( 21.213 10.758 -7.091) 24.819 28.541 ( -2.158 -0.768 -13.790) 13.979 29.276 ( -3.713 -3.172 6.758) 8.338 29.425 ( -3.305 1.391 9.819) 10.453 29.525 ( 3.650 -1.713 6.331) 7.506 30.461 ( -3.252 -3.381 1.856) 5.045 30.538 ( -1.781 3.169 -0.536) 3.675 30.668 ( 6.926 2.209 -0.592) 7.294 39.538 ( -12.315 -5.222 -16.560) 21.288 40.095 ( 14.702 7.589 -21.216) 26.905 40.373 ( 2.238 -12.217 -16.655) 20.776 40.606 ( -2.758 12.716 -15.987) 20.613 41.712 ( 9.262 3.795 10.684) 14.640 43.059 ( -6.740 -3.370 15.697) 17.412 43.252 ( 0.930 0.351 11.812) 11.854 44.079 ( -15.364 -10.714 12.026) 22.259 44.675 ( 13.178 9.489 11.332) 19.802 45.436 ( -3.391 -2.497 -9.386) 10.287 47.937 ( 0.618 0.315 -1.436) 1.595 48.274 ( 0.077 0.045 -0.071) 0.114 ======================= Grid point 184 (90/125) ======================= q-point: ( 0.44 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.694 ( 5.932 -3.427 28.983) 29.781 4.326 ( -17.819 2.382 12.563) 21.932 4.565 ( -6.667 -2.621 5.986) 9.335 5.255 ( -17.622 -9.317 -1.911) 20.025 5.897 ( 10.646 2.608 7.911) 13.518 6.243 ( 5.916 1.709 4.411) 7.574 6.754 ( 2.717 -5.739 -6.047) 8.769 7.060 ( -12.952 7.560 -19.553) 24.642 7.343 ( 0.438 -28.094 -16.129) 32.398 7.405 ( -7.786 9.832 5.094) 13.536 7.775 ( 11.551 -1.047 3.947) 12.252 8.235 ( -17.115 -1.717 6.226) 18.293 8.446 ( 2.980 6.209 7.093) 9.886 8.531 ( 8.444 5.083 -5.951) 11.513 9.128 ( 13.868 4.504 13.055) 19.571 9.400 ( -13.397 -5.634 -4.655) 15.261 9.959 ( -5.784 -4.962 -3.286) 8.299 10.171 ( 0.456 7.493 -1.812) 7.723 10.522 ( 3.632 5.384 -1.096) 6.586 10.635 ( 4.665 -5.144 -1.945) 7.211 11.226 ( -0.318 -1.488 -3.864) 4.152 11.746 ( 6.293 -2.005 2.968) 7.241 11.883 ( 6.711 9.582 -4.681) 12.601 12.037 ( -4.755 -1.661 3.202) 5.968 15.239 ( 7.032 4.048 -9.665) 12.619 16.437 ( 2.742 -1.960 4.182) 5.371 16.700 ( 9.731 6.603 4.900) 12.740 16.947 ( -2.085 0.989 -4.534) 5.088 17.205 ( 4.839 4.191 -5.832) 8.660 17.838 ( 10.482 4.564 -21.606) 24.444 23.592 ( -1.349 2.641 2.668) 3.989 23.863 ( 4.731 -3.451 3.605) 6.877 24.318 ( -5.961 -7.216 -0.474) 9.372 24.415 ( -12.258 -1.931 3.907) 13.010 24.819 ( 3.610 2.271 -0.668) 4.317 25.238 ( 6.482 -1.464 5.519) 8.638 25.372 ( 0.152 4.815 3.071) 5.713 25.671 ( 4.744 6.733 4.089) 9.196 26.556 ( -11.464 -11.661 -9.416) 18.870 27.166 ( -10.482 0.154 3.845) 11.166 27.987 ( 15.888 6.487 -8.130) 18.990 28.368 ( 3.439 1.853 -13.011) 13.584 29.255 ( -5.099 -5.053 5.526) 9.059 29.501 ( -4.114 3.948 7.788) 9.652 29.561 ( 0.010 -7.457 1.559) 7.619 30.429 ( -2.956 0.165 1.689) 3.408 30.543 ( 1.624 1.484 -0.120) 2.203 30.772 ( 4.181 2.527 1.083) 5.004 39.201 ( -5.906 -1.009 -14.191) 15.404 39.983 ( 7.090 -0.811 -21.635) 22.782 40.258 ( 10.274 -4.352 -12.614) 16.841 40.592 ( 5.659 17.465 -8.845) 20.379 41.967 ( 7.271 3.850 6.736) 10.633 43.125 ( -6.919 -3.057 15.007) 16.805 43.336 ( -4.614 -2.184 8.851) 10.218 43.938 ( -11.937 -11.124 12.390) 20.488 45.003 ( 8.269 7.890 6.138) 12.973 45.229 ( -6.406 -4.925 -8.874) 12.001 47.942 ( 1.319 0.670 -0.637) 1.611 48.277 ( 0.219 0.129 0.090) 0.270 ======================= Grid point 185 (91/125) ======================= q-point: (-0.44 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.770 ( -32.229 -22.191 0.114) 39.130 4.147 ( 13.595 1.148 19.490) 23.791 4.624 ( -23.447 -6.619 3.920) 24.676 5.060 ( -9.139 17.291 10.690) 22.289 5.942 ( -4.387 -5.846 -2.252) 7.648 6.289 ( -1.646 -15.402 -4.666) 16.177 6.660 ( -6.292 8.872 -21.051) 23.695 6.797 ( 9.136 -0.198 1.656) 9.287 7.052 ( 9.122 -22.242 -10.615) 26.279 7.517 ( -1.867 15.634 4.951) 16.505 7.990 ( 11.280 -2.412 3.723) 12.121 8.035 ( -19.158 -3.818 10.758) 22.302 8.600 ( 5.724 -2.351 -2.480) 6.667 8.632 ( 2.576 9.068 7.717) 12.182 9.175 ( -6.048 1.170 -5.696) 8.390 9.550 ( 13.180 2.898 19.174) 23.447 9.821 ( -3.386 -1.741 -4.106) 5.600 10.185 ( -3.679 6.113 -1.177) 7.231 10.549 ( 2.281 1.055 -12.507) 12.757 10.609 ( 1.929 -1.052 1.602) 2.719 11.231 ( 5.139 1.842 -1.908) 5.783 11.839 ( 5.199 -2.262 1.045) 5.766 11.903 ( 3.689 -6.468 -3.788) 8.354 12.053 ( -4.649 9.927 2.538) 11.251 15.342 ( 12.773 7.512 -5.351) 15.754 16.499 ( 3.254 -4.237 3.102) 6.178 16.854 ( -1.489 6.594 -2.141) 7.091 17.002 ( 9.385 4.441 5.406) 11.706 17.293 ( 8.977 5.948 -3.776) 11.411 17.828 ( 13.686 5.912 -15.802) 21.725 23.612 ( -2.992 3.946 0.533) 4.980 23.916 ( 2.354 -7.696 4.722) 9.331 24.185 ( -1.696 -0.656 -5.269) 5.574 24.271 ( -13.223 -6.624 7.062) 16.389 24.850 ( 3.678 1.260 -5.756) 6.947 25.364 ( 6.019 -5.035 3.846) 8.740 25.417 ( -4.933 4.543 2.532) 7.168 25.802 ( 0.466 6.585 2.140) 6.939 26.321 ( -1.908 -5.194 0.415) 5.549 27.078 ( -10.337 3.814 3.353) 11.517 27.985 ( 4.718 -3.103 -12.983) 14.158 28.464 ( 17.066 7.692 -6.565) 19.837 29.183 ( -5.353 -6.270 2.519) 8.620 29.441 ( -5.423 -10.316 -1.275) 11.724 29.572 ( -4.079 6.732 5.376) 9.532 30.404 ( -2.032 0.190 -0.124) 2.044 30.615 ( 4.466 1.087 1.579) 4.860 30.849 ( 1.018 2.053 3.333) 4.045 39.024 ( 1.034 1.906 -10.510) 10.731 39.865 ( 9.548 4.023 -19.658) 22.221 40.248 ( 8.999 -1.736 -5.801) 10.847 40.797 ( 15.737 16.001 -6.759) 23.439 42.124 ( 1.722 4.653 2.895) 5.745 43.147 ( -8.744 -5.403 12.119) 15.891 43.318 ( -7.850 -1.824 5.869) 9.969 43.882 ( -6.769 -11.452 16.182) 20.949 44.964 ( -10.533 -4.831 -8.661) 14.467 45.179 ( 4.400 3.154 1.053) 5.515 47.968 ( 1.807 1.014 0.075) 2.074 48.283 ( 0.276 0.158 0.123) 0.341 ======================= Grid point 186 (92/125) ======================= q-point: (-0.33 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.152 ( -36.271 -19.410 8.807) 42.070 4.056 ( -40.053 -10.829 -4.661) 41.752 4.580 ( 19.867 -0.600 10.919) 22.678 5.295 ( -7.207 25.013 11.290) 28.374 5.648 ( -26.496 -22.926 8.467) 36.047 5.924 ( -2.514 -15.831 -16.731) 23.170 6.572 ( 8.543 6.592 -12.893) 16.813 6.911 ( 13.828 -11.004 -7.687) 19.271 7.047 ( 11.363 0.197 2.335) 11.602 7.663 ( -1.468 10.775 1.153) 10.935 7.887 ( -15.715 4.134 13.298) 20.997 8.191 ( 11.968 -5.923 3.795) 13.882 8.570 ( 1.746 -6.268 -4.688) 8.019 8.821 ( 0.618 10.475 4.470) 11.405 9.159 ( 5.047 5.837 0.983) 7.778 9.714 ( -1.422 0.140 -5.990) 6.158 9.920 ( 4.637 -0.893 9.534) 10.639 10.222 ( 4.764 6.218 7.011) 10.512 10.394 ( -1.304 2.143 -14.675) 14.888 10.642 ( -0.186 1.594 0.440) 1.664 11.322 ( 7.589 0.719 -1.349) 7.741 11.823 ( -1.626 -4.776 -1.426) 5.243 11.873 ( 4.308 -5.486 -4.518) 8.311 12.090 ( -5.562 7.707 3.824) 10.245 15.555 ( 15.470 9.558 -5.397) 18.969 16.520 ( -0.428 -3.868 2.357) 4.550 16.843 ( -3.487 1.942 0.209) 3.997 17.259 ( 11.775 6.162 3.867) 13.841 17.422 ( 8.689 5.958 -4.751) 11.557 17.965 ( 20.084 10.014 -10.522) 24.787 23.556 ( -9.241 1.880 -0.837) 9.467 23.919 ( -1.568 -10.359 7.438) 12.848 24.112 ( -11.377 -5.942 5.380) 13.917 24.161 ( 4.626 0.769 -3.076) 5.608 24.802 ( 1.689 3.204 -10.929) 11.514 25.340 ( -0.676 -5.148 -4.226) 6.695 25.441 ( -4.866 -0.410 9.490) 10.672 25.822 ( -5.315 3.471 0.005) 6.348 26.420 ( 9.062 -2.747 7.833) 12.289 27.051 ( -5.546 16.125 0.430) 17.057 27.892 ( 9.329 -7.164 -10.462) 15.741 28.697 ( 15.170 6.749 -3.684) 17.007 29.072 ( -6.104 -3.477 -1.072) 7.106 29.234 ( -6.704 -11.609 -2.806) 13.697 29.620 ( -4.663 6.336 3.461) 8.594 30.386 ( -0.790 0.407 0.434) 0.989 30.664 ( -0.227 -0.733 0.081) 0.772 30.934 ( 3.206 0.620 4.256) 5.365 39.013 ( 7.524 4.051 -5.469) 10.146 39.836 ( 9.716 13.187 -20.294) 26.080 40.376 ( 13.695 -2.914 4.590) 14.735 41.096 ( 20.291 13.737 -6.930) 25.465 42.160 ( -4.430 6.315 -0.425) 7.725 43.085 ( -10.928 -6.020 8.974) 15.369 43.219 ( -9.041 -4.167 0.630) 9.975 43.938 ( -2.894 -12.784 19.714) 23.674 44.655 ( -15.411 -2.981 -7.146) 17.247 45.227 ( 3.382 -1.307 -1.831) 4.062 48.005 ( 1.739 1.115 0.279) 2.085 48.288 ( 0.152 0.077 -0.041) 0.176 ======================= Grid point 187 (93/125) ======================= q-point: (-0.22 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.717 ( -35.925 -9.442 24.575) 44.539 3.284 ( -48.181 -9.638 -4.850) 49.374 4.924 ( 21.169 -4.527 1.412) 21.694 5.114 ( -35.202 -35.681 21.603) 54.580 5.506 ( -9.115 21.892 6.949) 24.711 5.644 ( 4.454 -10.651 -13.376) 17.669 6.643 ( 11.726 8.388 -9.930) 17.506 6.968 ( 17.508 -6.912 -6.196) 19.817 7.239 ( 7.310 4.971 1.891) 9.040 7.660 ( -4.118 -1.223 3.989) 5.862 7.979 ( -3.702 12.475 6.738) 14.653 8.272 ( 3.013 -4.266 -2.790) 5.922 8.503 ( 5.192 -5.759 -3.457) 8.490 8.961 ( 3.428 8.420 5.594) 10.675 9.366 ( 5.113 10.335 4.581) 12.407 9.586 ( 0.741 -1.240 -12.970) 13.050 9.963 ( -1.384 0.516 2.716) 3.092 10.165 ( -3.237 0.793 -17.873) 18.181 10.579 ( 13.116 -2.424 8.780) 15.969 10.666 ( -1.021 7.805 7.906) 11.156 11.377 ( 4.591 -2.350 -4.379) 6.766 11.724 ( -2.986 -4.550 -4.578) 7.111 11.812 ( 1.406 -2.954 -3.294) 4.643 12.100 ( -8.362 4.372 5.059) 10.706 15.762 ( 14.512 9.435 -9.229) 19.617 16.491 ( -4.171 -2.523 3.246) 5.856 16.760 ( -6.791 -4.253 -0.939) 8.067 17.478 ( 8.039 7.211 -5.995) 12.352 17.530 ( 10.317 4.044 -0.761) 11.108 18.293 ( 25.648 14.059 -6.808) 30.030 23.361 ( -14.251 -2.448 -2.407) 14.659 23.879 ( -7.341 -11.513 11.105) 17.600 24.007 ( -7.694 -4.198 6.338) 10.816 24.233 ( 9.326 1.418 -3.825) 10.180 24.723 ( -0.093 6.956 -9.890) 12.091 25.235 ( -0.093 -4.790 -5.403) 7.221 25.455 ( -7.697 -3.147 9.436) 12.577 25.722 ( -11.559 1.426 0.927) 11.684 26.602 ( 13.652 -5.693 1.260) 14.845 27.259 ( 4.933 28.506 3.850) 29.185 27.883 ( 13.317 -9.466 -7.424) 17.946 28.876 ( 1.691 7.029 -4.142) 8.332 28.921 ( -7.246 -1.134 1.919) 7.581 29.058 ( 3.341 -12.076 -4.396) 13.279 29.616 ( -4.865 2.289 0.973) 5.464 30.400 ( -0.970 2.525 1.682) 3.185 30.609 ( -5.176 -2.154 0.357) 5.618 31.017 ( 4.697 -2.863 0.086) 5.501 39.168 ( 13.326 5.918 -0.021) 14.581 39.860 ( 9.519 18.832 -20.019) 29.086 40.694 ( 17.582 -0.897 14.085) 22.546 41.368 ( 17.374 9.321 -10.779) 22.471 42.129 ( -4.764 7.825 -1.188) 9.238 42.930 ( -17.535 4.347 -4.860) 18.708 43.038 ( -4.784 -17.589 5.034) 18.910 43.987 ( -2.845 -19.748 10.051) 22.341 44.353 ( -20.510 4.603 2.975) 21.230 45.259 ( 6.809 -3.861 0.772) 7.866 48.034 ( 1.050 0.753 -0.220) 1.310 48.287 ( -0.014 -0.015 -0.254) 0.255 ======================= Grid point 192 (94/125) ======================= q-point: ( 0.33 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.723 ( -3.914 -12.557 31.342) 33.990 4.239 ( 7.860 15.785 27.955) 33.052 4.921 ( -1.930 -6.289 -2.900) 7.189 5.469 ( -2.062 -22.609 -2.124) 22.802 5.776 ( 1.697 11.132 15.280) 18.981 6.127 ( -0.759 15.965 -2.793) 16.226 6.770 ( -3.075 -13.352 -6.470) 15.153 7.091 ( 5.113 -3.353 -8.906) 10.803 7.355 ( -0.782 -15.954 -11.644) 19.767 7.637 ( -3.007 0.583 3.768) 4.856 7.922 ( -15.737 7.983 -9.919) 20.242 8.089 ( 15.686 3.619 -9.874) 18.885 8.284 ( 3.977 -8.371 8.191) 12.369 8.707 ( -4.344 12.741 -1.118) 13.508 8.789 ( 0.947 4.711 19.409) 19.995 9.716 ( -0.451 -8.183 -4.356) 9.282 10.029 ( 1.909 8.059 -2.588) 8.677 10.088 ( -0.071 -9.750 -4.282) 10.649 10.418 ( 2.277 9.044 -7.086) 11.713 10.623 ( -3.013 -0.980 8.096) 8.694 11.396 ( -4.613 -5.870 -2.033) 7.737 11.452 ( 3.456 -6.545 -2.388) 7.777 11.799 ( 1.335 13.909 0.483) 13.981 12.114 ( -0.172 -1.073 0.831) 1.368 15.138 ( 0.008 1.964 -12.497) 12.651 16.434 ( -1.535 0.926 4.763) 5.090 16.522 ( 0.940 5.886 6.306) 8.678 16.941 ( -0.121 -7.563 -5.633) 9.431 17.179 ( 1.265 8.355 -4.543) 