----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 03:55:19]------------------------- Compiled with OpenMP support (max 48 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.913362765021721 -5.690078850000000 0.000000000000000 b 2.913362765021721 5.690078850000000 0.000000000000000 c -0.751174079085919 0.000000000000000 12.536761850764986 Atomic positions (fractional): *1 O 0.87047674935993 0.67316315164412 0.46527275189289 15.999 2 O 0.32683684835588 0.12952325064007 0.03472724810711 15.999 3 O 0.12952325064007 0.32683684835588 0.53472724810711 15.999 4 O 0.67316315164412 0.87047674935993 0.96527275189289 15.999 *5 O 0.99493705728439 0.00506294271561 0.25000000000000 15.999 6 O 0.00506294271561 0.99493705728439 0.75000000000000 15.999 *7 O 0.59542862149955 0.40457137850045 0.25000000000000 15.999 *8 O 0.85350822667875 0.51132054915573 0.86706917351242 15.999 9 O 0.51132054915573 0.85350822667875 0.36706917351242 15.999 10 O 0.14649177332125 0.48867945084427 0.13293082648758 15.999 11 O 0.48867945084427 0.14649177332125 0.63293082648758 15.999 12 O 0.40457137850045 0.59542862149955 0.75000000000000 15.999 *13 Zn 0.26964967628696 0.27376671462927 0.16349716316231 65.380 14 Zn 0.73035032371304 0.72623328537072 0.83650283683769 65.380 15 Zn 0.72623328537073 0.73035032371304 0.33650283683769 65.380 16 Zn 0.27376671462927 0.26964967628696 0.66349716316231 65.380 *17 Ba 0.97215212240980 0.56208004259811 0.65284715827387 137.327 18 Ba 0.56208004259811 0.97215212240980 0.15284715827387 137.327 19 Ba 0.02784787759020 0.43791995740189 0.34715284172613 137.327 20 Ba 0.43791995740189 0.02784787759020 0.84715284172613 137.327 *21 Ba 0.34437834893584 0.13703648618906 0.42487800544987 137.327 22 Ba 0.86296351381094 0.65562165106416 0.07512199455013 137.327 23 Ba 0.65562165106416 0.86296351381094 0.57512199455013 137.327 24 Ba 0.13703648618906 0.34437834893584 0.92487800544987 137.327 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.826725530043443 0.000000000000000 0.000000000000000 b 0.000000000000000 11.380157700000000 0.000000000000000 c -0.751174079085919 0.000000000000000 12.536761850764986 Atomic positions (fractional): *1 O 0.27181995050203 0.40134320114210 0.46527275189289 15.999 > 1 2 O 0.72818004949797 0.40134320114210 0.03472724810711 15.999 > 2 3 O 0.22818004949797 0.09865679885790 0.53472724810711 15.999 > 3 4 O 0.77181995050203 0.09865679885790 0.96527275189289 15.999 > 4 *5 O 0.00000000000000 0.00506294271561 0.25000000000000 15.999 > 5 6 O 0.50000000000000 0.49493705728439 0.75000000000000 15.999 > 6 *7 O 0.00000000000000 0.40457137850045 0.25000000000000 15.999 > 7 *8 O 0.18241438791724 0.32890616123849 0.86706917351242 15.999 > 8 9 O 0.68241438791724 0.17109383876151 0.36706917351242 15.999 > 9 10 O 0.31758561208276 0.17109383876151 0.13293082648758 15.999 > 10 11 O 0.81758561208276 0.32890616123849 0.63293082648758 15.999 > 11 12 O 0.50000000000000 0.09542862149955 0.75000000000000 15.999 > 12 13 O 0.77181995050203 0.90134320114210 0.46527275189289 15.999 > 1 14 O 0.22818004949797 0.90134320114210 0.03472724810711 15.999 > 2 15 O 0.72818004949797 0.59865679885790 0.53472724810711 15.999 > 3 16 O 0.27181995050203 0.59865679885790 0.96527275189289 15.999 > 4 17 O 0.50000000000000 0.50506294271561 0.25000000000000 15.999 > 5 18 O 0.00000000000000 0.99493705728439 0.75000000000000 15.999 > 6 19 O 0.50000000000000 0.90457137850045 0.25000000000000 15.999 > 7 20 O 0.68241438791724 0.82890616123849 0.86706917351242 15.999 > 8 21 O 0.18241438791724 0.67109383876151 0.36706917351242 15.999 > 9 22 O 0.81758561208276 0.67109383876151 0.13293082648758 15.999 > 10 23 O 0.31758561208276 0.82890616123849 0.63293082648758 15.999 > 11 24 O 0.00000000000000 0.59542862149955 0.75000000000000 15.999 > 12 *25 Zn 0.27170819545812 0.00205851917116 0.16349716316231 65.380 > 13 26 Zn 0.22829180454188 0.49794148082884 0.83650283683769 65.380 > 14 27 Zn 0.72829180454188 0.00205851917116 0.33650283683769 65.380 > 15 28 Zn 0.77170819545812 0.49794148082884 0.66349716316231 65.380 > 16 29 Zn 0.77170819545812 0.50205851917116 0.16349716316231 65.380 > 13 30 Zn 0.72829180454188 0.99794148082884 0.83650283683769 65.380 > 14 31 Zn 0.22829180454188 0.50205851917116 0.33650283683769 65.380 > 15 32 Zn 0.27170819545812 0.99794148082884 0.66349716316231 65.380 > 16 *33 Ba 0.26711608250395 0.29496396009415 0.65284715827387 137.327 > 17 34 Ba 0.76711608250395 0.20503603990585 0.15284715827387 137.327 > 18 35 Ba 0.23288391749605 0.20503603990585 0.34715284172613 137.327 > 19 36 Ba 0.73288391749605 0.29496396009415 0.84715284172613 137.327 > 20 *37 Ba 0.74070741756245 0.39632906862661 0.42487800544987 137.327 > 21 38 Ba 0.25929258243755 0.39632906862661 0.07512199455013 137.327 > 22 39 Ba 0.75929258243755 0.10367093137339 0.57512199455013 137.327 > 23 40 Ba 0.24070741756245 0.10367093137339 0.92487800544987 137.327 > 24 41 Ba 0.76711608250395 0.79496396009415 0.65284715827387 137.327 > 17 42 Ba 0.26711608250395 0.70503603990585 0.15284715827387 137.327 > 18 43 Ba 0.73288391749605 0.70503603990585 0.34715284172613 137.327 > 19 44 Ba 0.23288391749605 0.79496396009415 0.84715284172613 137.327 > 20 45 Ba 0.24070741756245 0.89632906862661 0.42487800544987 137.327 > 21 46 Ba 0.75929258243755 0.89632906862661 0.07512199455013 137.327 > 22 47 Ba 0.25929258243755 0.60367093137339 0.57512199455013 137.327 > 23 48 Ba 0.74070741756245 0.60367093137339 0.92487800544987 137.327 > 24 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.653451060086885 0.000000000000000 0.000000000000000 b 0.000000000000000 11.380157700000000 0.000000000000000 c -0.751174079085919 0.000000000000000 12.536761850764986 Atomic positions (fractional): *1 O 0.13590997525101 0.40134320114210 0.46527275189289 15.999 > 1 2 O 0.63590997525101 0.40134320114210 0.46527275189289 15.999 > 1 3 O 0.36409002474899 0.40134320114210 0.03472724810711 15.999 > 2 4 O 0.86409002474899 0.40134320114210 0.03472724810711 15.999 > 2 5 O 0.11409002474899 0.09865679885790 0.53472724810711 15.999 > 3 6 O 0.61409002474899 0.09865679885790 0.53472724810711 15.999 > 3 7 O 0.38590997525101 0.09865679885790 0.96527275189289 15.999 > 4 8 O 0.88590997525101 0.09865679885790 0.96527275189289 15.999 > 4 *9 O 0.00000000000000 0.00506294271561 0.25000000000000 15.999 > 5 10 O 0.50000000000000 0.00506294271561 0.25000000000000 15.999 > 5 11 O 0.25000000000000 0.49493705728439 0.75000000000000 15.999 > 6 12 O 0.75000000000000 0.49493705728439 0.75000000000000 15.999 > 6 *13 O 0.00000000000000 0.40457137850045 0.25000000000000 15.999 > 7 14 O 0.50000000000000 0.40457137850045 0.25000000000000 15.999 > 7 *15 O 0.09120719395862 0.32890616123849 0.86706917351242 15.999 > 8 16 O 0.59120719395862 0.32890616123849 0.86706917351242 15.999 > 8 17 O 0.34120719395862 0.17109383876151 0.36706917351242 15.999 > 9 18 O 0.84120719395862 0.17109383876151 0.36706917351242 15.999 > 9 19 O 0.15879280604138 0.17109383876151 0.13293082648758 15.999 > 10 20 O 0.65879280604138 0.17109383876151 0.13293082648758 15.999 > 10 21 O 0.40879280604138 0.32890616123849 0.63293082648758 15.999 > 11 22 O 0.90879280604138 0.32890616123849 0.63293082648758 15.999 > 11 23 O 0.25000000000000 0.09542862149955 0.75000000000000 15.999 > 12 24 O 0.75000000000000 0.09542862149955 0.75000000000000 15.999 > 12 25 O 0.38590997525101 0.90134320114210 0.46527275189289 15.999 > 1 26 O 0.88590997525101 0.90134320114210 0.46527275189289 15.999 > 1 27 O 0.11409002474899 0.90134320114210 0.03472724810711 15.999 > 2 28 O 0.61409002474899 0.90134320114210 0.03472724810711 15.999 > 2 29 O 0.36409002474899 0.59865679885790 0.53472724810711 15.999 > 3 30 O 0.86409002474899 0.59865679885790 0.53472724810711 15.999 > 3 31 O 0.13590997525101 0.59865679885790 0.96527275189289 15.999 > 4 32 O 0.63590997525101 0.59865679885790 0.96527275189289 15.999 > 4 33 O 0.25000000000000 0.50506294271561 0.25000000000000 15.999 > 5 34 O 0.75000000000000 0.50506294271561 0.25000000000000 15.999 > 5 35 O 0.00000000000000 0.99493705728439 0.75000000000000 15.999 > 6 36 O 0.50000000000000 0.99493705728439 0.75000000000000 15.999 > 6 37 O 0.25000000000000 0.90457137850045 0.25000000000000 15.999 > 7 38 O 0.75000000000000 0.90457137850045 0.25000000000000 15.999 > 7 39 O 0.34120719395862 0.82890616123849 0.86706917351242 15.999 > 8 40 O 0.84120719395862 0.82890616123849 0.86706917351242 15.999 > 8 41 O 0.09120719395862 0.67109383876151 0.36706917351242 15.999 > 9 42 O 0.59120719395862 0.67109383876151 0.36706917351242 15.999 > 9 43 O 0.40879280604138 0.67109383876151 0.13293082648758 15.999 > 10 44 O 0.90879280604138 0.67109383876151 0.13293082648758 15.999 > 10 45 O 0.15879280604138 0.82890616123849 0.63293082648758 15.999 > 11 46 O 0.65879280604138 0.82890616123849 0.63293082648758 15.999 > 11 47 O 0.00000000000000 0.59542862149955 0.75000000000000 15.999 > 12 48 O 0.50000000000000 0.59542862149955 0.75000000000000 15.999 > 12 *49 Zn 0.13585409772906 0.00205851917116 0.16349716316231 65.380 > 13 50 Zn 0.63585409772906 0.00205851917116 0.16349716316231 65.380 > 13 51 Zn 0.11414590227094 0.49794148082884 0.83650283683769 65.380 > 14 52 Zn 0.61414590227094 0.49794148082884 0.83650283683769 65.380 > 14 53 Zn 0.36414590227094 0.00205851917116 0.33650283683769 65.380 > 15 54 Zn 0.86414590227094 0.00205851917116 0.33650283683769 65.380 > 15 55 Zn 0.38585409772906 0.49794148082884 0.66349716316231 65.380 > 16 56 Zn 0.88585409772906 0.49794148082884 0.66349716316231 65.380 > 16 57 Zn 0.38585409772906 0.50205851917116 0.16349716316231 65.380 > 13 58 Zn 0.88585409772906 0.50205851917116 0.16349716316231 65.380 > 13 59 Zn 0.36414590227094 