9.594 17.669 ( -0.683 8.288 -25.544) 26.864 23.586 ( 1.112 -8.106 5.427) 9.818 23.806 ( -1.825 4.675 2.173) 5.469 24.447 ( -1.437 -13.362 -5.054) 14.358 24.596 ( 1.230 -7.297 9.239) 11.837 24.748 ( 1.340 4.609 0.853) 4.875 25.167 ( -3.420 0.997 4.367) 5.635 25.339 ( 2.968 11.885 0.784) 12.275 25.567 ( 0.731 6.018 7.852) 9.920 26.830 ( -2.861 -12.244 -12.390) 17.653 27.427 ( 15.340 0.903 -1.826) 15.475 27.519 ( -12.972 10.343 -1.057) 16.624 28.355 ( -0.004 -3.738 -15.732) 16.170 29.349 ( -0.426 -5.686 5.912) 8.213 29.517 ( 1.906 -5.118 7.534) 9.305 29.619 ( -2.511 2.814 7.780) 8.646 30.498 ( -1.740 0.273 0.800) 1.934 30.575 ( 8.187 2.593 0.121) 8.589 30.607 ( -5.642 3.970 -2.506) 7.340 39.314 ( 0.886 -15.938 -15.585) 22.309 39.825 ( 0.016 6.940 -22.555) 23.598 40.153 ( -5.342 -0.156 -10.944) 12.180 40.504 ( 4.873 16.902 -16.353) 24.018 41.844 ( -0.175 5.132 11.831) 12.898 43.185 ( 0.459 -13.584 15.178) 20.374 43.431 ( -0.102 4.625 10.115) 11.123 44.193 ( -1.619 -20.067 10.229) 22.581 44.810 ( 1.381 17.612 7.987) 19.388 45.333 ( -0.339 -1.917 -9.297) 9.498 47.923 ( -0.025 0.556 -0.750) 0.934 48.273 ( -0.000 0.172 -0.061) 0.182 ======================= Grid point 193 (95/125) ======================= q-point: ( 0.44 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.932 ( -0.833 -8.179 25.613) 26.900 4.619 ( -19.736 -14.425 -1.727) 24.506 4.806 ( 5.912 15.989 20.722) 26.833 5.292 ( -1.997 -16.169 2.598) 16.498 5.981 ( -3.875 10.352 3.327) 11.543 6.166 ( 4.456 8.715 -10.422) 14.298 6.593 ( 2.431 -11.875 -1.419) 12.204 6.856 ( 2.980 -29.763 -15.606) 33.739 7.099 ( -11.729 7.134 -14.033) 19.632 7.675 ( 5.614 -2.103 3.754) 7.073 7.720 ( -12.253 10.087 3.736) 16.305 8.242 ( 15.125 -8.359 0.205) 17.282 8.485 ( 3.691 9.088 3.311) 10.353 8.639 ( -11.213 9.907 4.516) 15.629 9.159 ( 10.303 -2.353 18.657) 21.443 9.495 ( -11.872 -1.866 -4.465) 12.820 9.929 ( -3.912 -7.904 -2.984) 9.310 10.179 ( 7.782 12.453 -4.314) 15.305 10.458 ( 4.713 7.789 -6.882) 11.412 10.612 ( -5.062 -7.311 5.460) 10.435 11.211 ( -5.508 -3.133 -2.291) 6.738 11.518 ( 13.768 -7.821 -3.860) 16.298 11.885 ( 0.175 6.031 -2.284) 6.451 12.144 ( -1.495 5.949 3.107) 6.876 15.079 ( 5.179 4.684 -7.639) 10.349 16.445 ( -0.585 -2.798 2.394) 3.729 16.694 ( 6.337 6.104 3.848) 9.603 16.889 ( 3.442 -2.837 0.693) 4.514 17.212 ( -2.281 10.916 -3.023) 11.554 17.530 ( 6.878 10.405 -17.781) 21.720 23.607 ( 2.026 -5.193 3.727) 6.705 23.829 ( 1.318 -2.617 2.011) 3.554 24.245 ( -1.566 -11.591 -6.858) 13.559 24.577 ( -6.636 -9.277 6.884) 13.323 24.807 ( 0.124 6.005 -1.390) 6.165 25.210 ( 2.026 -0.967 3.164) 3.879 25.499 ( 1.131 11.811 4.147) 12.569 25.741 ( 2.770 9.178 5.424) 11.015 26.529 ( -9.742 -4.871 -8.278) 13.681 27.378 ( -10.966 0.500 4.237) 11.767 27.697 ( 17.409 4.634 -5.976) 18.980 28.136 ( 2.804 -4.547 -15.582) 16.473 29.320 ( -3.398 -9.360 4.232) 10.820 29.552 ( -1.008 -5.825 4.204) 7.254 29.686 ( -4.105 3.411 7.513) 9.216 30.485 ( -3.996 2.365 -1.787) 4.975 30.546 ( -0.674 2.419 -0.336) 2.534 30.725 ( 7.982 4.190 0.410) 9.024 39.029 ( -0.576 -9.980 -12.761) 16.211 39.620 ( 5.876 -5.179 -17.904) 19.542 40.077 ( 1.871 12.089 -9.226) 15.322 40.542 ( 4.703 21.347 -13.353) 25.615 42.032 ( 3.233 3.275 9.260) 10.341 43.246 ( -0.426 -15.763 14.313) 21.296 43.526 ( -4.494 2.085 7.125) 8.678 44.086 ( -6.746 -17.530 10.751) 21.642 45.045 ( 4.307 10.334 1.694) 11.323 45.189 ( -4.721 1.079 -7.124) 8.615 47.929 ( 0.793 0.749 0.047) 1.091 48.276 ( 0.183 0.258 -0.042) 0.319 ======================= Grid point 194 (96/125) ======================= q-point: (-0.44 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.092 ( -19.174 -13.164 10.095) 25.355 4.228 ( -4.994 -5.486 11.691) 13.846 4.932 ( -19.943 -8.766 5.247) 22.407 5.352 ( 7.098 6.851 10.497) 14.405 5.916 ( -8.930 4.651 -6.753) 12.123 6.110 ( 2.365 -6.658 -11.033) 13.101 6.440 ( 3.566 -15.383 -16.505) 22.842 6.697 ( 12.198 -4.552 0.514) 13.029 6.828 ( -13.030 5.192 -5.909) 15.220 7.760 ( -5.461 13.118 4.567) 14.925 7.838 ( 11.347 -5.874 7.006) 14.572 8.353 ( 5.370 -14.839 7.207) 17.348 8.438 ( -11.635 4.950 0.027) 12.644 8.789 ( 1.963 13.635 5.514) 14.838 9.173 ( -5.553 -6.758 -3.635) 9.472 9.611 ( 10.637 2.150 13.146) 17.047 9.786 ( -2.729 -4.461 -3.092) 6.075 10.288 ( 2.588 11.571 -6.894) 13.715 10.432 ( -5.610 -0.103 -2.067) 5.980 10.588 ( 2.447 1.317 0.198) 2.786 11.153 ( 2.206 -0.992 -1.821) 3.028 11.613 ( 13.577 -6.661 -2.608) 15.346 11.868 ( -1.326 0.176 -2.234) 2.604 12.208 ( -2.787 8.108 1.905) 8.783 15.172 ( 10.706 7.424 -4.507) 13.785 16.467 ( 2.562 -3.757 4.044) 6.086 16.837 ( 5.543 3.000 -2.015) 6.617 16.997 ( 6.465 2.028 6.020) 9.064 17.238 ( 0.743 13.594 -6.000) 14.878 17.571 ( 9.114 9.039 -9.032) 15.695 23.644 ( 1.668 -0.023 1.284) 2.105 23.869 ( 3.906 -9.171 6.839) 12.089 24.074 ( 0.658 -7.132 -7.714) 10.527 24.450 ( -10.334 -9.896 5.654) 15.384 24.807 ( -1.964 7.172 -5.312) 9.139 25.246 ( 3.369 -5.140 -0.197) 6.149 25.648 ( -2.752 11.188 6.976) 13.468 25.874 ( -0.502 4.602 2.515) 5.269 26.361 ( -4.802 4.828 -0.190) 6.812 27.284 ( -9.699 2.139 2.075) 10.147 27.705 ( 3.951 -9.857 -11.845) 15.908 28.162 ( 19.673 5.448 -7.987) 21.920 29.218 ( -4.743 -10.052 2.285) 11.347 29.487 ( -7.642 -4.018 1.937) 8.849 29.744 ( -3.442 4.544 5.273) 7.766 30.403 ( -1.813 -1.313 -3.294) 3.983 30.599 ( 2.130 2.893 1.219) 3.794 30.857 ( 4.628 3.295 1.406) 5.852 38.865 ( 3.138 -4.153 -7.822) 9.395 39.514 ( 10.659 -1.363 -14.837) 18.320 40.139 ( 4.704 12.646 -4.852) 14.338 40.679 ( 9.302 22.468 -10.104) 26.333 42.182 ( 2.161 2.385 4.889) 5.853 43.238 ( -2.690 -19.439 11.620) 22.807 43.514 ( -8.309 1.426 3.225) 9.026 44.022 ( -3.767 -15.716 14.140) 21.474 44.996 ( -7.341 -1.917 -3.979) 8.567 45.170 ( -0.092 8.985 -4.722) 10.151 47.957 ( 1.490 0.973 0.636) 1.890 48.281 ( 0.308 0.242 -0.097) 0.403 ======================= Grid point 195 (97/125) ======================= q-point: (-0.33 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.711 ( -32.899 -7.001 16.116) 37.298 4.380 ( -1.241 -7.787 1.332) 7.997 4.525 ( -21.799 -8.192 5.132) 23.846 5.466 ( 7.992 -17.580 -14.027) 23.868 5.785 ( -11.308 21.121 5.054) 24.485 5.899 ( -12.600 -13.942 2.604) 18.972 6.320 ( 11.657 -2.695 -11.544) 16.626 6.628 ( -1.372 1.974 -6.787) 7.200 6.950 ( 11.401 2.527 5.626) 12.962 7.830 ( -5.658 10.038 2.800) 11.858 8.031 ( 11.434 -7.721 6.754) 15.361 8.287 ( -15.157 -0.590 11.801) 19.218 8.352 ( 4.521 -11.446 -6.480) 13.908 8.952 ( -0.554 9.338 1.794) 9.525 9.128 ( 5.726 0.468 3.960) 6.977 9.602 ( -0.082 -0.652 -13.726) 13.742 9.928 ( 8.721 -7.420 8.286) 14.134 10.268 ( -3.711 9.735 -9.200) 13.899 10.382 ( -1.459 0.094 5.077) 5.284 10.656 ( 1.804 8.387 0.711) 8.608 11.187 ( 6.221 -1.935 -1.637) 6.717 11.701 ( 7.784 -1.891 -3.907) 8.912 11.812 ( -1.931 -2.076 -1.594) 3.253 12.241 ( -3.078 4.942 2.310) 6.264 15.359 ( 13.288 8.712 -4.832) 16.608 16.536 ( 1.144 -2.239 5.838) 6.357 16.854 ( 1.470 -0.652 -4.432) 4.714 17.204 ( 9.286 3.214 5.202) 11.119 17.315 ( 4.818 11.850 -6.404) 14.305 17.717 ( 13.431 11.071 -5.065) 18.127 23.657 ( -3.907 1.959 -0.404) 4.389 23.931 ( 2.307 -11.107 7.398) 13.543 23.980 ( 4.837 -4.517 -4.114) 7.793 24.291 ( -9.281 -8.108 4.725) 13.198 24.753 ( -3.053 8.560 -7.818) 11.988 25.212 ( 1.294 -5.858 -3.122) 6.763 25.758 ( -10.048 9.197 11.118) 17.583 25.873 ( -0.530 0.847 -1.135) 1.512 26.420 ( 0.373 -0.136 5.717) 5.731 27.203 ( -2.321 11.073 -7.788) 13.736 27.575 ( 6.514 -12.604 -3.046) 14.511 28.424 ( 20.422 7.889 -7.024) 22.992 29.099 ( -4.654 -8.014 1.670) 9.417 29.332 ( -12.705 -0.877 -0.022) 12.735 29.768 ( -5.298 3.756 2.494) 6.956 30.367 ( 2.964 -3.416 -0.216) 4.528 30.649 ( 1.633 0.981 -0.624) 2.005 30.932 ( 1.300 0.469 1.434) 1.991 38.868 ( 7.909 0.667 -2.342) 8.275 39.528 ( 13.050 7.271 -15.993) 21.885 40.322 ( 8.876 11.182 4.745) 15.044 40.911 ( 13.389 21.156 -8.059) 26.302 42.233 ( -1.202 2.281 -0.871) 2.722 43.145 ( -3.470 -22.849 9.385) 24.944 43.376 ( -13.061 0.180 -2.625) 13.324 44.041 ( -1.435 -16.635 14.486) 22.105 44.839 ( -13.219 3.786 1.290) 13.811 45.139 ( 1.375 1.736 -7.025) 7.366 47.995 ( 1.574 0.987 0.567) 1.942 48.284 ( 0.232 0.112 -0.226) 0.343 ======================= Grid point 196 (98/125) ======================= q-point: (-0.22 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.501 ( -30.780 2.047 26.323) 40.552 3.843 ( -43.237 -4.443 -0.314) 43.466 4.582 ( 15.547 -9.344 -3.057) 18.395 5.198 ( 10.099 -20.679 -18.174) 29.324 5.586 ( -27.400 -22.253 18.693) 39.942 5.928 ( -8.867 20.717 8.042) 23.927 6.405 ( 15.848 5.957 -9.870) 19.597 6.647 ( 9.759 2.605 -3.841) 10.806 7.179 ( 9.486 4.722 2.209) 10.824 7.804 ( -10.146 0.981 4.270) 11.051 8.111 ( 0.069 -6.050 -1.837) 6.323 8.254 ( 6.332 -4.483 -6.478) 10.107 8.321 ( -1.055 0.176 12.642) 12.688 8.990 ( 2.307 -1.367 -1.386) 3.019 9.356 ( 12.216 0.372 5.017) 13.212 9.441 ( -1.045 9.323 -12.348) 15.508 9.943 ( 3.094 -11.133 -5.202) 12.672 10.147 ( -9.640 10.581 -7.340) 16.087 10.454 ( 4.070 -6.929 4.420) 9.171 10.847 ( 4.674 13.030 8.512) 16.250 11.227 ( 4.853 -2.454 -2.717) 6.079 11.680 ( 0.219 0.534 -7.462) 7.485 11.751 ( -1.821 -2.268 -1.188) 3.142 12.266 ( -3.337 2.425 3.908) 5.683 15.536 ( 12.170 8.023 -7.827) 16.545 16.578 ( -3.079 -0.983 5.331) 6.234 16.772 ( -2.333 -3.153 -4.966) 6.329 17.366 ( 2.727 8.090 -8.011) 11.707 17.415 ( 10.613 1.690 2.439) 11.020 18.022 ( 20.539 14.784 -2.887) 25.471 23.507 ( -13.002 -1.540 -3.386) 13.523 23.969 ( 7.066 -0.303 -1.958) 7.338 23.992 ( -2.254 -10.507 8.234) 13.538 24.211 ( -3.230 -4.392 5.551) 7.781 24.691 ( -1.326 9.085 -8.934) 12.811 25.136 ( -0.390 -3.165 -3.309) 4.596 25.734 ( -12.357 -3.217 9.093) 15.676 25.892 ( -6.633 8.043 2.307) 10.677 26.442 ( 3.996 -8.485 2.872) 9.808 27.243 ( 13.645 1.841 -11.204) 17.751 27.652 ( 7.344 5.461 5.034) 10.445 28.660 ( 16.748 7.742 -8.895) 20.483 29.014 ( -3.219 -5.100 3.058) 6.761 29.138 ( -15.256 2.049 0.506) 15.402 29.711 ( -6.834 0.320 -0.076) 6.842 30.423 ( 4.516 -1.995 3.565) 6.089 30.635 ( -1.115 -1.555 -1.905) 2.700 30.934 ( 0.028 -3.487 -0.478) 3.519 39.031 ( 12.539 4.245 1.674) 13.344 39.593 ( 12.837 14.616 -18.958) 27.163 40.698 ( 14.778 11.069 15.555) 24.143 41.171 ( 12.264 18.288 -7.117) 23.141 42.168 ( -2.892 1.327 -7.153) 7.829 42.962 ( -7.620 -22.203 -1.576) 23.527 43.137 ( -12.562 -3.938 1.025) 13.205 43.976 ( -6.784 -17.468 4.836) 19.353 44.743 ( -14.499 6.480 9.701) 18.610 45.133 ( 6.343 -1.733 -1.657) 6.781 48.023 ( 0.940 0.620 -0.228) 1.149 48.283 ( 0.052 -0.046 -0.282) 0.291 ======================= Grid point 201 (99/125) ======================= q-point: ( 0.33 0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.042 ( -2.979 -4.751 26.899) 27.477 4.502 ( 6.692 -1.913 16.128) 17.566 4.753 ( 15.340 -3.330 3.681) 16.123 5.193 ( 5.338 -24.006 -5.342) 25.166 5.996 ( -0.360 14.216 2.220) 14.393 6.271 ( -6.479 11.311 -2.940) 13.362 6.625 ( -3.522 -10.144 -14.852) 18.327 6.818 ( 2.617 -14.568 -2.011) 14.938 7.235 ( -5.409 -5.988 -4.674) 9.325 7.613 ( 23.043 8.368 -12.212) 27.389 7.828 ( -10.409 7.160 4.481) 13.405 8.169 ( -7.776 -5.148 0.218) 9.329 8.297 ( -1.122 0.055 6.907) 6.998 8.776 ( 6.785 8.907 6.891) 13.148 9.146 ( -9.551 -2.753 15.989) 18.827 9.537 ( 10.843 -0.243 0.288) 10.850 9.944 ( 2.913 -6.350 -4.378) 