0.99794148082884 0.83650283683769 65.380 > 14 60 Zn 0.86414590227094 0.99794148082884 0.83650283683769 65.380 > 14 61 Zn 0.11414590227094 0.50205851917116 0.33650283683769 65.380 > 15 62 Zn 0.61414590227094 0.50205851917116 0.33650283683769 65.380 > 15 63 Zn 0.13585409772906 0.99794148082884 0.66349716316231 65.380 > 16 64 Zn 0.63585409772906 0.99794148082884 0.66349716316231 65.380 > 16 *65 Ba 0.13355804125198 0.29496396009415 0.65284715827387 137.327 > 17 66 Ba 0.63355804125198 0.29496396009415 0.65284715827387 137.327 > 17 67 Ba 0.38355804125198 0.20503603990585 0.15284715827387 137.327 > 18 68 Ba 0.88355804125198 0.20503603990585 0.15284715827387 137.327 > 18 69 Ba 0.11644195874802 0.20503603990585 0.34715284172613 137.327 > 19 70 Ba 0.61644195874802 0.20503603990585 0.34715284172613 137.327 > 19 71 Ba 0.36644195874802 0.29496396009415 0.84715284172613 137.327 > 20 72 Ba 0.86644195874802 0.29496396009415 0.84715284172613 137.327 > 20 *73 Ba 0.37035370878122 0.39632906862661 0.42487800544987 137.327 > 21 74 Ba 0.87035370878122 0.39632906862661 0.42487800544987 137.327 > 21 75 Ba 0.12964629121878 0.39632906862661 0.07512199455013 137.327 > 22 76 Ba 0.62964629121878 0.39632906862661 0.07512199455013 137.327 > 22 77 Ba 0.37964629121878 0.10367093137339 0.57512199455013 137.327 > 23 78 Ba 0.87964629121878 0.10367093137339 0.57512199455013 137.327 > 23 79 Ba 0.12035370878122 0.10367093137339 0.92487800544987 137.327 > 24 80 Ba 0.62035370878122 0.10367093137339 0.92487800544987 137.327 > 24 81 Ba 0.38355804125198 0.79496396009415 0.65284715827387 137.327 > 17 82 Ba 0.88355804125198 0.79496396009415 0.65284715827387 137.327 > 17 83 Ba 0.13355804125198 0.70503603990585 0.15284715827387 137.327 > 18 84 Ba 0.63355804125198 0.70503603990585 0.15284715827387 137.327 > 18 85 Ba 0.36644195874802 0.70503603990585 0.34715284172613 137.327 > 19 86 Ba 0.86644195874802 0.70503603990585 0.34715284172613 137.327 > 19 87 Ba 0.11644195874802 0.79496396009415 0.84715284172613 137.327 > 20 88 Ba 0.61644195874802 0.79496396009415 0.84715284172613 137.327 > 20 89 Ba 0.12035370878122 0.89632906862661 0.42487800544987 137.327 > 21 90 Ba 0.62035370878122 0.89632906862661 0.42487800544987 137.327 > 21 91 Ba 0.37964629121878 0.89632906862661 0.07512199455013 137.327 > 22 92 Ba 0.87964629121878 0.89632906862661 0.07512199455013 137.327 > 22 93 Ba 0.12964629121878 0.60367093137339 0.57512199455013 137.327 > 23 94 Ba 0.62964629121878 0.60367093137339 0.57512199455013 137.327 > 23 95 Ba 0.37035370878122 0.60367093137339 0.92487800544987 137.327 > 24 96 Ba 0.87035370878122 0.60367093137339 0.92487800544987 137.327 > 24 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.3392804 0.0000000 0.0041430 0.0000000 4.5355700 0.0000000 0.0041423 0.0000000 4.5102390 -------------------------- Born effective charges -------------------------- 1 O -2.0710301 0.0141409 -0.0268759 0.0310493 -2.5896266 0.0426624 0.0223350 0.0552782 -2.7365412 2 O -2.0710301 -0.0141409 -0.0268759 -0.0310493 -2.5896266 -0.0426624 0.0223350 -0.0552782 -2.7365412 3 O -2.0710301 0.0141409 -0.0268759 0.0310493 -2.5896266 0.0426624 0.0223350 0.0552782 -2.7365412 4 O -2.0710301 -0.0141409 -0.0268759 -0.0310493 -2.5896266 -0.0426624 0.0223350 -0.0552782 -2.7365412 5 O -2.6443802 0.0000000 0.3185043 0.0000000 -1.9734224 0.0000000 0.1768548 0.0000000 -2.4269359 6 O -2.6443802 0.0000000 0.3185043 0.0000000 -1.9734224 0.0000000 0.1768548 0.0000000 -2.4269359 7 O -2.3800017 0.0000000 -0.2550952 0.0000000 -2.1894746 0.0000000 -0.2168406 0.0000000 -2.4647694 8 O -2.2931302 -0.1805359 0.0241142 -0.1089477 -2.6207120 0.0523008 -0.0035958 0.1236451 -2.4017465 9 O -2.2931302 0.1805359 0.0241142 0.1089477 -2.6207120 -0.0523008 -0.0035958 -0.1236451 -2.4017465 10 O -2.2931302 -0.1805359 0.0241142 -0.1089477 -2.6207120 0.0523008 -0.0035958 0.1236451 -2.4017465 11 O -2.2931302 0.1805359 0.0241142 0.1089477 -2.6207120 -0.0523008 -0.0035958 -0.1236451 -2.4017465 12 O -2.3800017 0.0000000 -0.2550952 0.0000000 -2.1894746 0.0000000 -0.2168406 0.0000000 -2.4647694 13 Zn 1.7653561 -0.1472853 -0.0605136 -0.0747754 1.9047075 0.0504624 -0.0347135 -0.0329934 1.8458716 14 Zn 1.7653561 -0.1472853 -0.0605136 -0.0747754 1.9047075 0.0504624 -0.0347135 -0.0329934 1.8458716 15 Zn 1.7653561 0.1472853 -0.0605136 0.0747754 1.9047075 -0.0504624 -0.0347135 0.0329934 1.8458716 16 Zn 1.7653561 0.1472853 -0.0605136 0.0747754 1.9047075 -0.0504624 -0.0347135 0.0329934 1.8458716 17 Ba 2.5748207 -0.0491925 0.1097730 -0.0839700 2.7117803 0.0742147 0.1087519 0.0816811 2.8587995 18 Ba 2.5748207 0.0491925 0.1097730 0.0839700 2.7117803 -0.0742147 0.1087519 -0.0816811 2.8587995 19 Ba 2.5748207 -0.0491925 0.1097730 -0.0839700 2.7117803 0.0742147 0.1087519 0.0816811 2.8587995 20 Ba 2.5748207 0.0491925 0.1097730 0.0839700 2.7117803 -0.0742147 0.1087519 -0.0816811 2.8587995 21 Ba 2.5361745 -0.0775475 -0.0782022 -0.0446064 2.6752993 0.1289101 -0.0727847 0.1596239 2.8794692 22 Ba 2.5361745 0.0775475 -0.0782022 0.0446064 2.6752993 -0.1289101 -0.0727847 -0.1596239 2.8794692 23 Ba 2.5361745 -0.0775475 -0.0782022 -0.0446064 2.6752993 0.1289101 -0.0727847 0.1596239 2.8794692 24 Ba 2.5361745 0.0775475 -0.0782022 0.0446064 2.6752993 -0.1289101 -0.0727847 -0.1596239 2.8794692 ---------------------------------------------------------------------------- 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: 288/288 Permutation basis: 12456/12456 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2704 Number of blocks in projector: 2704 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 584 Use submatrix version of eigh solver. (1) Block: 584 / 584 (2) Block: 250 / 584 (2) 237 eigenvectors found. (2) Block: 500 / 584 (2) 241 eigenvectors found. (2) Block: 584 / 584 (2) 76 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 571 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 240 eigenvectors found. (2) Block: 568 / 568 (2) 62 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 240 eigenvectors found. (2) Block: 568 / 568 (2) 62 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 328 Use standard eigh solver. Tree of FC basis block matrices: - (2704, 2650), data: False |-- (328, 321), data: True |-- (328, 321), data: True |-- (328, 321), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 16), data: (568, 26) @ (26, 16) |-- (68, 62), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 16), data: (568, 26) @ (26, 16) |-- (68, 62), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (584, 571), data: False |-- (584, 571), data: False |-- (584, 17), data: (584, 30) @ (30, 17) |-- (84, 76), data: True |-- (250, 241), data: True |-- (250, 237), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 720 - Time: 0.535 Solver_block: 200 / 720 - Time: 0.467 Solver_block: 300 / 720 - Time: 0.461 Solver_block: 400 / 720 - Time: 0.461 Solver_block: 500 / 720 - Time: 0.466 Solver_block: 600 / 720 - Time: 0.465 Solver_block: 700 / 720 - Time: 0.463 Solver_block: 720 / 720 - Time: 0.151 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 3.576 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xz) -0.00000000 (xz) Permutation basis: 288/288 Permutation basis: 12456/12456 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2704 Number of blocks in projector: 2704 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 584 Use submatrix version of eigh solver. (1) Block: 584 / 584 (2) Block: 250 / 584 (2) 237 eigenvectors found. (2) Block: 500 / 584 (2) 241 eigenvectors found. (2) Block: 584 / 584 (2) 76 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 571 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 240 eigenvectors found. (2) Block: 568 / 568 (2) 62 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 240 eigenvectors found. (2) Block: 568 / 568 (2) 62 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 328 Use standard eigh solver. Tree of FC basis block matrices: - (2704, 2650), data: False |-- (328, 321), data: True |-- (328, 321), data: True |-- (328, 321), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 16), data: (568, 26) @ (26, 16) |-- (68, 62), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 16), data: (568, 26) @ (26, 16) |-- (68, 62), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (584, 571), data: False |-- (584, 571), data: False |-- (584, 17), data: (584, 30) @ (30, 17) |-- (84, 76), data: True |-- (250, 241), data: True |-- (250, 237), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xz) -0.00000000 (xz) 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 03:55:44]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 03:55:44]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.913362765021721 -5.690078850000000 0.000000000000000 b 2.913362765021721 5.690078850000000 0.000000000000000 c -0.751174079085919 0.000000000000000 12.536761850764986 Atomic positions (fractional): 1 O 0.87047674935993 0.67316315164412 0.46527275189289 15.999 2 O 0.32683684835588 0.12952325064007 0.03472724810711 15.999 3 O 0.12952325064007 0.32683684835588 0.53472724810711 15.999 4 O 0.67316315164412 0.87047674935993 0.96527275189289 15.999 5 O 0.99493705728439 0.00506294271561 0.25000000000000 15.999 6 O 0.00506294271561 0.99493705728439 0.75000000000000 15.999 7 O 0.59542862149955 0.40457137850045 0.25000000000000 15.999 8 O 0.85350822667875 0.51132054915573 0.86706917351242 15.999 9 O 0.51132054915573 0.85350822667875 0.36706917351242 15.999 10 O 0.14649177332125 0.48867945084427 0.13293082648758 15.999 11 O 0.48867945084427 0.14649177332125 0.63293082648758 15.999 12 O 0.40457137850045 0.59542862149955 0.75000000000000 15.999 13 Zn 0.26964967628696 0.27376671462927 0.16349716316231 65.380 14 Zn 0.73035032371304 0.72623328537072 0.83650283683769 65.380 15 Zn 0.72623328537073 0.73035032371304 0.33650283683769 65.380 16 Zn 0.27376671462927 0.26964967628696 0.66349716316231 65.380 17 Ba 0.97215212240980 0.56208004259811 0.65284715827387 137.327 18 Ba 0.56208004259811 0.97215212240980 0.15284715827387 137.327 19 Ba 0.02784787759020 0.43791995740189 0.34715284172613 137.327 20 Ba 0.43791995740189 0.02784787759020 0.84715284172613 137.327 21 Ba 0.34437834893584 0.13703648618906 0.42487800544987 137.327 22 Ba 0.86296351381094 0.65562165106416 0.07512199455013 137.327 23 Ba 0.65562165106416 0.86296351381094 0.57512199455013 137.327 24 Ba 0.13703648618906 0.34437834893584 0.92487800544987 137.327 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.653451060086885 0.000000000000000 0.000000000000000 b 0.000000000000000 11.380157700000000 0.000000000000000 c -0.751174079085919 0.000000000000000 12.536761850764986 Atomic positions (fractional): 1 O 0.13590997525101 0.40134320114210 0.46527275189289 15.999 > 1 2 O 0.63590997525101 0.40134320114210 0.46527275189289 15.999 > 1 3 O 0.36409002474899 0.40134320114210 0.03472724810711 15.999 > 3 4 O 0.86409002474899 0.40134320114210 0.03472724810711 15.999 > 3 5 O 0.11409002474899 0.09865679885790 0.53472724810711 15.999 > 5 6 O 0.61409002474899 0.09865679885790 0.53472724810711 15.999 > 5 7 O 0.38590997525101 0.09865679885790 0.96527275189289 15.999 > 7 8 O 0.88590997525101 0.09865679885790 0.96527275189289 15.999 > 7 9 O 0.00000000000000 0.00506294271561 0.25000000000000 15.999 > 9 10 O 0.50000000000000 0.00506294271561 0.25000000000000 15.999 > 9 11 O 0.25000000000000 0.49493705728439 0.75000000000000 15.999 > 11 12 O 0.75000000000000 0.49493705728439 0.75000000000000 15.999 > 11 13 O 0.00000000000000 0.40457137850045 0.25000000000000 15.999 > 13 14 O 0.50000000000000 0.40457137850045 0.25000000000000 15.999 > 13 15 O 0.09120719395862 0.32890616123849 0.86706917351242 15.999 > 15 16 O 0.59120719395862 0.32890616123849 0.86706917351242 15.999 > 15 17 O 0.34120719395862 0.17109383876151 0.36706917351242 15.999 > 17 18 O 0.84120719395862 0.17109383876151 0.36706917351242 15.999 > 17 19 O 0.15879280604138 0.17109383876151 0.13293082648758 15.999 > 19 20 O 0.65879280604138 0.17109383876151 0.13293082648758 15.999 > 19 21 O 0.40879280604138 0.32890616123849 0.63293082648758 15.999 > 21 22 O 0.90879280604138 0.32890616123849 0.63293082648758 15.999 > 21 23 O 0.25000000000000 0.09542862149955 0.75000000000000 15.999 > 23 24 O 0.75000000000000 0.09542862149955 0.75000000000000 15.999 > 23 25 O 0.38590997525101 0.90134320114210 0.46527275189289 15.999 > 1 26 O 0.88590997525101 0.90134320114210 0.46527275189289 15.999 > 1 27 O 0.11409002474899 0.90134320114210 0.03472724810711 15.999 > 3 28 O 0.61409002474899 0.90134320114210 0.03472724810711 15.999 > 3 29 O 0.36409002474899 0.59865679885790 0.53472724810711 15.999 > 5 30 O 0.86409002474899 0.59865679885790 0.53472724810711 15.999 > 5 31 O 0.13590997525101 0.59865679885790 0.96527275189289 15.999 > 7 32 O 0.63590997525101 0.59865679885790 0.96527275189289 15.999 > 7 33 O 0.25000000000000 0.50506294271561 0.25000000000000 15.999 > 9 34 O 0.75000000000000 0.50506294271561 0.25000000000000 15.999 > 9 35 O 0.00000000000000 0.99493705728439 0.75000000000000 15.999 > 11 36 O 0.50000000000000 0.99493705728439 0.75000000000000 15.999 > 11 37 O 0.25000000000000 0.90457137850045 0.25000000000000 15.999 > 13 38 O 0.75000000000000 0.90457137850045 0.25000000000000 15.999 > 13 39 O 0.34120719395862 0.82890616123849 0.86706917351242 15.999 > 15 40 O 0.84120719395862 0.82890616123849 0.86706917351242 15.999 > 15 41 O 0.09120719395862 0.67109383876151 0.36706917351242 15.999 > 17 42 O 0.59120719395862 0.67109383876151 0.36706917351242 15.999 > 17 43 O 0.40879280604138 0.67109383876151 0.13293082648758 15.999 > 19 44 O 0.90879280604138 0.67109383876151 0.13293082648758 15.999 > 19 45 O 0.15879280604138 0.82890616123849 0.63293082648758 15.999 > 21 46 O 0.65879280604138 0.82890616123849 0.63293082648758 15.999 > 21 47 O 0.00000000000000 0.59542862149955 0.75000000000000 15.999 > 23 48 O 0.50000000000000 0.59542862149955 0.75000000000000 15.999 > 23 49 Zn 0.13585409772906 0.00205851917116 0.16349716316231 65.380 > 49 50 Zn 0.63585409772906 0.00205851917116 0.16349716316231 65.380 > 49 51 Zn 0.11414590227094 0.49794148082884 0.83650283683769 65.380 > 51 52 Zn 0.61414590227094 0.49794148082884 0.83650283683769 65.380 > 51 53 Zn 0.36414590227094 0.00205851917116 0.33650283683769 65.380 > 53 54 Zn 0.86414590227094 0.00205851917116 0.33650283683769 65.380 > 53 55 Zn 0.38585409772906 0.49794148082884 0.66349716316231 65.380 > 55 56 Zn 0.88585409772906 0.49794148082884 0.66349716316231 65.380 > 55 57 Zn 0.38585409772906 