8.245 10.070 ( -3.104 4.546 -2.978) 6.258 10.395 ( -2.899 3.926 -6.852) 8.412 10.715 ( 0.294 0.474 2.703) 2.760 11.206 ( 5.518 -2.572 -5.699) 8.338 11.550 ( -15.994 -8.474 -1.115) 18.134 11.875 ( 0.298 9.163 -1.586) 9.304 12.124 ( 3.091 3.284 2.789) 5.303 15.078 ( -5.134 4.618 -7.716) 10.355 16.509 ( -1.580 1.296 2.594) 3.302 16.651 ( -4.903 2.420 2.210) 5.897 16.877 ( -2.683 -2.977 1.125) 4.162 17.181 ( 2.424 9.565 -2.045) 10.077 17.561 ( -7.391 12.042 -17.675) 22.628 23.568 ( -0.160 -7.121 3.521) 7.946 23.891 ( -4.381 0.728 1.457) 4.674 24.241 ( 2.072 -11.801 -7.872) 14.335 24.598 ( 6.625 -8.665 10.432) 15.093 24.784 ( -0.834 5.641 -2.487) 6.221 25.288 ( -5.526 -2.530 3.791) 7.163 25.409 ( 2.981 12.270 2.530) 12.878 25.703 ( -0.544 6.653 5.571) 8.694 26.602 ( 7.761 -1.021 -9.333) 12.181 27.220 ( 9.695 -6.804 1.521) 11.941 27.790 ( -14.331 7.827 -3.649) 16.731 28.159 ( -3.966 -2.120 -13.668) 14.389 29.338 ( 2.410 -7.833 3.993) 9.116 29.528 ( 0.785 -7.017 5.794) 9.134 29.723 ( 4.354 4.865 5.078) 8.271 30.465 ( 5.607 0.792 -2.404) 6.152 30.558 ( -0.611 3.767 2.917) 4.804 30.705 ( -7.422 2.615 -1.516) 8.014 39.018 ( 1.083 -10.642 -11.358) 15.602 39.610 ( -5.742 -3.525 -21.057) 22.109 40.216 ( -9.017 15.332 -10.281) 20.544 40.425 ( 1.755 17.134 -9.510) 19.675 42.012 ( -2.133 1.523 7.647) 8.084 43.229 ( 1.149 -15.795 13.845) 21.035 43.523 ( 4.692 0.476 7.538) 8.892 44.148 ( 4.037 -13.664 11.320) 18.197 45.001 ( -2.034 8.553 0.362) 8.799 45.209 ( 3.233 2.283 -5.674) 6.918 47.929 ( -0.806 0.771 -0.033) 1.116 48.276 ( -0.185 0.261 -0.035) 0.322 ======================= Grid point 202 (100/125) ======================= q-point: ( 0.44 0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.194 ( -6.030 -9.287 21.763) 24.418 4.659 ( -1.770 -10.866 1.275) 11.083 4.992 ( 7.380 4.841 9.260) 12.793 5.117 ( 13.257 -17.297 4.261) 22.206 6.060 ( -2.734 8.671 -9.913) 13.451 6.171 ( -4.735 2.635 -6.142) 8.191 6.394 ( 3.944 -5.401 -7.829) 10.297 6.551 ( -11.313 -20.400 -6.357) 24.177 7.159 ( -1.919 5.372 -2.825) 6.365 7.699 ( -7.831 3.762 -4.312) 9.699 7.847 ( 11.894 -4.014 5.875) 13.860 8.110 ( -3.734 11.005 1.306) 11.694 8.527 ( 8.725 6.537 8.441) 13.788 8.858 ( -4.077 0.570 2.999) 5.093 9.238 ( -0.568 -10.700 12.925) 16.789 9.586 ( -4.288 1.525 1.488) 4.788 9.876 ( -1.158 -4.790 -3.371) 5.970 10.089 ( 4.882 8.052 -5.182) 10.748 10.390 ( 5.503 7.328 -3.423) 9.783 10.701 ( -4.495 -4.052 2.727) 6.638 11.222 ( 10.988 -4.687 -5.054) 12.971 11.284 ( -11.496 -4.856 -0.367) 12.485 11.894 ( -0.491 3.454 -3.171) 4.714 12.234 ( 1.111 7.622 2.110) 7.986 15.012 ( 0.124 6.223 -4.362) 7.600 16.455 ( -2.308 -4.472 0.830) 5.101 16.701 ( 2.150 4.097 1.267) 4.797 16.887 ( 0.154 2.382 3.684) 4.390 17.302 ( 1.222 9.017 0.872) 9.141 17.418 ( -1.725 15.894 -12.745) 20.446 23.572 ( 2.232 -7.904 5.120) 9.678 23.836 ( -2.724 -3.943 1.975) 5.184 24.068 ( -0.126 -10.725 -6.690) 12.641 24.637 ( -2.799 -8.882 5.460) 10.796 24.825 ( 2.371 5.241 -2.724) 6.365 25.228 ( -2.506 -3.551 0.968) 4.453 25.605 ( 3.459 12.151 4.040) 13.264 25.845 ( 2.043 9.053 3.856) 10.050 26.546 ( -3.480 6.498 -6.097) 9.565 27.361 ( 13.813 -5.998 -0.325) 15.062 27.634 ( -8.235 2.999 -3.878) 9.584 27.921 ( -4.130 -3.113 -9.915) 11.183 29.307 ( -1.079 -10.324 2.262) 10.624 29.555 ( 2.159 -7.344 5.162) 9.233 29.824 ( -2.260 2.182 4.005) 5.090 30.530 ( 1.451 4.281 -2.797) 5.315 30.577 ( -3.815 1.633 -3.129) 5.198 30.668 ( 3.682 5.425 3.244) 7.315 38.826 ( -0.127 -8.786 -7.090) 11.290 39.333 ( 1.507 -3.922 -15.303) 15.870 40.137 ( -5.526 18.577 -7.425) 20.755 40.515 ( 3.609 24.047 -11.296) 26.812 42.104 ( 2.255 -1.208 6.796) 7.261 43.265 ( 0.677 -19.001 12.857) 22.952 43.619 ( 0.637 -3.058 4.696) 5.640 44.146 ( -4.008 -15.102 10.983) 19.099 45.026 ( 2.564 2.319 -5.523) 6.516 45.234 ( -1.561 10.620 -2.646) 11.055 47.934 ( 0.040 0.822 0.638) 1.041 48.276 ( -0.010 0.311 -0.127) 0.336 ======================= Grid point 203 (101/125) ======================= q-point: (-0.44 0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.248 ( -3.771 -11.908 12.001) 17.322 4.467 ( -13.984 -8.634 6.125) 17.539 5.091 ( -1.845 -8.806 -0.350) 9.004 5.242 ( 5.855 -12.054 3.975) 13.978 5.854 ( -0.334 -10.402 -13.376) 16.948 6.091 ( 5.005 -8.150 -8.589) 12.854 6.156 ( -13.876 15.178 -3.916) 20.935 6.540 ( 12.948 0.474 2.743) 13.244 7.072 ( -15.431 10.470 -1.561) 18.713 7.669 ( 7.971 -0.434 -3.593) 8.754 8.017 ( -1.053 -4.305 15.621) 16.238 8.191 ( 2.827 5.079 -1.746) 6.069 8.669 ( -5.850 2.507 2.858) 6.977 8.925 ( 2.991 4.425 8.854) 10.340 9.154 ( -5.617 -10.462 -0.492) 11.885 9.569 ( 0.992 -2.676 -4.622) 5.432 9.770 ( -2.108 -7.595 2.325) 8.218 10.153 ( 7.003 5.700 -7.683) 11.856 10.547 ( 5.933 11.969 -0.524) 13.369 10.617 ( -8.010 -1.747 3.588) 8.949 11.158 ( -4.867 -0.833 1.961) 5.313 11.337 ( 15.423 -3.281 -1.607) 15.850 11.858 ( -1.121 0.705 -3.278) 3.535 12.304 ( -1.152 6.109 -0.017) 6.216 15.077 ( 5.851 7.995 -1.986) 10.104 16.464 ( 2.391 -2.180 5.466) 6.352 16.752 ( 2.674 1.542 -3.008) 4.311 16.993 ( 4.885 3.297 3.765) 6.994 17.321 ( -3.725 14.712 -5.063) 15.999 17.489 ( 5.011 10.374 -3.076) 11.924 23.621 ( 3.385 -4.380 4.381) 7.059 23.835 ( 2.892 -6.983 5.891) 9.583 23.924 ( -0.661 -7.403 -4.356) 8.615 24.539 ( -6.997 -8.238 1.967) 10.986 24.837 ( -0.730 5.580 -4.441) 7.169 25.187 ( 0.032 -4.830 0.419) 4.848 25.769 ( 2.095 8.086 2.437) 8.701 25.958 ( 0.478 5.459 1.847) 5.783 26.519 ( -6.193 14.336 -0.858) 15.640 27.347 ( -3.840 -6.202 -9.796) 12.213 27.505 ( 1.490 -8.268 -2.015) 8.640 27.913 ( 10.113 7.183 -0.520) 12.416 29.213 ( -3.175 -9.028 0.856) 9.608 29.574 ( -2.042 -5.895 5.076) 8.043 29.822 ( -0.231 -0.378 -0.008) 0.443 30.403 ( -7.527 0.581 -4.951) 9.028 30.621 ( 1.272 3.011 0.974) 3.411 30.826 ( 6.458 5.328 1.840) 8.572 38.735 ( 1.732 -3.277 -1.511) 4.002 39.223 ( 7.427 0.499 -11.767) 13.924 40.188 ( 0.239 18.513 -2.839) 18.731 40.651 ( 5.581 26.226 -10.464) 28.782 42.194 ( 3.219 -2.772 3.508) 5.509 43.226 ( -1.907 -22.651 10.137) 24.889 43.613 ( -3.213 -4.038 1.629) 5.411 44.106 ( -3.888 -14.422 12.806) 19.675 45.005 ( 0.537 1.543 -2.686) 3.144 45.214 ( -4.945 8.930 -7.476) 12.653 47.958 ( 0.870 0.977 1.017) 1.657 48.278 ( 0.171 0.269 -0.190) 0.372 ======================= Grid point 204 (102/125) ======================= q-point: (-0.33 0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.176 ( -7.606 -9.960 6.522) 14.127 4.331 ( -10.582 -8.517 9.755) 16.724 4.843 ( -13.834 -11.675 -5.069) 18.798 5.003 ( -6.710 -21.866 -13.189) 26.402 5.772 ( 12.209 -8.723 -2.692) 15.245 6.039 ( 3.495 3.615 -4.388) 6.674 6.212 ( -6.044 16.976 4.984) 18.696 6.741 ( 0.193 10.334 -0.461) 10.346 6.967 ( -5.759 7.841 4.910) 10.898 7.776 ( 15.158 -4.317 -3.653) 16.179 8.114 ( -6.954 -6.598 16.197) 18.821 8.159 ( -2.757 -3.646 -4.531) 6.436 8.593 ( -10.104 1.356 4.163) 11.011 8.991 ( -1.943 -3.486 -2.340) 4.627 9.136 ( 3.435 -0.511 7.242) 8.032 9.429 ( 0.519 2.660 -13.126) 13.403 9.747 ( 6.971 -18.267 0.811) 19.569 10.216 ( 5.806 7.542 -5.783) 11.138 10.550 ( -9.422 3.819 4.184) 10.994 10.706 ( 5.214 11.291 -0.631) 12.452 11.159 ( -1.518 2.313 3.496) 4.458 11.513 ( 12.163 -1.142 -1.530) 12.312 11.810 ( -1.348 -0.358 -1.428) 1.996 12.310 ( -1.360 2.234 -0.547) 2.672 15.232 ( 8.779 8.948 -1.870) 12.674 16.591 ( 2.753 0.814 8.755) 9.213 16.726 ( 2.228 -1.511 -6.810) 7.323 17.146 ( 7.847 1.350 2.620) 8.382 17.359 ( -1.480 14.225 -3.078) 14.629 17.624 ( 7.910 11.570 -2.177) 14.183 23.697 ( 2.877 2.003 2.380) 4.237 23.797 ( -0.833 -5.197 -6.798) 8.598 23.949 ( 5.127 -10.264 13.715) 17.881 24.378 ( -8.118 -5.699 -0.441) 9.929 24.790 ( -3.603 5.349 -6.010) 8.816 25.152 ( -0.582 -3.772 0.084) 3.817 25.844 ( 2.022 1.542 -0.968) 2.721 26.015 ( -1.375 5.207 3.216) 6.273 26.526 ( -7.133 3.101 1.534) 7.928 27.088 ( -2.489 -3.972 -12.851) 13.679 27.514 ( 2.822 -0.082 4.500) 5.312 28.178 ( 15.431 10.077 -0.363) 18.434 29.107 ( -3.275 -6.493 -0.108) 7.273 29.500 ( -9.463 -1.255 1.851) 9.723 29.843 ( 2.390 -1.824 0.837) 3.121 30.268 ( -1.078 -3.674 -3.555) 5.225 30.650 ( -0.707 1.165 0.273) 1.390 30.944 ( 1.969 3.149 1.530) 4.017 38.783 ( 4.775 1.705 2.723) 5.755 39.253 ( 10.768 7.859 -11.569) 17.651 40.389 ( 6.752 16.950 5.281) 18.994 40.852 ( 9.150 26.044 -8.541) 28.895 42.208 ( 0.669 -3.295 -2.525) 4.204 43.094 ( -3.826 -25.792 7.556) 27.147 43.486 ( -9.242 -4.362 -2.458) 10.512 44.101 ( -3.123 -15.218 12.882) 20.181 45.025 ( 1.401 2.191 -0.061) 2.601 45.076 ( -8.052 5.995 -6.975) 12.224 47.992 ( 1.110 0.960 0.670) 1.613 48.280 ( 0.187 0.143 -0.202) 0.311 ======================= Grid point 205 (103/125) ======================= q-point: (-0.22 0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.021 ( -8.444 -13.329 -1.841) 15.885 4.266 ( -12.711 -3.448 15.944) 20.680 4.490 ( -18.803 -3.358 0.340) 19.103 4.617 ( 8.329 -22.876 -18.506) 30.580 5.827 ( 0.257 -11.988 7.218) 13.995 6.123 ( 8.198 7.072 -2.285) 11.065 6.314 ( -7.687 16.737 4.299) 18.913 6.715 ( -9.372 13.060 0.541) 16.084 7.136 ( 6.533 5.239 4.455) 9.485 7.905 ( 15.252 -12.021 -6.702) 20.544 8.023 ( -2.771 3.175 -2.160) 4.735 8.074 ( -11.223 -10.327 10.127) 18.307 8.575 ( -5.715 4.306 8.678) 11.248 8.837 ( -0.581 -10.935 -11.651) 15.989 9.203 ( 6.402 0.854 -5.704) 8.617 9.470 ( 3.705 10.573 3.336) 11.689 9.663 ( 7.152 -22.545 -2.081) 23.743 10.242 ( -4.624 8.129 -5.214) 10.707 10.541 ( -3.965 4.760 5.694) 8.415 10.865 ( 8.046 7.376 -2.018) 11.100 11.220 ( 0.323 6.100 2.740) 6.695 11.562 ( 2.290 -2.840 -4.482) 5.779 11.779 ( -2.782 1.082 -0.699) 3.066 12.321 ( 1.318 -0.399 1.712) 2.197 15.392 ( 7.668 8.583 -3.517) 12.035 16.619 ( -0.823 -3.213 -6.054) 6.903 16.740 ( 0.245 2.802 6.403) 6.994 17.270 ( 7.233 -0.084 -1.891) 7.477 17.406 ( -0.861 8.226 -0.980) 8.329 17.887 ( 14.545 16.301 -0.019) 21.847 23.598 ( -9.101 -2.600 -6.279) 11.358 23.821 ( 7.713 3.427 -0.939) 8.492 24.096 ( -1.320 -9.116 14.950) 17.560 24.247 ( -2.146 -3.447 -0.083) 4.061 24.676 ( -3.941 2.705 -9.048) 10.233 25.126 ( -1.144 1.025 0.407) 1.589 25.833 ( -1.890 -4.685 1.064) 5.162 26.092 ( -1.317 8.416 0.645) 8.543 26.406 ( -3.081 -11.654 3.679) 12.604 26.936 ( 1.526 -6.132 -7.694) 9.957 27.698 ( 8.352 12.637 3.246) 15.491 28.450 ( 12.300 10.515 -1.805) 16.282 29.030 ( -1.200 -3.734 0.218) 3.928 29.364 ( -11.841 2.605 0.444) 12.132 29.814 ( -6.723 -1.196 0.708) 6.865 30.274 ( 11.373 -7.753 0.023) 13.764 30.630 ( -2.115 -0.679 -0.114) 2.225 30.959 ( -3.528 0.241 0.463) 3.566 38.951 ( 8.784 5.267 4.494) 11.184 39.341 ( 10.089 14.248 -14.487) 22.687 40.791 ( 14.306 15.812 15.193) 26.182 41.116 ( 10.869 24.494 -5.805) 27.419 42.086 ( -3.094 -4.029 -10.250) 11.439 42.860 ( -8.060 -26.966 0.878) 28.159 43.266 ( -11.032 -5.300 -1.044) 12.283 44.021 ( -8.642 -15.020 6.366) 18.461 44.929 ( 1.121 0.904 -7.510) 7.647 45.132 ( -2.944 4.121 10.606) 11.753 48.014 ( 0.625 0.690 -0.266) 0.969 48.280 ( 0.048 -0.030 -0.105) 0.119 ======================= Grid point 210 (104/125) ======================= q-point: ( 0.33 -0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.161 ( 31.804 -12.773 4.406) 34.555 4.373 ( -1.640 4.301 17.089) 17.698 4.765 ( 16.257 -13.695 2.893) 21.453 4.858 ( -8.305 -19.848 6.010) 22.339 6.028 ( 4.751 4.277 -5.244) 8.268 6.294 ( -5.444 -6.532 -14.328) 16.661 6.422 ( 3.620 10.200 -8.948) 14.043 6.819 ( -4.072 -1.046 4.295) 6.010 7.264 ( -11.426 -6.455 -2.871) 13.434 7.297 ( 16.330 13.424 -6.429) 22.095 8.074 ( -2.729 -0.080 5.604) 6.234 8.194 ( -0.910 -3.698 12.595) 13.158 8.417 ( -5.582 1.410 0.423) 5.773 8.852 ( 3.219 6.165 7.947) 10.560 9.089 ( 9.178 -12.174 -4.123) 15.794 9.719 ( -9.155 4.048 16.404) 19.217 9.816 ( 3.993 0.437 -3.311) 5.205 10.083 ( -2.031 0.059 -3.781) 4.292 10.377 ( -2.081 3.811 -9.107) 10.090 10.676 ( 3.719 -0.356 -1.230) 3.934 11.155 ( -5.090 0.950 -1.944) 5.531 11.681 ( -13.756 -6.906 -2.496) 15.593 11.895 ( 0.349 4.599 -3.679) 5.900 12.144 ( 5.080 5.312 4.106) 8.419 15.166 ( -10.624 6.962 -4.703) 13.545 16.550 ( -2.232 -2.187 0.061) 3.126 16.743 ( -4.801 1.386 1.788) 5.307 17.000 ( -7.372 4.041 4.029) 9.322 17.233 ( -1.069 10.140 -1.256) 10.274 17.601 ( -8.872 11.549 -11.707) 18.685 23.558 ( -1.000 -6.580 2.434) 7.087 23.983 ( -6.215 -2.283 1.621) 6.816 24.061 ( 1.292 -6.187 -4.190) 7.583 24.521 ( 11.918 -6.908 9.254) 16.596 24.772 ( 0.011 4.563 -8.366) 9.530 25.333 ( -3.727 -7.473 -0.179) 8.353 25.519 ( 2.446 11.857 4.579) 12.944 25.812 ( -0.183 3.539 4.628) 5.829 26.441 ( 6.904 7.304 -1.450) 10.155 27.049 ( 6.446 -12.196 0.176) 13.795 27.835 ( -4.549 -0.824 -10.299) 11.290 28.246 ( -16.549 9.929 -5.914) 20.185 29.248 ( 5.126 -8.618 0.774) 10.057 29.531 ( -1.645 -7.923 4.207) 9.120 29.684 ( 14.068 7.259 2.579) 16.039 30.378 ( 1.205 -2.552 -2.433) 3.726 30.645 ( -1.350 5.291 1.632) 5.699 30.818 ( -6.514 1.182 1.858) 6.876 38.868 ( -3.112 -3.835 -6.048) 7.809 39.450 ( -9.731 -3.717 -19.031) 21.695 40.344 ( -2.016 21.746 -5.337) 22.482 40.554 ( -13.012 16.955 -6.501) 22.339 42.090 ( -1.290 -4.600 3.394) 5.860 43.213 ( 2.752 -17.851 10.255) 20.770 43.500 ( 7.743 -2.610 5.305) 9.742 44.168 ( 3.458 -7.127 15.349) 17.273 44.903 ( 6.643 -3.462 -9.872) 12.393 45.227 ( 0.849 9.719 0.088) 9.757 47.955 ( -1.484 0.855 0.486) 1.780 48.281 ( -0.303 0.261 -0.080) 0.408 ======================= Grid point 211 (105/125) ======================= q-point: ( 0.44 -0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.421 ( -1.877 -11.195 13.926) 17.966 4.544 ( 6.495 -9.176 1.118) 11.297 4.761 ( 19.954 -18.464 7.513) 28.205 4.938 ( 8.934 -2.795 -0.499) 9.374 5.956 ( 3.972 -10.437 -6.393) 12.867 6.127 ( -7.094 8.977 -7.966) 13.941 6.346 ( -2.885 0.727 -7.868) 8.412 6.616 ( -17.966 -3.040 -4.688) 18.815 7.158 ( 2.311 3.094 -1.319) 4.081 7.625 ( 15.911 9.272 2.003) 18.524 7.932 ( -13.792 -0.412 1.180) 13.849 8.319 ( -3.494 4.825 10.061) 11.692 8.556 ( 8.257 5.268 8.712) 13.108 8.842 ( -0.095 -10.194 -1.533) 10.309 9.189 ( 8.897 -8.630 1.809) 12.526 9.669 ( -6.283 -5.093 -2.354) 8.423 9.884 ( -2.401 4.783 3.917) 6.632 10.041 ( 2.431 1.432 -4.371) 5.203 10.382 ( 1.351 9.816 1.077) 9.967 10.671 ( 2.670 -3.115 -3.167) 5.183 11.100 ( -0.676 0.621 0.107) 0.924 11.430 ( -12.734 -4.489 1.177) 13.553 11.875 ( -0.113 2.048 -4.530) 4.972 12.284 ( 2.784 6.706 1.127) 7.347 15.070 ( -5.410 7.579 -2.016) 9.528 16.469 ( -2.697 -4.127 1.928) 5.293 16.757 ( -2.739 4.695 1.249) 5.577 16.980 ( -4.042 4.530 1.807) 6.334 17.342 ( 3.132 7.974 0.795) 8.604 17.487 ( -5.691 15.149 -7.954) 18.032 23.547 ( 1.156 -7.915 5.575) 9.750 23.847 ( -3.068 -5.736 -2.757) 7.066 24.003 ( -4.739 -4.154 3.207) 7.071 24.648 ( 0.648 -9.318 6.114) 11.164 24.737 ( 6.106 4.545 -9.004) 11.791 25.223 ( -2.343 -6.329 -0.765) 6.792 25.716 ( 2.289 11.677 5.262) 13.010 25.900 ( 1.995 4.964 0.672) 5.392 26.581 ( 3.505 14.987 -2.642) 15.617 27.092 ( 12.673 -10.982 -1.102) 16.805 27.612 ( -6.801 -5.438 -8.106) 11.897 28.053 ( -13.887 8.557 -1.539) 16.384 29.237 ( 2.710 -9.228 0.778) 9.649 29.502 ( 1.462 -8.651 2.856) 9.227 29.881 ( 1.250 1.802 1.591) 2.710 30.406 ( 10.296 2.395 -3.346) 11.088 30.638 ( -5.206 1.945 -2.465) 6.079 30.785 ( -4.768 4.661 4.415) 7.997 38.756 ( -2.990 -2.466 -0.270) 3.885 39.152 ( -2.634 -1.267 -12.947) 13.273 40.338 ( -10.493 21.144 -4.817) 24.091 40.575 ( -0.356 25.971 -8.740) 27.405 42.101 ( 2.736 -6.965 4.353) 8.657 43.224 ( 2.462 -20.272 10.495) 22.960 43.583 ( 4.227 -6.965 2.373) 8.486 44.236 ( -4.312 -12.144 12.388) 17.876 44.897 ( 7.249 1.939 -6.981) 10.249 45.292 ( -0.614 9.613 -4.472) 10.621 47.955 ( -0.701 0.858 0.974) 1.475 48.278 ( -0.198 0.287 -0.182) 0.393 ======================= Grid point 212 (106/125) ======================= q-point: (-0.44 -0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.307 ( -6.981 -20.718 5.791) 22.617 4.546 ( 0.339 -8.218 3.844) 9.079 4.858 ( 0.706 -12.748 -14.995) 19.694 5.093 ( 20.571 -11.999 11.414) 26.409 5.809 ( -20.172 -6.956 -5.914) 22.141 5.939 ( 2.016 2.800 -3.972) 5.261 6.360 ( 9.780 0.649 3.809) 10.516 6.422 ( -4.522 13.565 -6.709) 15.794 7.221 ( 3.380 3.080 -1.496) 4.812 7.645 ( -11.920 7.372 -5.136) 14.927 8.031 ( 9.819 -3.836 11.878) 15.882 8.382 ( -8.441 9.899 5.046) 13.954 8.699 ( 1.297 -6.334 -2.757) 7.029 8.905 ( 14.367 -5.437 11.911) 19.438 9.138 ( -4.133 -8.506 -2.633) 9.816 9.475 ( -4.676 -1.718 -11.059) 12.129 9.819 ( -10.271 -4.708 2.006) 11.475 10.063 ( 2.800 2.741 -2.366) 4.577 10.563 ( 5.510 10.797 3.215) 12.540 10.677 ( 3.744 1.019 -1.307) 4.095 11.155 ( 5.846 1.904 0.638) 6.181 11.307 ( -7.880 -0.643 6.535) 10.257 11.829 ( -0.151 0.320 -3.754) 3.771 12.343 ( -0.226 4.112 -1.716) 4.462 15.093 ( 0.370 8.778 0.571) 8.804 16.502 ( 1.760 0.119 7.276) 7.487 16.741 ( -2.702 1.826 -2.037) 3.845 17.012 ( 0.593 4.084 1.609) 4.429 17.405 ( 0.029 8.017 -3.263) 8.655 17.517 ( -0.265 15.356 -2.685) 15.592 23.590 ( 2.944 -8.209 6.768) 11.039 23.777 ( 1.506 -1.684 -1.680) 2.816 23.953 ( -5.639 -4.531 7.529) 10.441 24.572 ( -4.922 -5.287 -1.090) 7.305 24.766 ( 6.012 -0.182 -5.934) 8.449 25.159 ( -0.219 -4.958 0.758) 5.021 25.844 ( -1.688 5.594 2.172) 6.233 25.959 ( 3.148 4.127 -2.737) 5.868 26.710 ( -2.733 19.414 -1.502) 19.663 27.082 ( 7.650 -12.902 -12.218) 19.346 27.463 ( -1.615 -3.282 3.074) 4.778 28.008 ( -4.821 10.568 4.825) 12.579 29.187 ( -1.528 -7.823 0.578) 7.992 29.511 ( 6.950 -9.737 1.599) 12.069 29.811 ( -5.217 -3.310 -3.256) 6.984 30.489 ( -7.476 2.224 -3.998) 8.765 30.594 ( 6.916 3.442 0.696) 7.756 30.845 ( 0.930 4.692 3.420) 5.880 38.755 ( -1.983 2.239 5.976) 6.683 39.040 ( 3.560 3.334 -8.826) 10.084 40.357 ( -5.028 21.049 -1.397) 21.686 40.692 ( 2.254 27.739 -10.381) 29.703 42.140 ( 3.652 -7.564 3.362) 9.047 43.178 ( -1.364 -22.467 8.971) 24.231 43.584 ( 2.081 -8.113 0.433) 8.387 44.203 ( -4.398 -13.518 11.462) 18.261 44.947 ( 4.825 4.212 -4.016) 7.559 45.239 ( -3.660 5.762 -9.136) 11.405 47.972 ( 0.132 1.000 1.115) 1.503 48.277 ( -0.026 0.258 -0.142) 0.296 ======================= Grid point 213 (107/125) ======================= q-point: (-0.33 -0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.062 ( -4.539 -28.903 -0.181) 29.257 4.380 ( 1.505 -27.212 -22.598) 35.403 4.608 ( -4.970 0.455 7.081) 8.663 5.218 ( -18.204 -6.796 4.533) 19.953 5.538 ( 7.526 -1.223 -1.640) 7.799 6.026 ( 2.477 7.942 3.118) 8.884 6.409 ( -0.633 9.988 -3.568) 10.625 6.691 ( 16.958 6.030 6.630) 19.181 7.239 ( -4.946 6.269 0.335) 7.992 7.519 ( -0.259 3.103 -7.072) 7.727 8.139 ( -3.679 -9.058 5.191) 11.069 8.405 ( -6.987 0.988 10.337) 12.516 8.636 ( 3.389 -4.101 -4.308) 6.845 8.914 ( -6.267 -7.728 -9.782) 13.953 9.155 ( 1.701 -5.041 7.274) 9.012 9.334 ( 3.951 4.833 -4.157) 7.500 9.645 ( -9.296 -10.314 4.654) 14.644 10.130 ( 6.980 6.204 -2.941) 9.791 10.696 ( -0.714 2.375 -0.910) 2.642 10.722 ( 0.998 11.720 -1.787) 11.898 11.248 ( 1.526 4.391 -1.784) 4.979 11.388 ( 5.228 -0.039 10.386) 11.628 11.805 ( 0.400 -0.496 -0.185) 0.663 12.311 ( -1.407 -0.028 -3.378) 3.659 15.220 ( 3.910 10.056 1.946) 10.963 16.641 ( 0.408 1.099 0.156) 1.183 16.689 ( 0.426 1.140 5.121) 5.263 17.093 ( 4.063 1.575 2.021) 4.804 17.436 ( 0.182 8.470 -3.191) 9.053 17.637 ( 3.047 17.368 -1.015) 17.662 23.619 ( 3.376 -8.271 0.405) 8.943 23.799 ( -1.235 4.116 1.052) 4.425 23.994 ( 1.528 -5.761 13.435) 14.698 24.429 ( -7.012 -2.787 -2.722) 8.022 24.738 ( 2.412 -2.529 -7.738) 8.490 25.151 ( 0.150 -2.998 2.944) 4.204 25.818 ( -1.364 -1.200 -3.460) 3.908 25.986 ( 3.499 1.374 -4.409) 5.794 26.687 ( -11.599 -1.499 0.285) 11.699 26.957 ( 3.240 6.325 -11.958) 13.910 27.538 ( 2.817 1.879 7.141) 7.903 28.194 ( 4.025 13.585 8.236) 16.388 29.087 ( -3.047 -6.552 -1.247) 7.333 29.570 ( 5.930 -8.570 2.890) 10.815 29.680 ( 1.394 -3.832 -5.848) 7.130 30.328 ( -10.475 0.676 -1.877) 10.663 30.670 ( 0.262 0.595 0.430) 0.779 30.957 ( 3.518 4.142 2.046) 5.806 38.851 ( -1.538 5.460 7.975) 9.787 39.091 ( 7.641 10.337 -5.982) 14.178 40.525 ( 3.637 19.373 4.762) 20.279 40.851 ( 6.546 27.080 -9.793) 29.531 42.131 ( 0.286 -6.750 -0.942) 6.821 43.037 ( -5.180 -24.071 6.911) 25.574 43.501 ( -3.505 -7.846 -2.261) 8.886 44.182 ( -3.220 -14.940 12.567) 19.787 44.920 ( -0.880 1.218 -13.372) 13.456 45.175 ( 0.506 5.754 0.599) 5.808 47.996 ( 0.473 1.023 0.612) 1.283 48.278 ( 0.052 0.166 0.001) 0.174 ======================= Grid point 214 (108/125) ======================= q-point: (-0.22 -0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.732 ( 1.551 -34.586 -5.515) 35.058 3.936 ( 11.061 -30.101 -22.041) 38.913 4.696 ( -14.671 5.936 11.940) 19.825 4.866 ( -17.931 4.581 0.076) 18.507 5.715 ( 10.195 -1.985 4.098) 11.165 6.147 ( -0.141 6.751 3.207) 7.475 6.448 ( 5.283 1.026 -3.339) 6.334 6.948 ( -1.545 9.976 1.953) 10.282 7.262 ( -5.475 13.354 5.075) 15.299 7.523 ( 12.951 -5.508 -6.047) 15.318 8.007 ( -4.720 -8.683 -0.570) 9.899 8.347 ( -13.031 -8.456 8.252) 17.589 8.590 ( -1.985 -8.780 -10.334) 13.704 8.722 ( 2.236 7.454 -1.234) 7.880 9.091 ( -3.059 0.630 -6.458) 7.173 9.465 ( 3.906 -14.165 9.674) 17.593 9.587 ( -2.213 4.669 8.287) 9.766 10.276 ( 6.436 10.203 -2.015) 12.230 10.626 ( -3.600 -3.254 -1.214) 5.003 10.817 ( 4.165 12.179 -5.780) 14.110 11.267 ( -0.001 5.604 -1.620) 5.833 11.542 ( -0.805 -0.989 6.072) 6.205 11.814 ( -0.789 0.222 1.109) 1.379 12.271 ( 3.501 -3.030 -1.561) 4.887 15.384 ( 3.269 10.706 2.019) 11.374 16.542 ( -3.008 -2.160 -5.036) 6.251 16.858 ( 2.878 4.238 7.374) 8.979 17.174 ( 3.157 -0.922 1.859) 3.778 17.464 ( -0.302 7.266 -2.516) 7.695 17.885 ( 8.537 20.770 2.066) 22.551 23.536 ( -0.731 -7.450 -6.082) 9.645 23.838 ( -1.383 4.874 3.305) 6.049 24.187 ( 6.281 -3.515 9.223) 11.699 24.284 ( -8.776 -1.371 2.684) 9.279 24.596 ( -1.414 -5.259 -10.216) 11.577 25.169 ( -1.021 1.089 2.235) 2.688 25.783 ( 4.490 -5.677 -0.755) 7.278 25.984 ( 8.066 -3.258 -6.483) 10.849 26.476 ( -13.824 -5.292 1.889) 14.922 26.922 ( -2.208 5.513 -4.917) 7.710 27.715 ( 4.916 9.642 4.076) 11.565 28.465 ( 4.494 12.657 6.881) 15.091 28.999 ( -0.103 -3.877 -1.251) 4.075 29.505 ( -7.665 0.385 -1.193) 7.767 29.740 ( 14.584 -8.486 -1.409) 16.931 30.187 ( -7.047 -1.211 0.696) 7.184 30.654 ( -1.613 -2.095 0.741) 2.745 31.014 ( -1.736 2.050 0.358) 2.710 38.991 ( 2.529 8.833 5.241) 10.577 39.227 ( 4.807 14.622 -5.106) 16.217 40.898 ( 13.956 17.433 12.176) 25.434 41.092 ( 11.426 25.499 -6.036) 28.586 41.993 ( -6.099 -5.817 -7.580) 11.336 42.798 ( -10.145 -24.295 2.673) 26.463 43.326 ( -7.221 -7.685 -2.030) 10.738 44.114 ( -9.234 -15.180 8.237) 19.585 44.745 ( 4.669 -2.578 -13.071) 14.117 45.303 ( 1.678 5.354 6.918) 8.907 48.012 ( 0.184 0.940 -0.184) 0.976 48.280 ( -0.023 0.004 0.168) 0.169 ======================= Grid point 219 (109/125) ======================= q-point: ( 0.33 -0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.649 ( 36.916 -13.048 12.305) 41.042 4.137 ( 26.357 -28.177 -5.153) 38.926 4.723 ( -4.703 11.977 7.656) 14.972 5.018 ( -15.719 -19.089 8.391) 26.113 5.841 ( 6.377 1.442 -12.463) 14.073 6.146 ( 13.117 -0.859 2.967) 13.476 6.373 ( -1.194 7.997 -9.210) 12.256 6.921 ( -4.046 6.834 -2.399) 8.297 7.201 ( 8.440 16.082 -0.419) 18.167 7.400 ( -17.294 -6.808 -1.041) 18.615 8.030 ( 8.451 -13.654 12.168) 20.147 8.411 ( 3.924 13.672 7.315) 15.995 8.498 ( -8.546 -7.769 3.460) 12.057 8.767 ( 8.184 -4.912 -5.542) 11.037 9.032 ( -10.711 -3.355 3.261) 11.688 9.692 ( 5.661 3.171 -7.650) 10.031 9.915 ( -3.981 -7.804 -3.283) 9.355 10.163 ( -6.683 0.058 -2.062) 6.994 10.354 ( -0.029 15.140 5.852) 16.231 10.650 ( -0.169 -2.312 1.794) 2.931 11.253 ( -7.438 2.965 -1.511) 8.149 11.737 ( -6.796 -3.503 -6.453) 10.004 11.862 ( 1.192 1.410 -3.303) 3.784 12.162 ( 4.863 2.507 5.048) 7.444 15.345 ( -13.328 7.706 -4.755) 16.113 16.549 ( -1.087 -4.445 0.863) 4.656 16.842 ( -1.391 3.623 1.612) 4.202 17.187 ( -9.758 4.090 -0.417) 10.588 17.330 ( -3.807 7.539 -0.041) 8.445 17.734 ( -13.577 13.315 -7.461) 20.428 23.531 ( 1.827 -7.431 2.409) 8.023 23.958 ( -3.759 -3.171 -5.545) 7.412 24.113 ( -1.657 -0.218 6.868) 7.069 24.389 ( 12.772 -4.251 7.260) 15.294 24.657 ( 2.011 1.114 -11.566) 11.792 25.290 ( -1.390 -6.099 -2.919) 6.903 25.604 ( 5.784 8.812 4.648) 11.520 25.853 ( 3.065 -1.137 3.727) 4.957 26.550 ( -6.301 9.146 9.112) 14.366 26.843 ( 3.853 -12.611 -4.608) 13.969 27.802 ( -6.012 2.398 -7.872) 10.192 28.492 ( -16.025 10.574 -7.262) 20.527 29.088 ( 6.485 -8.254 -1.352) 10.584 29.518 ( 12.971 5.725 1.864) 14.300 29.569 ( 2.955 -3.575 3.525) 5.826 30.334 ( -2.538 -5.156 -1.572) 5.958 30.686 ( 0.748 1.471 -0.474) 1.717 30.949 ( -4.787 2.703 3.190) 6.356 38.899 ( -7.333 2.675 -0.619) 7.830 39.373 ( -13.020 -1.667 -17.011) 21.487 40.545 ( -3.590 23.340 2.732) 23.772 40.847 ( -18.406 18.734 -7.391) 27.283 42.064 ( -0.301 -9.931 1.259) 10.015 43.094 ( 6.093 -18.971 4.443) 20.415 43.402 ( 9.049 -4.255 3.260) 10.518 44.288 ( 2.016 -5.617 18.984) 19.900 44.607 ( 12.370 -5.123 -10.996) 17.326 45.278 ( 1.045 9.320 -1.705) 9.532 47.991 ( -1.666 0.734 0.522) 1.893 48.285 ( -0.212 0.139 -0.221) 0.336 ======================= Grid point 220 (110/125) ======================= q-point: ( 0.44 -0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.213 ( 23.975 -10.697 6.566) 27.061 4.247 ( 28.669 -16.069 6.267) 33.458 4.732 ( -12.416 -20.279 10.680) 26.066 4.788 ( -0.069 -0.336 -8.845) 8.852 5.807 ( 4.722 2.213 -4.190) 6.689 6.145 ( -0.346 2.971 -5.908) 6.622 6.362 ( -8.133 5.344 -5.573) 11.214 6.795 ( -15.271 -0.955 -2.919) 15.576 7.158 ( -4.922 2.892 -4.164) 7.066 7.550 ( 16.322 12.907 7.136) 21.999 8.065 ( -5.129 -6.731 1.252) 8.555 8.481 ( 0.938 -9.230 13.371) 16.274 8.599 ( 2.202 9.754 1.493) 10.110 8.689 ( 1.576 -14.722 -3.874) 15.305 9.041 ( 6.360 -0.968 4.231) 7.700 9.630 ( -5.506 -2.641 -10.620) 12.250 9.809 ( 13.541 -4.668 -4.096) 14.897 10.100 ( -7.834 5.932 0.597) 9.844 10.542 ( -3.785 12.824 6.966) 15.077 10.625 ( -1.668 -0.690 -0.103) 1.808 11.170 ( -4.819 1.467 1.164) 5.170 11.554 ( -7.524 -2.864 -1.013) 8.114 11.832 ( -0.271 0.225 -3.701) 3.717 12.293 ( 3.865 4.416 0.773) 5.919 15.218 ( -8.556 8.256 -1.306) 11.961 16.506 ( -1.633 -3.335 3.892) 5.380 16.844 ( -3.778 4.123 -2.459) 6.109 17.114 ( -5.704 5.131 1.747) 7.868 17.368 ( -0.086 4.853 -0.534) 4.883 17.631 ( -7.877 16.212 -4.201) 18.507 23.545 ( 0.915 -6.706 6.213) 9.188 23.817 ( -3.942 -1.305 -4.107) 5.840 24.140 ( -5.745 -2.925 8.646) 10.785 24.502 ( 10.151 0.294 -11.865) 15.618 24.626 ( 2.568 -6.886 3.348) 8.076 25.189 ( -1.931 -4.886 -1.653) 5.507 25.820 ( 5.187 10.381 2.231) 11.817 25.919 ( 0.014 2.023 3.211) 3.795 26.597 ( 4.152 0.443 -0.022) 4.176 26.866 ( 6.039 -2.972 0.387) 6.742 27.625 ( -7.983 0.397 -4.238) 9.047 28.293 ( -13.126 10.840 -4.601) 17.634 29.105 ( 6.042 -6.572 -0.502) 8.941 29.478 ( -3.561 -8.272 2.403) 9.321 29.851 ( 9.084 4.580 1.016) 10.224 30.257 ( 4.874 -2.001 -2.674) 5.909 30.674 ( -1.932 0.038 -1.618) 2.520 30.933 ( -5.089 2.566 2.798) 6.349 38.856 ( -5.398 4.554 4.338) 8.288 39.084 ( -6.545 2.611 -9.388) 11.738 40.657 ( -13.506 22.716 0.433) 26.431 40.727 ( -6.373 25.701 -9.573) 28.157 42.037 ( 3.095 -10.590 4.851) 12.052 43.102 ( 7.586 -20.212 6.783) 22.629 43.457 ( 5.249 -9.261 -0.150) 10.646 44.312 ( -2.422 -15.903 6.651) 17.407 44.729 ( 10.603 5.372 -0.997) 11.928 45.304 ( -1.268 7.171 -6.579) 9.814 47.986 ( -1.050 0.789 0.850) 1.565 48.280 ( -0.182 0.168 -0.226) 0.335 ======================= Grid point 221 (111/125) ======================= q-point: (-0.44 -0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.214 ( -1.166 -21.915 -1.081) 21.972 4.506 ( -8.082 -15.826 -1.283) 17.817 4.561 ( 4.310 -11.756 -12.040) 17.371 4.826 ( 27.238 -6.670 15.373) 31.980 5.949 ( 5.687 8.257 6.170) 11.773 6.053 ( -23.308 0.012 -5.707) 23.996 6.167 ( 10.421 1.181 -6.172) 12.169 6.554 ( -10.420 3.703 -4.070) 11.784 7.144 ( 2.832 4.489 -4.297) 6.829 7.854 ( -9.703 8.342 -0.872) 12.826 8.002 ( 10.168 -2.287 10.295) 14.649 8.426 ( 8.729 -17.827 -8.634) 21.646 8.577 ( -6.356 3.070 -2.613) 7.526 8.862 ( 11.680 -4.918 16.865) 21.095 9.100 ( -2.643 0.135 -0.850) 2.779 9.427 ( -4.388 3.800 -9.154) 10.839 9.948 ( 5.601 -4.358 -0.474) 7.113 10.034 ( -6.172 0.485 5.000) 7.958 10.544 ( 2.051 0.227 -2.015) 2.884 10.704 ( -1.519 13.866 1.346) 14.013 11.169 ( -0.868 2.611 0.927) 2.904 11.484 ( -5.180 -0.131 6.484) 8.300 11.786 ( 0.117 -1.190 -2.250) 2.548 12.342 ( 0.352 2.425 -2.422) 3.446 15.214 ( -3.600 9.912 2.598) 10.861 16.573 ( 2.148 0.246 8.050) 8.335 16.764 ( -3.143 0.655 -4.335) 5.394 17.118 ( -6.006 5.718 4.072) 9.238 17.387 ( 2.229 5.200 -4.125) 7.001 17.664 ( -3.764 18.154 -1.218) 18.580 23.576 ( 0.011 -9.596 6.865) 11.799 23.764 ( 0.107 4.072 -0.190) 4.078 24.122 ( -7.152 -4.041 8.876) 12.094 24.486 ( 9.724 1.489 -14.292) 17.350 24.611 ( -1.251 -9.010 2.904) 9.548 25.132 ( -0.037 -3.480 0.549) 3.523 25.902 ( 2.736 2.457 -3.111) 4.817 25.960 ( -5.834 2.618 1.853) 6.658 26.694 ( 12.805 -3.266 -9.692) 16.388 26.886 ( -0.985 3.851 3.731) 5.452 27.548 ( -4.499 4.407 2.295) 6.702 28.239 ( -5.961 13.778 3.010) 15.311 29.127 ( 3.663 -5.740 0.038) 6.809 29.368 ( -1.822 -10.505 -1.435) 10.758 29.823 ( -5.116 -5.630 -1.605) 7.775 30.425 ( 12.393 6.121 -2.415) 14.031 30.610 ( -3.528 -0.312 0.162) 3.546 30.922 ( -2.473 1.124 2.152) 3.466 38.934 ( 1.425 9.062 2.204) 9.434 38.995 ( -6.148 6.836 3.920) 9.994 40.624 ( -10.299 22.696 -3.748) 25.203 40.791 ( -2.658 25.404 -7.502) 26.621 42.077 ( 3.126 -8.741 6.463) 11.311 43.109 ( 2.552 -20.713 8.643) 22.588 43.430 ( 6.092 -10.928 -2.932) 12.851 44.227 ( 0.277 -15.576 4.548) 16.229 44.881 ( 4.353 5.134 -0.255) 6.736 45.197 ( -3.091 2.672 -10.802) 11.549 47.994 ( -0.364 0.965 0.855) 1.340 48.278 ( -0.072 0.180 -0.035) 0.197 ======================= Grid point 222 (112/125) ======================= q-point: (-0.33 -0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.854 ( -4.673 -28.095 -16.417) 32.874 3.943 ( -15.204 -37.932 -9.686) 41.998 4.668 ( 8.896 5.188 4.160) 11.107 5.291 ( 15.951 -3.874 15.395) 22.504 5.629 ( -23.552 2.137 -7.516) 24.814 6.171 ( 0.128 8.478 5.336) 10.018 6.192 ( 11.276 -8.760 -12.720) 19.123 6.624 ( 12.849 9.287 7.217) 17.420 7.179 ( 3.778 4.133 -3.482) 6.594 7.692 ( -13.111 5.555 -1.666) 14.336 8.189 ( -2.586 -4.514 3.273) 6.146 8.355 ( 9.837 -15.967 -0.732) 18.768 8.489 ( 4.079 1.878 -7.745) 8.953 8.935 ( -9.923 4.597 -5.334) 12.168 9.205 ( 3.973 -4.962 17.365) 18.492 9.352 ( -2.486 11.355 -4.954) 12.635 9.855 ( -13.618 -4.794 9.352) 17.202 10.056 ( 3.821 -0.555 -0.652) 3.915 10.632 ( 9.926 0.818 -3.001) 10.402 10.754 ( -3.061 13.398 -7.424) 15.621 11.227 ( 3.606 3.219 2.381) 5.389 11.535 ( -2.848 0.888 10.527) 10.941 11.784 ( 2.189 -1.557 1.141) 2.918 12.283 ( -2.884 -1.366 -4.821) 5.782 15.331 ( -0.103 12.294 5.705) 13.554 16.639 ( -1.780 -1.829 -3.204) 4.097 16.749 ( 2.417 -0.269 6.478) 6.920 17.154 ( -2.728 5.638 6.170) 8.792 17.428 ( 2.685 7.564 -3.885) 8.917 17.785 ( -0.804 21.789 0.868) 21.821 23.531 ( -0.898 -11.734 1.779) 11.902 23.877 ( 2.120 7.552 5.094) 9.353 24.100 ( -2.688 -5.335 6.480) 8.814 24.454 ( 3.692 2.274 -9.622) 10.554 24.530 ( -1.089 -9.343 -0.702) 9.433 25.152 ( 2.565 -2.845 4.001) 5.539 25.797 ( -8.974 -3.474 -7.883) 12.440 25.899 ( 1.782 -2.575 -3.801) 4.925 26.646 ( 6.452 -9.891 -3.749) 12.390 27.004 ( -6.941 21.178 -2.527) 22.430 27.619 ( 3.417 3.863 7.256) 8.902 28.412 ( -0.244 16.545 9.890) 19.277 29.069 ( -4.330 -7.190 -0.947) 8.447 29.288 ( 10.650 -11.734 -4.147) 16.380 29.691 ( -5.416 -3.913 -1.024) 6.760 30.438 ( -5.850 1.237 -2.675) 6.551 30.653 ( 2.912 0.164 0.629) 2.984 30.960 ( 3.177 1.984 1.938) 4.217 38.997 ( 1.085 9.814 -2.573) 10.204 39.167 ( -3.283 13.797 14.816) 20.510 40.679 ( 0.877 21.040 -4.920) 21.625 40.899 ( 0.733 22.981 -3.408) 23.244 42.100 ( -1.405 -5.702 3.758) 6.972 43.022 ( -5.465 -20.185 7.985) 22.384 43.381 ( 4.971 -11.005 -4.502) 12.887 44.195 ( 3.225 -16.232 7.833) 18.309 44.789 ( -6.889 -2.188 -15.073) 16.716 45.169 ( 5.874 5.559 -0.459) 8.100 48.008 ( -0.029 1.088 0.467) 1.184 48.280 ( -0.006 0.128 0.195) 0.233 ======================= Grid point 223 (113/125) ======================= q-point: (-0.22 -0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.254 ( 2.281 -36.985 -22.528) 43.366 3.452 ( -6.117 -40.504 -1.707) 40.999 4.935 ( 8.166 14.290 6.321) 17.631 5.167 ( -26.162 3.451 -5.256) 26.907 5.651 ( 8.820 -1.398 8.842) 12.567 5.953 ( 13.903 -28.346 -19.580) 37.151 6.393 ( -0.328 11.219 9.230) 14.531 6.995 ( 10.429 9.533 5.815) 15.279 7.260 ( 8.981 4.337 -0.741) 10.001 7.587 ( -8.691 10.639 -0.373) 13.743 7.970 ( -9.063 -8.810 -10.057) 16.152 8.353 ( 3.342 -11.541 2.151) 12.206 8.516 ( -0.818 -0.594 -0.634) 1.193 8.825 ( -5.689 14.107 -1.755) 15.312 9.181 ( -12.361 4.244 -2.151) 13.245 9.495 ( 2.592 -4.041 12.511) 13.400 9.811 ( -7.489 0.041 12.955) 14.964 10.166 ( 11.888 2.975 -0.558) 12.267 10.643 ( -5.101 -2.368 -2.460) 6.138 10.724 ( 5.627 13.710 -14.682) 20.861 11.327 ( 0.198 4.178 3.793) 5.646 11.658 ( -0.912 -0.549 10.182) 10.237 11.823 ( 1.414 -1.163 1.676) 2.482 12.160 ( 0.443 -5.057 -5.417) 7.424 15.520 ( -0.170 14.169 7.117) 15.857 16.534 ( -3.815 -3.294 -2.802) 5.767 16.840 ( 5.558 -3.298 1.475) 6.629 17.270 ( -2.463 6.837 8.663) 11.308 17.484 ( 1.271 8.973 -2.646) 9.441 18.029 ( 3.307 25.412 4.286) 25.982 23.418 ( -1.119 -11.744 -1.589) 11.904 23.954 ( -4.059 2.727 2.160) 5.346 24.130 ( 2.486 -4.840 -1.237) 5.580 24.365 ( 4.755 -4.450 -12.164) 13.798 24.496 ( -4.026 0.482 11.902) 12.573 25.219 ( -0.241 -1.366 4.325) 4.541 25.610 ( 4.842 -5.792 -5.385) 9.273 25.806 ( 0.087 -9.329 -5.735) 10.951 26.666 ( -1.547 -1.682 6.223) 6.629 26.932 ( -9.322 18.291 -12.008) 23.784 27.830 ( 2.260 7.747 8.469) 11.698 28.648 ( -1.809 10.821 9.591) 14.573 28.955 ( -0.236 -3.743 -0.866) 3.849 29.373 ( 19.483 -10.404 -2.608) 22.241 29.577 ( -5.887 -0.974 -2.001) 6.294 30.323 ( -8.514 0.318 0.372) 8.528 30.648 ( -0.269 -3.859 -0.036) 3.869 31.040 ( 1.425 2.682 0.148) 3.041 39.084 ( 1.024 13.300 -1.492) 