0.50205851917116 0.16349716316231 65.380 > 49 58 Zn 0.88585409772906 0.50205851917116 0.16349716316231 65.380 > 49 59 Zn 0.36414590227094 0.99794148082884 0.83650283683769 65.380 > 51 60 Zn 0.86414590227094 0.99794148082884 0.83650283683769 65.380 > 51 61 Zn 0.11414590227094 0.50205851917116 0.33650283683769 65.380 > 53 62 Zn 0.61414590227094 0.50205851917116 0.33650283683769 65.380 > 53 63 Zn 0.13585409772906 0.99794148082884 0.66349716316231 65.380 > 55 64 Zn 0.63585409772906 0.99794148082884 0.66349716316231 65.380 > 55 65 Ba 0.13355804125198 0.29496396009415 0.65284715827387 137.327 > 65 66 Ba 0.63355804125198 0.29496396009415 0.65284715827387 137.327 > 65 67 Ba 0.38355804125198 0.20503603990585 0.15284715827387 137.327 > 67 68 Ba 0.88355804125198 0.20503603990585 0.15284715827387 137.327 > 67 69 Ba 0.11644195874802 0.20503603990585 0.34715284172613 137.327 > 69 70 Ba 0.61644195874802 0.20503603990585 0.34715284172613 137.327 > 69 71 Ba 0.36644195874802 0.29496396009415 0.84715284172613 137.327 > 71 72 Ba 0.86644195874802 0.29496396009415 0.84715284172613 137.327 > 71 73 Ba 0.37035370878122 0.39632906862661 0.42487800544987 137.327 > 73 74 Ba 0.87035370878122 0.39632906862661 0.42487800544987 137.327 > 73 75 Ba 0.12964629121878 0.39632906862661 0.07512199455013 137.327 > 75 76 Ba 0.62964629121878 0.39632906862661 0.07512199455013 137.327 > 75 77 Ba 0.37964629121878 0.10367093137339 0.57512199455013 137.327 > 77 78 Ba 0.87964629121878 0.10367093137339 0.57512199455013 137.327 > 77 79 Ba 0.12035370878122 0.10367093137339 0.92487800544987 137.327 > 79 80 Ba 0.62035370878122 0.10367093137339 0.92487800544987 137.327 > 79 81 Ba 0.38355804125198 0.79496396009415 0.65284715827387 137.327 > 65 82 Ba 0.88355804125198 0.79496396009415 0.65284715827387 137.327 > 65 83 Ba 0.13355804125198 0.70503603990585 0.15284715827387 137.327 > 67 84 Ba 0.63355804125198 0.70503603990585 0.15284715827387 137.327 > 67 85 Ba 0.36644195874802 0.70503603990585 0.34715284172613 137.327 > 69 86 Ba 0.86644195874802 0.70503603990585 0.34715284172613 137.327 > 69 87 Ba 0.11644195874802 0.79496396009415 0.84715284172613 137.327 > 71 88 Ba 0.61644195874802 0.79496396009415 0.84715284172613 137.327 > 71 89 Ba 0.12035370878122 0.89632906862661 0.42487800544987 137.327 > 73 90 Ba 0.62035370878122 0.89632906862661 0.42487800544987 137.327 > 73 91 Ba 0.37964629121878 0.89632906862661 0.07512199455013 137.327 > 75 92 Ba 0.87964629121878 0.89632906862661 0.07512199455013 137.327 > 75 93 Ba 0.12964629121878 0.60367093137339 0.57512199455013 137.327 > 77 94 Ba 0.62964629121878 0.60367093137339 0.57512199455013 137.327 > 77 95 Ba 0.37035370878122 0.60367093137339 0.92487800544987 137.327 > 79 96 Ba 0.87035370878122 0.60367093137339 0.92487800544987 137.327 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.3392804 0.0000000 0.0041430 0.0000000 4.5355700 0.0000000 0.0041423 0.0000000 4.5102390 -------------------------- Born effective charges -------------------------- 1 O -2.0710301 0.0141409 -0.0268759 0.0310493 -2.5896266 0.0426624 0.0223350 0.0552782 -2.7365412 2 O -2.0710301 -0.0141409 -0.0268759 -0.0310493 -2.5896266 -0.0426624 0.0223350 -0.0552782 -2.7365412 3 O -2.0710301 0.0141409 -0.0268759 0.0310493 -2.5896266 0.0426624 0.0223350 0.0552782 -2.7365412 4 O -2.0710301 -0.0141409 -0.0268759 -0.0310493 -2.5896266 -0.0426624 0.0223350 -0.0552782 -2.7365412 5 O -2.6443802 0.0000000 0.3185043 0.0000000 -1.9734224 0.0000000 0.1768548 0.0000000 -2.4269359 6 O -2.6443802 0.0000000 0.3185043 0.0000000 -1.9734224 0.0000000 0.1768548 0.0000000 -2.4269359 7 O -2.3800017 0.0000000 -0.2550952 0.0000000 -2.1894746 0.0000000 -0.2168406 0.0000000 -2.4647694 8 O -2.2931302 -0.1805359 0.0241142 -0.1089477 -2.6207120 0.0523008 -0.0035958 0.1236451 -2.4017465 9 O -2.2931302 0.1805359 0.0241142 0.1089477 -2.6207120 -0.0523008 -0.0035958 -0.1236451 -2.4017465 10 O -2.2931302 -0.1805359 0.0241142 -0.1089477 -2.6207120 0.0523008 -0.0035958 0.1236451 -2.4017465 11 O -2.2931302 0.1805359 0.0241142 0.1089477 -2.6207120 -0.0523008 -0.0035958 -0.1236451 -2.4017465 12 O -2.3800017 0.0000000 -0.2550952 0.0000000 -2.1894746 0.0000000 -0.2168406 0.0000000 -2.4647694 13 Zn 1.7653561 -0.1472853 -0.0605136 -0.0747754 1.9047075 0.0504624 -0.0347135 -0.0329934 1.8458716 14 Zn 1.7653561 -0.1472853 -0.0605136 -0.0747754 1.9047075 0.0504624 -0.0347135 -0.0329934 1.8458716 15 Zn 1.7653561 0.1472853 -0.0605136 0.0747754 1.9047075 -0.0504624 -0.0347135 0.0329934 1.8458716 16 Zn 1.7653561 0.1472853 -0.0605136 0.0747754 1.9047075 -0.0504624 -0.0347135 0.0329934 1.8458716 17 Ba 2.5748207 -0.0491925 0.1097730 -0.0839700 2.7117803 0.0742147 0.1087519 0.0816811 2.8587995 18 Ba 2.5748207 0.0491925 0.1097730 0.0839700 2.7117803 -0.0742147 0.1087519 -0.0816811 2.8587995 19 Ba 2.5748207 -0.0491925 0.1097730 -0.0839700 