13.423 39.392 ( -5.654 14.692 12.698) 20.225 40.878 ( 14.800 18.106 -7.007) 24.412 41.147 ( 7.194 21.003 7.468) 23.423 42.008 ( -8.976 -2.866 -1.795) 9.591 42.821 ( -11.836 -18.723 4.647) 22.633 43.276 ( 0.035 -10.341 -3.847) 11.033 44.208 ( -3.834 -17.842 11.942) 21.809 44.459 ( 1.562 -5.166 -20.507) 21.205 45.328 ( 7.280 5.287 1.552) 9.131 48.020 ( -0.152 1.189 0.062) 1.200 48.284 ( -0.048 0.004 0.308) 0.312 ======================= Grid point 273 (114/125) ======================= q-point: ( 0.33 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.303 ( 0.000 -0.000 26.095) 26.095 4.303 ( 0.000 -0.000 26.095) 26.095 4.979 ( 0.000 -0.000 1.020) 1.020 5.774 ( 0.000 0.000 -6.737) 6.737 5.774 ( -0.000 0.000 -6.737) 6.737 5.812 ( 0.000 -0.000 8.631) 8.631 6.912 ( 0.000 0.000 -4.295) 4.295 6.912 ( -0.000 0.000 -4.295) 4.295 7.577 ( -0.000 0.000 -11.870) 11.870 7.577 ( -0.000 0.000 -11.870) 11.870 7.616 ( -0.000 0.000 -1.991) 1.991 7.869 ( -0.000 0.000 -8.740) 8.740 8.582 ( 0.000 -0.000 8.566) 8.566 8.582 ( 0.000 -0.000 8.566) 8.566 9.009 ( 0.000 -0.000 26.908) 26.908 9.825 ( 0.000 0.000 -4.658) 4.658 9.825 ( -0.000 0.000 -4.658) 4.658 10.192 ( -0.000 0.000 -5.228) 5.228 10.192 ( -0.000 0.000 -5.228) 5.228 10.717 ( 0.000 -0.000 5.994) 5.994 11.485 ( 0.000 0.000 -3.151) 3.151 11.485 ( -0.000 0.000 -3.151) 3.151 11.598 ( -0.000 0.000 -0.853) 0.853 12.130 ( 0.000 -0.000 0.512) 0.512 14.982 ( -0.000 0.000 -9.657) 9.657 16.517 ( 0.000 -0.000 5.118) 5.118 16.517 ( 0.000 -0.000 5.118) 5.118 17.031 ( 0.000 -0.000 0.016) 0.016 17.031 ( -0.000 0.000 0.016) 0.016 17.282 ( -0.000 0.000 -24.364) 24.364 23.748 ( 0.000 -0.000 3.041) 3.041 23.748 ( 0.000 -0.000 3.041) 3.041 24.559 ( -0.000 0.000 -7.253) 7.253 24.559 ( -0.000 0.000 -7.253) 7.253 24.834 ( 0.000 -0.000 12.601) 12.601 25.239 ( 0.000 -0.000 4.461) 4.461 25.239 ( 0.000 -0.000 4.461) 4.461 25.605 ( 0.000 -0.000 6.196) 6.196 26.755 ( -0.000 0.000 -18.080) 18.080 27.428 ( 0.000 -0.000 2.557) 2.557 27.428 ( 0.000 -0.000 2.557) 2.557 28.193 ( -0.000 0.000 -16.148) 16.148 29.482 ( 0.000 -0.000 7.046) 7.046 29.668 ( 0.000 -0.000 6.950) 6.950 29.668 ( 0.000 -0.000 6.950) 6.950 30.500 ( -0.000 0.000 -3.844) 3.844 30.538 ( 0.000 0.000 -0.610) 0.610 30.538 ( -0.000 0.000 -0.610) 0.610 39.373 ( -0.000 0.000 -16.973) 16.973 39.373 ( -0.000 0.000 -16.973) 16.973 40.111 ( -0.000 0.000 -13.015) 13.015 40.111 ( -0.000 0.000 -13.015) 13.015 41.961 ( 0.000 -0.000 12.960) 12.960 43.488 ( 0.000 -0.000 11.474) 11.474 43.488 ( 0.000 -0.000 11.474) 11.474 44.606 ( 0.000 -0.000 6.728) 6.728 44.606 ( 0.000 -0.000 6.728) 6.728 45.234 ( -0.000 0.000 -9.576) 9.576 47.913 ( -0.000 0.000 -0.029) 0.029 48.271 ( -0.000 0.000 -0.102) 0.102 ======================= Grid point 274 (115/125) ======================= q-point: ( 0.44 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.380 ( -6.496 -9.444 21.956) 24.768 4.787 ( -0.096 11.952 17.414) 21.122 4.860 ( -9.762 -11.346 4.566) 15.649 5.457 ( -14.917 -1.086 -4.042) 15.493 5.842 ( 5.147 1.990 -3.063) 6.311 5.994 ( 14.296 1.491 -6.101) 15.615 6.694 ( -13.095 -0.407 -7.104) 14.904 6.904 ( -4.745 -2.439 -1.347) 5.502 7.199 ( 0.525 -31.427 -14.173) 34.479 7.414 ( -8.599 18.042 -5.330) 20.685 7.765 ( 7.777 5.320 3.504) 10.053 8.013 ( 19.318 11.069 -9.142) 24.069 8.614 ( -10.501 5.062 13.491) 17.830 8.724 ( 3.283 -9.496 10.915) 14.835 9.400 ( 5.605 4.627 24.349) 25.411 9.548 ( -11.081 -10.379 -4.869) 15.944 9.914 ( 2.830 4.791 -8.645) 10.281 10.030 ( -1.721 -1.658 -0.899) 2.553 10.262 ( 5.129 5.369 -5.957) 9.519 10.754 ( -2.228 -3.084 3.976) 5.503 11.229 ( -10.405 -4.084 -3.816) 11.811 11.584 ( 10.937 -0.806 -5.542) 12.287 11.677 ( 4.591 7.831 -2.493) 9.414 12.140 ( -0.505 0.018 2.165) 2.223 14.931 ( 4.631 2.702 -5.860) 7.943 16.529 ( -0.020 -2.352 3.411) 4.144 16.643 ( 4.346 4.514 2.215) 6.646 16.982 ( -5.863 8.248 -5.064) 11.316 17.007 ( 5.104 -8.682 -0.046) 10.071 17.244 ( 11.041 6.519 -6.035) 14.171 23.688 ( -4.829 -1.702 2.566) 5.728 23.878 ( 5.439 1.696 3.769) 6.831 24.288 ( -8.356 -4.483 -9.209) 13.218 24.611 ( 6.744 3.063 -8.858) 11.547 24.859 ( -10.637 -5.707 10.485) 15.989 25.301 ( 4.053 -4.471 4.098) 7.295 25.387 ( 3.303 9.009 5.839) 11.232 25.706 ( 3.106 2.766 5.206) 6.663 26.489 ( -5.137 -4.603 -13.182) 14.878 27.377 ( -8.809 1.782 3.018) 9.480 27.604 ( 13.366 2.608 -0.974) 13.653 28.000 ( 0.700 -0.529 -14.219) 14.246 29.502 ( -5.858 -3.511 5.652) 8.865 29.690 ( -3.204 -2.805 4.667) 6.318 29.733 ( -3.355 -1.461 5.641) 6.724 30.433 ( -1.694 -0.298 -3.189) 3.623 30.526 ( 1.680 -0.274 0.043) 1.703 30.633 ( 8.074 5.808 -1.735) 10.096 39.014 ( -7.468 -4.495 -11.189) 14.184 39.347 ( 6.670 5.124 -18.361) 20.196 39.950 ( 5.707 -1.951 -7.169) 9.369 40.135 ( 8.889 9.129 -10.415) 16.457 42.112 ( 0.659 1.085 9.715) 9.798 43.547 ( -5.686 -1.199 10.864) 12.320 43.607 ( -2.157 -2.869 7.949) 8.722 44.438 ( -10.708 -8.602 8.540) 16.174 44.889 ( 8.668 7.409 0.555) 11.417 45.111 ( -1.407 -1.788 -7.726) 8.054 47.923 ( 0.683 0.406 0.539) 0.960 48.272 ( 0.223 0.125 -0.126) 0.285 ======================= Grid point 275 (116/125) ======================= q-point: (-0.44 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.457 ( -16.623 -16.162 9.211) 24.947 4.493 ( -9.806 -8.594 12.265) 17.901 5.030 ( -15.107 0.443 2.778) 15.367 5.273 ( -9.638 16.419 7.667) 20.525 5.867 ( 3.055 -7.609 -4.478) 9.343 6.078 ( 13.616 -3.122 -9.622) 16.963 6.337 ( -16.225 4.058 -13.172) 21.289 6.782 ( -0.312 -12.165 -8.684) 14.949 6.953 ( 8.997 -19.052 3.989) 21.444 7.458 ( -4.923 22.338 -2.085) 22.969 8.010 ( 13.307 0.108 7.092) 15.079 8.231 ( 10.981 10.354 -6.875) 16.584 8.658 ( -11.805 1.086 15.930) 19.858 8.832 ( 3.492 -7.652 11.347) 14.125 9.200 ( -14.484 -6.424 -6.105) 16.980 9.731 ( 0.502 -6.540 -4.666) 8.049 9.861 ( 6.141 4.432 12.947) 14.999 10.086 ( 3.387 5.360 -0.687) 6.377 10.247 ( -2.101 6.402 -8.419) 10.783 10.694 ( -4.260 -5.650 2.215) 7.415 11.122 ( 0.877 1.707 -1.845) 2.662 11.637 ( 9.046 -1.234 -7.829) 12.027 11.762 ( 3.858 5.367 -2.617) 7.109 12.172 ( -0.506 1.071 3.736) 3.919 15.011 ( 9.384 5.574 -3.584) 11.488 16.569 ( 1.854 -1.732 3.681) 4.471 16.746 ( 3.264 5.864 -0.905) 6.772 16.952 ( 6.491 6.801 -8.923) 12.962 17.091 ( 5.402 -3.133 7.158) 9.499 17.384 ( 8.234 6.304 -2.898) 10.767 23.654 ( -2.894 -0.107 2.064) 3.557 24.007 ( 1.756 1.428 -0.406) 2.300 24.082 ( -1.464 -2.941 -0.691) 3.357 24.562 ( 0.655 -1.806 -10.109) 10.290 24.759 ( -10.112 -5.453 6.563) 13.231 25.330 ( 1.884 -4.716 -0.785) 5.139 25.568 ( 0.387 8.052 7.730) 11.168 25.849 ( 2.500 3.964 5.313) 7.084 26.314 ( 2.180 -1.587 -4.167) 4.964 27.248 ( -13.365 0.534 -1.397) 13.448 27.687 ( 4.064 -1.448 -7.332) 8.507 27.998 ( 15.309 4.532 -6.198) 17.127 29.398 ( -9.681 -5.455 1.914) 11.276 29.615 ( -5.350 -10.898 2.209) 12.340 29.730 ( -6.100 4.145 4.454) 8.616 30.388 ( -0.507 0.584 -1.639) 1.812 30.576 ( 4.465 0.279 0.156) 4.476 30.785 ( 7.598 5.917 -0.340) 9.636 38.835 ( -1.018 -1.418 -4.837) 5.142 39.245 ( 4.488 5.928 -17.613) 19.118 40.037 ( 13.488 -0.103 -0.766) 13.510 40.277 ( 14.247 13.007 -8.032) 20.897 42.205 ( -1.915 1.596 4.958) 5.549 43.536 ( -11.170 0.293 6.458) 12.906 43.588 ( -4.831 -8.327 5.669) 11.172 44.395 ( -3.683 -8.788 12.766) 15.930 44.896 ( -7.891 4.997 -7.514) 11.987 45.070 ( 6.643 -2.328 -2.837) 7.589 47.950 ( 1.283 0.824 0.770) 1.708 48.275 ( 0.366 0.196 -0.184) 0.454 ======================= Grid point 276 (117/125) ======================= q-point: (-0.33 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.092 ( -27.844 -15.040 16.562) 35.718 4.490 ( -18.192 -4.775 -0.431) 18.813 4.675 ( -11.501 -6.890 1.200) 13.461 5.475 ( -8.389 23.028 10.799) 26.782 5.604 ( -2.465 -17.039 -16.090) 23.565 6.126 ( 7.513 1.784 -8.699) 11.632 6.173 ( 0.647 -4.315 2.872) 5.224 6.631 ( 9.482 -11.852 -9.690) 18.007 7.054 ( 7.236 -6.886 7.292) 12.367 7.565 ( -2.717 20.934 -0.532) 21.116 8.252 ( 10.852 -7.014 2.277) 13.120 8.303 ( -2.332 6.251 4.618) 8.114 8.637 ( -8.425 -15.849 6.326) 19.031 8.850 ( -8.634 4.224 5.200) 10.928 9.106 ( 4.041 7.913 5.425) 10.410 9.509 ( -1.855 -8.814 -15.085) 17.569 9.999 ( -4.850 9.140 -5.967) 11.945 10.102 ( -0.203 -3.766 -4.754) 6.068 10.354 ( 8.063 9.529 14.157) 18.874 10.655 ( 1.556 -3.834 0.675) 4.193 11.174 ( 5.524 1.059 -1.187) 5.748 11.624 ( 3.550 1.392 -9.656) 10.381 11.800 ( 2.159 0.178 -1.923) 2.896 12.229 ( -0.443 1.831 4.669) 5.035 15.173 ( 11.619 6.979 -3.753) 14.064 16.618 ( -0.671 0.553 3.371) 3.482 16.794 ( 2.904 1.157 -4.194) 5.231 17.058 ( 10.547 7.741 -5.010) 14.010 17.251 ( 7.319 0.080 6.008) 9.469 17.524 ( 10.343 7.702 -2.720) 13.180 23.643 ( -3.574 0.529 1.746) 4.012 23.899 ( -0.060 -0.642 -7.978) 8.004 24.200 ( 0.232 -2.444 8.984) 9.314 24.390 ( -1.801 -2.731 -7.859) 8.513 24.655 ( -7.647 -4.225 2.741) 9.156 25.261 ( -1.220 -4.825 -4.208) 6.517 25.710 ( -2.596 7.094 8.496) 11.369 25.902 ( -1.641 -0.434 1.918) 2.561 26.485 ( 13.541 3.839 8.648) 16.519 27.000 ( -13.462 1.251 -6.598) 15.044 27.642 ( 4.196 -2.709 -5.649) 7.541 28.218 ( 17.664 7.232 -6.814) 20.267 29.221 ( -10.504 -3.178 -0.710) 10.997 29.450 ( -6.426 -14.573 2.635) 16.144 29.725 ( -6.411 5.285 2.560) 8.695 30.393 ( -0.128 2.484 0.972) 2.670 30.635 ( 4.180 -0.843 -0.772) 4.333 30.909 ( 5.127 2.732 -0.192) 5.813 38.843 ( 5.287 1.123 0.859) 5.473 39.173 ( 6.015 8.767 -16.677) 19.778 40.295 ( 17.617 2.751 5.525) 18.667 40.542 ( 18.847 14.260 -5.460) 24.257 42.198 ( -5.009 1.087 0.430) 5.143 43.370 ( -16.107 -2.527 -1.231) 16.350 43.497 ( -6.610 -9.562 5.262) 12.760 44.429 ( -1.557 -13.969 7.425) 15.896 44.732 ( -12.346 9.113 0.467) 15.352 45.104 ( 7.010 -3.326 -2.835) 8.260 47.985 ( 1.405 0.944 0.428) 1.746 48.279 ( 0.303 0.158 -0.249) 0.423 ======================= Grid point 283 (118/125) ======================= q-point: ( 0.44 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.617 ( -5.269 -12.006 18.804) 22.924 4.876 ( 3.022 -9.714 5.924) 11.772 5.029 ( 0.826 3.152 8.413) 9.022 5.404 ( 11.239 -11.180 0.445) 15.858 5.778 ( -5.793 11.226 -11.054) 16.786 5.939 ( -4.057 9.267 -4.009) 10.882 6.580 ( 11.043 -20.991 -3.004) 23.908 6.866 ( -10.921 -27.014 -8.302) 30.297 7.040 ( -8.970 7.066 0.456) 11.427 7.523 ( 4.581 9.046 -9.718) 14.044 7.701 ( 11.157 16.779 -2.727) 20.334 7.903 ( -6.817 13.864 -0.652) 15.463 8.748 ( 2.795 -8.835 15.684) 18.217 8.913 ( -2.420 2.574 11.014) 11.567 9.501 ( -0.708 -10.778 -4.171) 11.578 9.653 ( -3.376 -0.297 14.880) 15.261 9.791 ( 2.555 5.277 -8.131) 10.025 10.020 ( -0.629 -2.583 0.050) 2.659 10.218 ( 2.886 8.120 -3.016) 9.130 10.807 ( -1.333 -3.450 4.391) 5.741 11.265 ( 13.085 -8.416 -5.801) 16.604 11.334 ( -13.886 -3.780 -2.438) 14.596 11.701 ( 1.076 13.078 -5.735) 14.320 12.178 ( 0.247 2.637 1.924) 3.273 14.872 ( 0.029 4.642 -3.229) 5.655 16.545 ( -1.399 -4.003 2.067) 4.717 16.651 ( 1.644 3.336 0.640) 3.774 16.847 ( 0.741 3.852 -8.023) 8.931 17.126 ( -4.310 5.616 1.636) 7.266 17.204 ( 3.192 6.806 3.526) 8.303 23.728 ( 0.525 -5.806 3.935) 7.033 23.900 ( -0.495 1.713 4.397) 4.744 24.154 ( 0.023 -11.082 -8.559) 14.003 24.520 ( -0.471 10.870 -10.335) 15.007 24.977 ( 0.180 -12.387 7.950) 14.719 25.322 ( -3.079 -3.408 3.481) 5.763 25.480 ( 3.190 11.151 5.685) 12.917 25.772 ( 0.720 5.724 4.512) 7.324 26.365 ( -0.764 1.940 -12.407) 12.581 