2.7117803 0.0742147 0.1087519 0.0816811 2.8587995 20 Ba 2.5748207 0.0491925 0.1097730 0.0839700 2.7117803 -0.0742147 0.1087519 -0.0816811 2.8587995 21 Ba 2.5361745 -0.0775475 -0.0782022 -0.0446064 2.6752993 0.1289101 -0.0727847 0.1596239 2.8794692 22 Ba 2.5361745 0.0775475 -0.0782022 0.0446064 2.6752993 -0.1289101 -0.0727847 -0.1596239 2.8794692 23 Ba 2.5361745 -0.0775475 -0.0782022 -0.0446064 2.6752993 0.1289101 -0.0727847 0.1596239 2.8794692 24 Ba 2.5361745 0.0775475 -0.0782022 0.0446064 2.6752993 -0.1289101 -0.0727847 -0.1596239 2.8794692 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Computing fc3[ 13, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Computing fc3[ 15, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Computing fc3[ 65, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0006 0.0000 0.0100] [ 0.0006 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 (zx) -0.00000000 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 03:56:03]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 03:56:03]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.913362765021721 -5.690078850000000 0.000000000000000 b 2.913362765021721 5.690078850000000 0.000000000000000 c -0.751174079085919 0.000000000000000 12.536761850764986 Atomic positions (fractional): 1 O 0.87047674935993 0.67316315164412 0.46527275189289 15.999 2 O 0.32683684835588 0.12952325064007 0.03472724810711 15.999 3 O 0.12952325064007 0.32683684835588 0.53472724810711 15.999 4 O 0.67316315164412 0.87047674935993 0.96527275189289 15.999 5 O 0.99493705728439 0.00506294271561 0.25000000000000 15.999 6 O 0.00506294271561 0.99493705728439 0.75000000000000 15.999 7 O 0.59542862149955 0.40457137850045 0.25000000000000 15.999 8 O 0.85350822667875 0.51132054915573 0.86706917351242 15.999 9 O 0.51132054915573 0.85350822667875 0.36706917351242 15.999 10 O 0.14649177332125 0.48867945084427 0.13293082648758 15.999 11 O 0.48867945084427 0.14649177332125 0.63293082648758 15.999 12 O 0.40457137850045 0.59542862149955 0.75000000000000 15.999 13 Zn 0.26964967628696 0.27376671462927 0.16349716316231 65.380 14 Zn 0.73035032371304 0.72623328537072 0.83650283683769 65.380 15 Zn 0.72623328537073 0.73035032371304 0.33650283683769 65.380 16 Zn 0.27376671462927 0.26964967628696 0.66349716316231 65.380 17 Ba 0.97215212240980 0.56208004259811 0.65284715827387 137.327 18 Ba 0.56208004259811 0.97215212240980 0.15284715827387 137.327 19 Ba 0.02784787759020 0.43791995740189 0.34715284172613 137.327 20 Ba 0.43791995740189 0.02784787759020 0.84715284172613 137.327 21 Ba 0.34437834893584 0.13703648618906 0.42487800544987 137.327 22 Ba 0.86296351381094 0.65562165106416 0.07512199455013 137.327 23 Ba 0.65562165106416 0.86296351381094 0.57512199455013 137.327 24 Ba 0.13703648618906 0.34437834893584 0.92487800544987 137.327 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.653451060086885 0.000000000000000 0.000000000000000 b 0.000000000000000 11.380157700000000 0.000000000000000 c -0.751174079085919 0.000000000000000 12.536761850764986 Atomic positions (fractional): 1 O 0.13590997525101 0.40134320114210 0.46527275189289 15.999 > 1 2 O 0.63590997525101 0.40134320114210 0.46527275189289 15.999 > 1 3 O 0.36409002474899 0.40134320114210 0.03472724810711 15.999 > 3 4 O 0.86409002474899 0.40134320114210 0.03472724810711 15.999 > 3 5 O 0.11409002474899 0.09865679885790 0.53472724810711 15.999 > 5 6 O 0.61409002474899 0.09865679885790 0.53472724810711 15.999 > 5 7 O 0.38590997525101 0.09865679885790 0.96527275189289 15.999 > 7 8 O 0.88590997525101 0.09865679885790 0.96527275189289 15.999 > 7 9 O 0.00000000000000 0.00506294271561 0.25000000000000 15.999 > 9 10 O 0.50000000000000 0.00506294271561 0.25000000000000 15.999 > 9 11 O 0.25000000000000 0.49493705728439 0.75000000000000 15.999 > 11 12 O 0.75000000000000 0.49493705728439 0.75000000000000 15.999 > 11 13 O 0.00000000000000 0.40457137850045 0.25000000000000 15.999 > 13 14 O 0.50000000000000 0.40457137850045 0.25000000000000 15.999 > 13 15 O 0.09120719395862 0.32890616123849 0.86706917351242 15.999 > 15 16 O 0.59120719395862 0.32890616123849 0.86706917351242 15.999 > 15 17 O 0.34120719395862 0.17109383876151 0.36706917351242 15.999 > 17 18 O 0.84120719395862 0.17109383876151 0.36706917351242 15.999 > 17 19 O 0.15879280604138 0.17109383876151 0.13293082648758 15.999 > 19 20 O 0.65879280604138 0.17109383876151 0.13293082648758 15.999 > 19 21 O 0.40879280604138 0.32890616123849 0.63293082648758 15.999 > 21 22 O 0.90879280604138 0.32890616123849 0.63293082648758 15.999 > 21 23 O 0.25000000000000 0.09542862149955 0.75000000000000 15.999 > 23 24 O 0.75000000000000 0.09542862149955 0.75000000000000 15.999 > 23 25 O 0.38590997525101 0.90134320114210 0.46527275189289 15.999 > 1 26 O 0.88590997525101 0.90134320114210 0.46527275189289 15.999 > 1 