27.451 ( 9.610 -3.723 1.876) 10.475 27.539 ( -7.993 3.371 -1.180) 8.754 27.835 ( -1.442 -0.437 -10.047) 10.159 29.538 ( -0.388 -11.695 4.327) 12.475 29.726 ( 0.608 -6.094 4.913) 7.852 29.841 ( -0.592 1.366 3.602) 3.898 30.430 ( 0.573 3.084 -3.385) 4.615 30.517 ( -1.769 1.623 -2.432) 3.417 30.580 ( 1.576 7.489 0.037) 7.653 38.887 ( -0.372 -8.770 -6.868) 11.145 39.142 ( 1.028 3.991 -14.700) 15.267 39.870 ( -2.608 6.129 -4.187) 7.868 40.057 ( 1.810 16.556 -9.087) 18.972 42.211 ( 0.613 -1.002 7.503) 7.594 43.629 ( 1.044 -9.712 8.917) 13.226 43.715 ( -0.663 -1.642 5.530) 5.807 44.505 ( -2.231 -13.762 7.702) 15.928 44.891 ( 3.025 8.126 -3.018) 9.181 45.055 ( -1.642 4.259 -5.293) 6.990 47.930 ( 0.020 0.646 0.808) 1.034 48.270 ( -0.004 0.216 -0.163) 0.270 ======================= Grid point 284 (119/125) ======================= q-point: (-0.44 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.593 ( -8.331 -13.313 10.432) 18.854 4.728 ( -11.466 -12.961 7.547) 18.879 5.146 ( 0.571 -3.583 -3.808) 5.260 5.464 ( -4.673 -2.371 2.588) 5.845 5.772 ( 16.102 1.691 -3.842) 16.640 5.878 ( -9.588 11.319 -3.465) 15.234 6.314 ( -8.400 -28.620 -11.320) 31.903 6.607 ( 2.577 -4.772 1.471) 5.619 6.944 ( -10.530 3.712 3.028) 11.569 7.568 ( 7.966 8.249 -5.118) 12.558 7.954 ( 1.176 11.166 -1.404) 11.315 8.075 ( 15.620 15.577 0.850) 22.076 8.842 ( -2.607 -11.089 11.376) 16.099 9.042 ( -4.009 2.126 16.723) 17.328 9.253 ( -10.514 -7.387 -5.546) 13.995 9.568 ( -1.638 -7.996 -13.334) 15.634 9.900 ( 6.086 0.376 5.423) 8.160 10.036 ( 2.061 -0.812 0.459) 2.263 10.322 ( 1.880 13.519 -0.788) 13.671 10.742 ( -6.933 -8.951 2.808) 11.665 11.149 ( -4.750 2.233 -1.807) 5.551 11.372 ( 12.958 -3.449 -2.077) 13.570 11.741 ( 1.693 7.758 -4.725) 9.240 12.227 ( 0.154 3.868 1.273) 4.075 14.928 ( 4.944 6.936 -1.582) 8.664 16.568 ( 3.058 -2.360 4.916) 6.252 16.689 ( 2.532 1.185 -3.514) 4.491 16.858 ( 3.442 12.005 -5.933) 13.827 17.156 ( -1.315 2.561 5.475) 6.186 17.346 ( 4.529 6.918 -0.060) 8.269 23.711 ( -2.804 -3.154 3.635) 5.570 23.926 ( 0.542 -6.425 -6.267) 8.992 24.070 ( 4.403 -2.851 8.095) 9.646 24.463 ( -1.443 7.171 -11.026) 13.231 24.893 ( -7.014 -10.170 4.140) 13.029 25.293 ( -1.298 -5.439 1.808) 5.877 25.676 ( 3.246 8.595 4.359) 10.169 25.897 ( 3.269 4.835 2.288) 6.269 26.280 ( 0.102 9.769 -4.965) 10.958 27.349 ( -9.273 -6.444 -6.496) 13.027 27.563 ( 4.610 -1.989 -1.344) 5.198 27.812 ( 6.981 5.077 -0.718) 8.662 29.428 ( -4.581 -14.104 1.955) 14.958 29.696 ( -7.863 -4.105 2.684) 9.268 29.847 ( 0.160 -0.650 1.802) 1.922 30.360 ( -2.519 -1.018 -2.609) 3.767 30.560 ( 1.921 4.731 -0.173) 5.109 30.721 ( 7.692 8.501 -0.252) 11.467 38.782 ( -0.207 -3.819 -0.413) 3.847 39.039 ( 3.486 2.736 -12.683) 13.435 39.945 ( 6.050 10.534 1.068) 12.194 40.168 ( 7.454 19.327 -7.595) 22.063 42.270 ( -0.386 -1.823 3.211) 3.713 43.616 ( -2.214 -13.355 5.460) 14.597 43.694 ( -5.914 -3.601 2.430) 7.338 44.467 ( -2.177 -11.781 9.969) 15.586 44.937 ( 3.890 3.495 -6.339) 8.217 44.998 ( -4.930 5.905 -2.768) 8.175 47.952 ( 0.747 0.988 0.709) 1.427 48.271 ( 0.195 0.253 -0.159) 0.357 ======================= Grid point 285 (120/125) ======================= q-point: (-0.33 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.434 ( -11.558 -11.665 6.780) 17.766 4.616 ( -9.522 -9.977 11.183) 17.756 4.881 ( -17.265 -4.258 -8.918) 19.893 5.220 ( -3.308 -25.892 -14.715) 29.965 5.864 ( -5.012 13.649 3.497) 14.954 6.016 ( 12.324 -3.625 7.186) 14.720 6.042 ( 1.410 -4.751 -5.184) 7.172 6.544 ( -10.441 10.461 -1.909) 14.902 7.000 ( 6.117 -2.454 6.872) 9.521 7.703 ( 6.835 9.897 -2.543) 12.294 8.045 ( 6.286 1.909 -3.474) 7.432 8.354 ( 6.837 7.240 4.164) 10.794 8.730 ( -12.871 -14.296 5.347) 19.966 9.070 ( -5.872 -3.940 4.640) 8.458 9.186 ( -1.071 -2.968 -1.092) 3.339 9.295 ( -2.972 -0.809 -5.237) 6.075 10.015 ( 5.360 -9.237 0.628) 10.698 10.023 ( 0.464 7.183 -4.530) 8.505 10.484 ( 4.763 12.739 2.190) 13.776 10.598 ( -4.167 -6.409 -0.434) 7.657 11.142 ( 0.011 2.894 0.108) 2.896 11.487 ( 6.348 2.175 -2.744) 7.250 11.767 ( 1.256 2.678 -1.238) 3.207 12.277 ( 1.450 2.373 1.410) 3.118 15.065 ( 7.610 8.329 -1.511) 11.383 16.652 ( 0.453 0.275 -4.724) 4.754 16.680 ( 3.983 -0.202 3.345) 5.205 16.993 ( 6.756 13.450 -2.268) 15.221 17.253 ( 3.149 1.670 5.426) 6.492 17.453 ( 6.187 7.612 -2.109) 10.033 23.706 ( -2.027 -0.016 3.140) 3.737 23.785 ( -1.193 -4.934 -7.562) 9.107 24.265 ( 5.083 -4.404 12.476) 14.173 24.320 ( -3.979 2.524 -9.823) 10.895 24.759 ( -7.494 -4.947 1.191) 9.058 25.226 ( -3.629 -4.933 -0.423) 6.138 25.804 ( 3.515 3.819 2.070) 5.588 25.951 ( 0.052 3.591 -1.597) 3.930 26.455 ( 10.410 10.476 4.861) 15.548 27.066 ( -10.650 -8.592 -5.120) 14.610 27.551 ( 0.435 -1.503 -1.803) 2.387 28.019 ( 11.813 9.369 -0.206) 15.079 29.261 ( -5.481 -10.909 0.004) 12.208 29.537 ( -11.026 -3.842 0.567) 11.691 29.866 ( -3.036 1.876 1.867) 4.028 30.335 ( 5.842 -6.175 0.301) 8.506 30.604 ( -0.332 4.192 -0.474) 4.232 30.871 ( 4.745 6.194 -0.642) 7.829 38.811 ( 3.080 -0.216 4.041) 5.085 38.987 ( 4.266 6.418 -11.394) 13.756 40.220 ( 12.702 13.414 6.171) 19.477 40.402 ( 13.692 19.393 -3.998) 24.074 42.233 ( -3.179 -3.434 -1.887) 5.046 43.462 ( -8.985 -13.028 -1.962) 15.947 43.570 ( -7.594 -8.028 2.607) 11.354 44.442 ( -5.250 -11.266 5.925) 13.769 44.869 ( -0.538 3.811 -8.145) 9.009 45.041 ( 1.425 3.500 6.156) 7.223 47.979 ( 1.012 1.080 0.079) 1.482 48.275 ( 0.235 0.230 -0.098) 0.343 ======================= Grid point 292 (121/125) ======================= q-point: ( 0.44 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.705 ( 8.549 -6.711 5.423) 12.147 4.772 ( 8.532 -13.407 9.690) 18.613 5.025 ( 4.296 -9.024 -2.246) 10.243 5.163 ( 6.928 -14.023 9.782) 18.448 5.914 ( -10.204 8.736 -3.074) 13.780 6.009 ( -2.565 12.723 -8.698) 15.624 6.164 ( 14.281 -18.183 -5.770) 23.829 6.762 ( -7.114 -13.131 -5.833) 16.033 7.120 ( -3.707 -3.717 -3.851) 6.511 7.375 ( 15.088 19.984 1.843) 25.108 7.888 ( -17.250 5.898 0.287) 18.233 8.141 ( -7.781 17.616 -1.022) 19.285 8.845 ( 2.056 -9.651 18.496) 20.964 9.005 ( 3.798 -4.364 8.235) 10.064 9.263 ( 12.062 -6.205 -7.278) 15.394 9.652 ( -2.784 -1.997 -12.964) 13.409 9.903 ( -2.845 0.035 6.157) 6.782 10.033 ( -2.876 -2.654 1.786) 4.301 10.227 ( 2.587 10.497 2.211) 11.035 10.769 ( 5.792 -9.471 1.633) 11.221 11.084 ( -0.473 1.072 -1.027) 1.558 11.461 ( -10.047 -0.904 -3.502) 10.678 11.723 ( -1.361 8.826 -4.762) 10.120 12.219 ( 0.343 3.347 1.756) 3.795 14.927 ( -4.869 6.760 -1.523) 8.469 16.562 ( -2.610 -3.977 2.002) 5.161 16.694 ( -2.726 3.942 0.396) 4.809 16.843 ( -2.954 9.620 -5.514) 11.475 17.236 ( 1.659 7.301 4.598) 8.786 17.286 ( -5.777 3.772 -0.813) 6.947 23.704 ( 3.356 -4.434 4.809) 7.352 23.902 ( -0.373 -7.197 -5.767) 9.230 24.104 ( -5.308 -0.134 6.490) 8.386 24.475 ( 1.079 8.289 -12.082) 14.691 24.893 ( 6.618 -10.826 4.413) 13.434 25.333 ( -0.359 -5.363 -0.202) 5.379 25.629 ( -0.727 8.029 7.313) 10.885 25.866 ( -1.684 2.360 2.883) 4.089 26.301 ( -1.325 11.441 -6.120) 13.043 27.266 ( 9.941 -10.845 -0.504) 14.721 27.584 ( -4.237 -1.178 -4.662) 6.409 27.878 ( -8.367 8.981 -3.088) 12.658 29.439 ( 5.626 -12.808 1.503) 14.069 29.682 ( 1.012 -9.269 2.866) 9.755 29.854 ( 6.403 3.737 1.745) 7.616 30.357 ( 3.259 -0.708 -2.272) 4.035 30.573 ( -4.312 3.725 -1.251) 5.834 30.705 ( -6.731 8.478 0.866) 10.860 38.798 ( -0.527 -2.825 0.038) 2.875 39.004 ( -1.738 0.397 -12.190) 12.320 40.019 ( -10.601 13.909 -0.713) 17.503 40.119 ( -4.168 17.822 -7.028) 19.605 42.245 ( 1.633 -4.017 4.290) 6.099 43.589 ( 4.560 -12.534 5.954) 14.607 43.710 ( 4.017 -5.123 2.467) 6.962 44.558 ( -3.123 -8.556 11.131) 14.383 44.791 ( 6.171 0.159 -7.242) 9.516 45.084 ( -1.257 8.383 -4.361) 9.533 47.951 ( -0.699 0.902 0.740) 1.360 48.271 ( -0.203 0.270 -0.165) 0.376 ======================= Grid point 293 (122/125) ======================= q-point: (-0.44 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.648 ( -2.215 -16.661 0.202) 16.808 4.805 ( -3.714 -12.449 10.705) 16.833 4.914 ( 3.647 -13.639 -11.351) 18.115 5.471 ( 21.185 -10.621 13.516) 27.282 5.659 ( -17.881 5.346 -10.456) 21.393 6.006 ( 1.161 3.154 -2.855) 4.410 6.176 ( -8.194 -5.963 -2.942) 10.552 6.485 ( 7.277 -9.606 4.229) 12.771 7.154 ( 4.716 2.941 -1.655) 5.799 7.454 ( -11.090 8.416 -5.077) 14.819 8.007 ( 11.329 15.003 4.384) 19.304 8.171 ( -6.299 17.743 -0.808) 18.845 8.906 ( -0.586 -12.332 8.252) 14.850 9.190 ( -0.499 -6.317 -8.640) 10.715 9.209 ( 7.002 -6.285 17.303) 19.696 9.373 ( -5.104 -6.175 -16.798) 18.610 9.898 ( -2.866 -2.022 2.713) 4.434 10.046 ( -0.814 -0.087 2.280) 2.422 10.368 ( 1.566 12.294 -1.876) 12.535 10.749 ( 2.027 -10.462 0.139) 10.658 11.109 ( 3.271 3.312 -1.498) 4.890 11.368 ( -4.397 2.329 5.693) 7.561 11.733 ( 0.665 6.641 -3.110) 7.364 12.259 ( 0.008 3.899 -0.881) 3.998 14.949 ( 0.071 8.833 0.197) 8.836 16.583 ( 1.380 -0.110 5.857) 6.019 16.683 ( -2.187 2.531 -1.352) 3.608 16.858 ( 1.145 11.723 -4.092) 12.469 17.262 ( -2.209 4.346 0.555) 4.907 17.345 ( 1.735 7.000 -0.177) 7.214 23.755 ( -0.573 -5.527 3.604) 6.623 23.796 ( 1.625 -4.579 -2.542) 5.484 24.138 ( -1.548 -2.046 10.912) 11.210 24.415 ( -0.214 8.097 -11.640) 14.181 24.875 ( 0.563 -11.654 0.840) 11.697 25.282 ( -0.100 -6.708 1.704) 6.921 25.755 ( -0.081 7.993 0.802) 8.033 25.898 ( 0.695 1.575 0.531) 1.802 26.339 ( -0.358 18.253 -4.603) 18.828 27.223 ( 1.338 -14.933 -5.114) 15.841 27.531 ( 0.305 -0.680 2.838) 2.934 27.871 ( -1.691 10.872 1.838) 11.155 29.383 ( -1.489 -13.730 1.982) 13.951 29.684 ( 7.966 -9.662 0.597) 12.537 29.829 ( -7.030 -2.863 -2.208) 7.905 30.405 ( -2.180 2.645 -2.681) 4.351 30.544 ( 3.217 4.008 0.955) 5.228 30.756 ( -0.405 9.880 1.398) 9.986 38.808 ( -1.318 0.307 6.224) 6.369 38.897 ( 1.654 1.286 -7.880) 8.153 40.050 ( -1.832 16.644 1.668) 16.827 40.187 ( 1.316 21.692 -6.326) 22.634 42.267 ( 0.647 -4.597 1.632) 4.921 43.568 ( -0.334 -15.654 3.931) 16.143 43.705 ( 0.515 -6.890 -0.128) 6.911 44.534 ( -2.460 -10.710 8.943) 14.169 44.832 ( 3.606 3.248 -5.089) 7.032 45.051 ( -1.808 5.741 -4.990) 7.818 47.962 ( 0.028 1.241 0.412) 1.308 48.271 ( -0.007 0.311 -0.036) 0.313 ======================= Grid point 294 (123/125) ======================= q-point: (-0.33 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.463 ( -4.002 -19.794 -0.366) 20.197 4.624 ( -0.441 -25.122 -13.905) 28.717 4.747 ( -1.666 -10.796 5.988) 12.457 5.227 ( -25.291 -1.814 -10.399) 27.406 5.746 ( 9.716 -16.884 6.469) 20.526 5.982 ( 2.379 4.334 6.478) 8.149 6.177 ( 0.976 16.056 1.439) 16.150 6.706 ( 7.797 2.545 6.701) 10.591 7.136 ( -13.113 7.931 4.129) 15.871 7.417 ( 15.352 -1.810 -8.959) 17.867 8.143 ( -7.482 10.371 0.008) 12.788 8.352 ( 9.574 11.554 1.172) 15.051 8.853 ( -6.897 -14.039 7.151) 17.198 8.931 ( -4.786 -13.181 -17.840) 22.692 9.099 ( -1.872 -0.465 -7.201) 7.455 9.468 ( 3.554 -2.151 16.207) 16.731 9.861 ( -0.487 -8.762 1.978) 8.996 10.046 ( -1.514 2.122 1.199) 2.869 10.438 ( 5.804 11.621 -8.709) 15.639 10.678 ( -4.628 -0.838 -0.249) 4.710 11.158 ( 1.126 4.420 -2.047) 4.999 11.481 ( 1.644 3.228 8.518) 9.256 11.775 ( 1.222 3.928 0.575) 4.154 12.265 ( 1.263 1.355 -2.235) 2.903 15.064 ( 3.242 10.726 1.163) 11.265 16.602 ( -3.297 0.591 -3.177) 4.616 16.730 ( 2.230 3.195 5.793) 6.981 16.982 ( 6.229 11.788 -0.798) 13.356 17.298 ( 1.467 4.133 0.190) 4.390 17.421 ( 3.086 9.379 -1.119) 9.937 23.685 ( -0.984 -4.331 -4.151) 6.079 23.799 ( -3.362 -0.082 4.943) 5.979 24.270 ( 1.887 -3.971 3.038) 5.344 24.324 ( -0.637 2.646 0.925) 2.874 24.774 ( -1.978 -7.645 -2.480) 8.278 25.254 ( -2.699 -4.523 2.772) 5.952 25.764 ( 2.502 1.799 -5.651) 6.437 25.917 ( 1.180 1.760 -1.767) 2.759 26.478 ( 4.772 16.097 -2.157) 16.927 27.021 ( -4.185 -15.749 -1.959) 16.413 27.574 ( -1.281 1.821 3.995) 4.573 28.048 ( 4.121 14.418 5.568) 15.996 29.241 ( -4.960 -11.949 0.685) 12.955 29.651 ( -9.614 -2.472 -2.183) 10.164 29.760 ( 13.332 -9.371 -1.204) 16.341 30.313 ( -6.576 -0.460 0.096) 6.592 30.641 ( 1.593 3.709 0.587) 4.079 30.867 ( 3.194 8.321 0.036) 8.913 38.847 ( -0.630 2.925 -1.606) 3.395 38.931 ( 1.459 5.467 6.220) 8.409 40.285 ( 8.916 17.716 6.300) 20.809 40.360 ( 7.604 22.610 -4.760) 24.325 42.210 ( -3.015 -5.471 -2.259) 6.643 43.418 ( -5.803 -17.075 -0.400) 18.039 43.606 ( -4.320 -8.046 -1.217) 9.213 44.533 ( -5.198 -10.446 9.939) 15.327 44.733 ( 0.547 0.467 -13.906) 13.924 45.114 ( 4.787 5.357 4.157) 8.300 47.978 ( 0.367 1.387 -0.240) 1.455 48.275 ( 0.093 0.317 0.128) 0.354 ======================= Grid point 364 (124/125) ======================= q-point: ( 0.44 0.44 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.994 ( 0.000 -0.000 13.097) 13.097 4.994 ( 0.000 -0.000 13.097) 13.097 5.123 ( 0.000 -0.000 4.734) 4.734 5.472 ( -0.000 0.000 -8.892) 8.892 5.472 ( -0.000 0.000 -8.892) 8.892 5.843 ( -0.000 0.000 -2.763) 2.763 6.910 ( 0.000 -0.000 4.563) 4.563 6.910 ( 0.000 -0.000 4.563) 4.563 7.190 ( 0.000 0.000 -9.716) 9.716 7.190 ( -0.000 0.000 -9.716) 9.716 7.401 ( -0.000 0.000 -4.548) 4.548 7.769 ( -0.000 0.000 -0.743) 0.743 9.025 ( 0.000 -0.000 13.952) 13.952 9.025 ( 0.000 -0.000 13.952) 13.952 9.550 ( -0.000 0.000 -10.852) 10.852 9.550 ( -0.000 0.000 -10.852) 10.852 9.879 ( 0.000 -0.000 15.745) 15.745 10.087 ( 0.000 0.000 -0.689) 0.689 10.087 ( -0.000 0.000 -0.689) 0.689 10.902 ( 0.000 -0.000 6.840) 6.840 11.357 ( -0.000 0.000 -2.819) 2.819 11.357 ( -0.000 0.000 -2.819) 2.819 11.390 ( -0.000 0.000 -9.768) 9.768 12.177 ( 0.000 -0.000 1.201) 1.201 14.804 ( -0.000 0.000 -1.593) 1.593 16.616 ( 0.000 -0.000 1.099) 1.099 16.616 ( 0.000 -0.000 1.099) 1.099 16.676 ( -0.000 0.000 -8.863) 8.863 17.177 ( 0.000 -0.000 4.436) 4.436 17.177 ( 0.000 -0.000 4.436) 4.436 23.884 ( 0.000 -0.000 5.384) 5.384 23.884 ( 0.000 -0.000 5.384) 5.384 24.218 ( -0.000 0.000 -9.681) 9.681 24.218 ( -0.000 0.000 -9.681) 9.681 25.230 ( 0.000 -0.000 7.352) 7.352 25.388 ( 0.000 -0.000 2.555) 2.555 25.388 ( 0.000 -0.000 2.555) 2.555 25.786 ( 0.000 -0.000 6.115) 6.115 26.196 ( -0.000 0.000 -13.034) 13.034 27.515 ( 0.000 -0.000 1.492) 1.492 27.515 ( 0.000 -0.000 1.492) 1.492 27.713 ( -0.000 0.000 -8.427) 8.427 29.698 ( 0.000 -0.000 4.072) 4.072 29.858 ( 0.000 -0.000 3.326) 3.326 29.858 ( 0.000 -0.000 3.326) 3.326 30.366 ( -0.000 0.000 -2.849) 2.849 30.479 ( -0.000 0.000 -1.820) 1.820 30.479 ( -0.000 0.000 -1.820) 1.820 38.926 ( -0.000 0.000 -6.841) 6.841 38.926 ( -0.000 0.000 -6.841) 6.841 39.805 ( -0.000 0.000 -4.297) 4.297 39.805 ( -0.000 0.000 -4.297) 4.297 42.298 ( 0.000 -0.000 5.206) 5.206 43.791 ( 0.000 -0.000 4.846) 4.846 43.791 ( 0.000 -0.000 4.846) 4.846 44.737 ( 0.000 -0.000 1.281) 1.281 44.737 ( -0.000 -0.000 1.281) 1.281 44.968 ( -0.000 0.000 -4.388) 4.388 47.933 ( 0.000 -0.000 0.653) 0.653 48.266 ( -0.000 0.000 -0.134) 0.134 ======================= Grid point 365 (125/125) ======================= q-point: (-0.44 0.44 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 0.00e+00 0.00e+00 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.891 ( -14.027 -9.619 6.195) 18.101 5.025 ( -8.992 -10.567 6.032) 15.130 5.107 ( -8.781 0.686 -7.869) 11.811 5.397 ( 2.433 8.831 7.615) 11.912 5.638 ( 15.840 4.277 -8.354) 18.411 5.821 ( 2.404 -0.379 0.011) 2.434 6.554 ( -31.153 -8.039 1.198) 32.195 6.765 ( -10.616 -15.762 -6.951) 20.235 7.089 ( 8.168 -12.105 4.133) 15.177 7.262 ( 1.576 19.786 -0.499) 19.855 7.726 ( 23.638 12.425 -4.062) 27.012 7.876 ( 11.662 6.037 0.874) 13.161 9.131 ( -1.189 -6.127 10.066) 11.843 9.149 ( -6.464 1.625 5.286) 8.507 9.316 ( -8.518 -2.813 2.509) 9.315 9.470 ( 1.502 -1.770 -15.138) 15.315 9.952 ( -2.485 -2.437 2.144) 4.088 10.090 ( -0.198 -0.430 -3.206) 3.240 10.155 ( 5.747 5.599 5.373) 9.657 10.957 ( -8.469 -7.673 8.160) 14.043 11.063 ( -4.816 1.280 -6.502) 8.191 11.375 ( 4.548 -0.164 -4.402) 6.332 11.555 ( 10.589 7.226 -0.747) 12.842 12.203 ( 1.581 0.979 0.713) 1.991 14.835 ( 4.565 2.645 -0.530) 5.302 16.625 ( -0.484 1.769 0.025) 1.834 16.644 ( 3.006 -1.055 -2.518) 4.061 16.662 ( 5.499 3.994 0.278) 6.802 17.215 ( 1.555 -1.067 3.253) 3.760 17.257 ( 2.965 3.568 -0.187) 4.643 23.830 ( -6.426 -4.135 5.778) 9.580 23.925 ( -5.077 -2.057 -6.529) 8.523 24.151 ( 6.828 3.403 8.029) 11.075 24.232 ( 5.088 2.962 -10.374) 11.928 25.092 ( -12.761 -7.319 1.547) 14.792 25.376 ( -2.758 -2.525 0.497) 3.772 25.587 ( 9.844 6.537 2.469) 12.072 25.881 ( 1.372 1.080 3.102) 3.560 26.111 ( 5.786 3.236 -4.725) 8.141 27.409 ( -10.017 -4.854 0.259) 11.135 27.552 ( 1.565 0.848 -1.799) 2.530 27.726 ( 7.376 3.293 -1.274) 8.177 29.623 ( -10.705 -5.853 0.344) 12.205 29.822 ( -3.493 -8.137 1.203) 8.936 29.850 ( -5.042 2.963 1.668) 6.081 30.356 ( 1.005 0.784 -0.127) 1.281 30.494 ( 3.215 0.966 -1.118) 3.538 30.579 ( 10.032 6.400 -0.591) 11.914 38.837 ( -1.318 -1.602 1.835) 2.769 38.885 ( -0.040 0.986 -6.796) 6.867 39.853 ( 10.101 2.703 0.552) 10.471 39.876 ( 9.031 8.140 -2.821) 12.481 42.323 ( -1.900 -0.910 1.536) 2.607 43.768 ( -6.872 -2.970 1.285) 7.595 43.793 ( -3.559 -2.915 1.645) 4.885 44.698 ( -1.002 -5.993 4.360) 7.478 44.769 ( -2.293 5.166 -3.929) 6.884 44.958 ( 3.094 0.422 -0.710) 3.202 47.946 ( 0.703 0.415 0.250) 0.854 48.267 ( 0.189 0.107 -0.064) 0.226 =================== 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 3/43740 10.0 1722.413 1722.413 983.187 0.000 -0.000 0.000 3/43740 20.0 1676.151 1676.151 1373.047 0.000 -0.000 0.000 3/43740 30.0 813.342 813.342 739.282 0.000 -0.000 0.000 3/43740 40.0 398.022 398.022 368.349 0.000 -0.000 0.000 3/43740 50.0 213.097 213.097 199.054 0.000 -0.000 0.000 3/43740 60.0 127.793 127.793 119.938 0.000 -0.000 0.000 3/43740 70.0 84.587 84.587 79.518 0.000 -0.000 0.000 3/43740 80.0 60.477 60.477 56.865 0.000 -0.000 0.000 3/43740 90.0 45.838 45.838 43.094 0.000 -0.000 0.000 3/43740 100.0 36.311 36.311 34.136 0.000 -0.000 0.000 3/43740 110.0 29.751 29.751 27.976 0.000 -0.000 0.000 3/43740 120.0 25.025 25.025 23.544 0.000 -0.000 0.000 3/43740 130.0 21.493 21.493 20.236 0.000 -0.000 0.000 3/43740 140.0 18.772 18.772 17.689 0.000 -0.000 0.000 3/43740 150.0 16.622 16.622 15.677 0.000 -0.000 0.000 3/43740 160.0 14.888 14.888 14.055 0.000 -0.000 0.000 3/43740 170.0 13.464 13.464 12.722 0.000 -0.000 0.000 3/43740 180.0 12.277 12.277 11.610 0.000 -0.000 0.000 3/43740 190.0 11.273 11.273 10.669 0.000 -0.000 0.000 3/43740 200.0 10.415 10.415 9.863 0.000 -0.000 0.000 3/43740 210.0 9.674 9.674 9.167 0.000 -0.000 0.000 3/43740 220.0 9.027 9.027 8.559 0.000 -0.000 0.000 3/43740 230.0 8.459 8.459 8.024 0.000 -0.000 0.000 3/43740 240.0 7.957 7.957 7.551 0.000 -0.000 0.000 3/43740 250.0 7.509 7.509 7.128 0.000 -0.000 0.000 3/43740 260.0 7.107 7.107 6.749 0.000 -0.000 0.000 3/43740 270.0 6.746 6.746 6.407 0.000 -0.000 0.000 3/43740 280.0 6.419 6.419 6.097 0.000 -0.000 0.000 3/43740 290.0 6.121 6.121 5.815 0.000 -0.000 0.000 3/43740 300.0 5.849 5.849 5.558 0.000 -0.000 0.000 3/43740 310.0 5.600 5.600 5.322 0.000 -0.000 0.000 3/43740 320.0 5.371 5.371 5.104 0.000 -0.000 0.000 3/43740 330.0 5.160 5.160 4.903 0.000 -0.000 0.000 3/43740 340.0 4.964 4.964 4.718 0.000 -0.000 0.000 3/43740 350.0 4.783 4.783 4.545 0.000 -0.000 0.000 3/43740 360.0 4.614 4.614 4.384 0.000 -0.000 0.000 3/43740 370.0 4.457 4.457 4.235 0.000 -0.000 0.000 3/43740 380.0 4.310 4.310 4.095 0.000 -0.000 0.000 3/43740 390.0 4.172 4.172 3.964 0.000 -0.000 0.000 3/43740 400.0 4.043 4.043 3.840 0.000 -0.000 0.000 3/43740 410.0 3.922 3.922 3.725 0.000 -0.000 0.000 3/43740 420.0 3.807 3.807 3.616 0.000 -0.000 0.000 3/43740 430.0 3.699 3.699 3.513 0.000 -0.000 0.000 3/43740 440.0 3.597 3.597 3.415 0.000 -0.000 0.000 3/43740 450.0 3.501 3.501 3.323 0.000 -0.000 0.000 3/43740 460.0 3.410 3.410 3.236 0.000 -0.000 0.000 3/43740 470.0 3.323 3.323 3.153 0.000 -0.000 0.000 3/43740 480.0 3.240 3.240 3.075 0.000 -0.000 0.000 3/43740 490.0 3.162 3.162 3.000 0.000 -0.000 0.000 3/43740 500.0 3.087 3.087 2.929 0.000 -0.000 0.000 3/43740 510.0 3.016 3.016 2.861 0.000 -0.000 0.000 3/43740 520.0 2.948 2.948 2.796 0.000 -0.000 0.000 3/43740 530.0 2.883 2.883 2.734 0.000 -0.000 0.000 3/43740 540.0 2.821 2.821 2.675 0.000 -0.000 0.000 3/43740 550.0 2.762 2.762 2.618 0.000 -0.000 0.000 3/43740 560.0 2.705 2.705 2.564 0.000 -0.000 0.000 3/43740 570.0 2.650 2.650 2.512 0.000 -0.000 0.000 3/43740 580.0 2.598 2.598 2.462 0.000 -0.000 0.000 3/43740 590.0 2.547 2.547 2.414 0.000 -0.000 0.000 3/43740 600.0 2.499 2.499 2.367 0.000 -0.000 0.000 3/43740 610.0 2.452 2.452 2.323 0.000 -0.000 0.000 3/43740 620.0 2.407 2.407 2.280 0.000 -0.000 0.000 3/43740 630.0 2.364 2.364 2.239 0.000 -0.000 0.000 3/43740 640.0 2.322 2.322 2.199 0.000 -0.000 0.000 3/43740 650.0 2.282 2.282 2.161 0.000 -0.000 0.000 3/43740 660.0 2.243 2.243 2.124 0.000 -0.000 0.000 3/43740 670.0 2.206 2.206 2.088 0.000 -0.000 0.000 3/43740 680.0 2.170 2.170 2.054 0.000 -0.000 0.000 3/43740 690.0 2.135 2.135 2.020 0.000 -0.000 0.000 3/43740 700.0 2.101 2.101 1.988 0.000 -0.000 0.000 3/43740 710.0 2.068 2.068 1.957 0.000 -0.000 0.000 3/43740 720.0 2.036 2.036 1.927 0.000 -0.000 0.000 3/43740 730.0 2.005 2.005 1.897 0.000 -0.000 0.000 3/43740 740.0 1.975 1.975 1.869 0.000 -0.000 0.000 3/43740 750.0 1.946 1.946 1.841 0.000 -0.000 0.000 3/43740 760.0 1.918 1.918 1.814 0.000 -0.000 0.000 3/43740 770.0 1.891 1.891 1.788 0.000 -0.000 0.000 3/43740 780.0 1.864 1.864 1.763 0.000 -0.000 0.000 3/43740 790.0 1.839 1.839 1.739 0.000 -0.000 0.000 3/43740 800.0 1.814 1.814 1.715 0.000 -0.000 0.000 3/43740 810.0 1.789 1.789 1.692 0.000 -0.000 0.000 3/43740 820.0 1.766 1.766 1.669 0.000 -0.000 0.000 3/43740 830.0 1.742 1.742 1.647 0.000 -0.000 0.000 3/43740 840.0 1.720 1.720 1.626 0.000 -0.000 0.000 3/43740 850.0 1.698 1.698 1.605 0.000 -0.000 0.000 3/43740 860.0 1.677 1.677 1.585 0.000 -0.000 0.000 3/43740 870.0 1.656 1.656 1.565 0.000 -0.000 0.000 3/43740 880.0 1.636 1.636 1.546 0.000 -0.000 0.000 3/43740 890.0 1.616 1.616 1.527 0.000 -0.000 0.000 3/43740 900.0 1.597 1.597 1.509 0.000 -0.000 0.000 3/43740 910.0 1.578 1.578 1.491 0.000 -0.000 0.000 3/43740 920.0 1.559 1.559 1.473 0.000 -0.000 0.000 3/43740 930.0 1.542 1.542 1.456 0.000 -0.000 0.000 3/43740 940.0 1.524 1.524 1.440 0.000 -0.000 0.000 3/43740 950.0 1.507 1.507 1.423 0.000 -0.000 0.000 3/43740 960.0 1.490 1.490 1.408 0.000 -0.000 0.000 3/43740 970.0 1.474 1.474 1.392 0.000 -0.000 0.000 3/43740 980.0 1.458 1.458 1.377 0.000 -0.000 0.000 3/43740 990.0 1.442 1.442 1.362 0.000 -0.000 0.000 3/43740 1000.0 1.427 1.427 1.347 0.000 -0.000 0.000 3/43740 Thermal conductivity related properties were written into "kappa-m999.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 09:04:04]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|