27 O 0.11409002474899 0.90134320114210 0.03472724810711 15.999 > 3 28 O 0.61409002474899 0.90134320114210 0.03472724810711 15.999 > 3 29 O 0.36409002474899 0.59865679885790 0.53472724810711 15.999 > 5 30 O 0.86409002474899 0.59865679885790 0.53472724810711 15.999 > 5 31 O 0.13590997525101 0.59865679885790 0.96527275189289 15.999 > 7 32 O 0.63590997525101 0.59865679885790 0.96527275189289 15.999 > 7 33 O 0.25000000000000 0.50506294271561 0.25000000000000 15.999 > 9 34 O 0.75000000000000 0.50506294271561 0.25000000000000 15.999 > 9 35 O 0.00000000000000 0.99493705728439 0.75000000000000 15.999 > 11 36 O 0.50000000000000 0.99493705728439 0.75000000000000 15.999 > 11 37 O 0.25000000000000 0.90457137850045 0.25000000000000 15.999 > 13 38 O 0.75000000000000 0.90457137850045 0.25000000000000 15.999 > 13 39 O 0.34120719395862 0.82890616123849 0.86706917351242 15.999 > 15 40 O 0.84120719395862 0.82890616123849 0.86706917351242 15.999 > 15 41 O 0.09120719395862 0.67109383876151 0.36706917351242 15.999 > 17 42 O 0.59120719395862 0.67109383876151 0.36706917351242 15.999 > 17 43 O 0.40879280604138 0.67109383876151 0.13293082648758 15.999 > 19 44 O 0.90879280604138 0.67109383876151 0.13293082648758 15.999 > 19 45 O 0.15879280604138 0.82890616123849 0.63293082648758 15.999 > 21 46 O 0.65879280604138 0.82890616123849 0.63293082648758 15.999 > 21 47 O 0.00000000000000 0.59542862149955 0.75000000000000 15.999 > 23 48 O 0.50000000000000 0.59542862149955 0.75000000000000 15.999 > 23 49 Zn 0.13585409772906 0.00205851917116 0.16349716316231 65.380 > 49 50 Zn 0.63585409772906 0.00205851917116 0.16349716316231 65.380 > 49 51 Zn 0.11414590227094 0.49794148082884 0.83650283683769 65.380 > 51 52 Zn 0.61414590227094 0.49794148082884 0.83650283683769 65.380 > 51 53 Zn 0.36414590227094 0.00205851917116 0.33650283683769 65.380 > 53 54 Zn 0.86414590227094 0.00205851917116 0.33650283683769 65.380 > 53 55 Zn 0.38585409772906 0.49794148082884 0.66349716316231 65.380 > 55 56 Zn 0.88585409772906 0.49794148082884 0.66349716316231 65.380 > 55 57 Zn 0.38585409772906 0.50205851917116 0.16349716316231 65.380 > 49 58 Zn 0.88585409772906 0.50205851917116 0.16349716316231 65.380 > 49 59 Zn 0.36414590227094 0.99794148082884 0.83650283683769 65.380 > 51 60 Zn 0.86414590227094 0.99794148082884 0.83650283683769 65.380 > 51 61 Zn 0.11414590227094 0.50205851917116 0.33650283683769 65.380 > 53 62 Zn 0.61414590227094 0.50205851917116 0.33650283683769 65.380 > 53 63 Zn 0.13585409772906 0.99794148082884 0.66349716316231 65.380 > 55 64 Zn 0.63585409772906 0.99794148082884 0.66349716316231 65.380 > 55 65 Ba 0.13355804125198 0.29496396009415 0.65284715827387 137.327 > 65 66 Ba 0.63355804125198 0.29496396009415 0.65284715827387 137.327 > 65 67 Ba 0.38355804125198 0.20503603990585 0.15284715827387 137.327 > 67 68 Ba 0.88355804125198 0.20503603990585 0.15284715827387 137.327 > 67 69 Ba 0.11644195874802 0.20503603990585 0.34715284172613 137.327 > 69 70 Ba 0.61644195874802 0.20503603990585 0.34715284172613 137.327 > 69 71 Ba 0.36644195874802 0.29496396009415 0.84715284172613 137.327 > 71 72 Ba 0.86644195874802 0.29496396009415 0.84715284172613 137.327 > 71 73 Ba 0.37035370878122 0.39632906862661 0.42487800544987 137.327 > 73 74 Ba 0.87035370878122 0.39632906862661 0.42487800544987 137.327 > 73 75 Ba 0.12964629121878 0.39632906862661 0.07512199455013 137.327 > 75 76 Ba 0.62964629121878 0.39632906862661 0.07512199455013 137.327 > 75 77 Ba 0.37964629121878 0.10367093137339 0.57512199455013 137.327 > 77 78 Ba 0.87964629121878 0.10367093137339 0.57512199455013 137.327 > 77 79 Ba 0.12035370878122 0.10367093137339 0.92487800544987 137.327 > 79 80 Ba 0.62035370878122 0.10367093137339 0.92487800544987 137.327 > 79 81 Ba 0.38355804125198 0.79496396009415 0.65284715827387 137.327 > 65 82 Ba 0.88355804125198 0.79496396009415 0.65284715827387 137.327 > 65 83 Ba 0.13355804125198 0.70503603990585 0.15284715827387 137.327 > 67 84 Ba 0.63355804125198 0.70503603990585 0.15284715827387 137.327 > 67 85 Ba 0.36644195874802 0.70503603990585 0.34715284172613 137.327 > 69 86 Ba 0.86644195874802 0.70503603990585 0.34715284172613 137.327 > 69 87 Ba 0.11644195874802 0.79496396009415 0.84715284172613 137.327 > 71 88 Ba 0.61644195874802 0.79496396009415 0.84715284172613 137.327 > 71 89 Ba 0.12035370878122 0.89632906862661 0.42487800544987 137.327 > 73 90 Ba 0.62035370878122 0.89632906862661 0.42487800544987 137.327 > 73 91 Ba 0.37964629121878 0.89632906862661 0.07512199455013 137.327 > 75 92 Ba 0.87964629121878 0.89632906862661 0.07512199455013 137.327 > 75 93 Ba 0.12964629121878 0.60367093137339 0.57512199455013 137.327 > 77 94 Ba 0.62964629121878 0.60367093137339 0.57512199455013 137.327 > 77 95 Ba 0.37035370878122 0.60367093137339 0.92487800544987 137.327 > 79 96 Ba 0.87035370878122 0.60367093137339 0.92487800544987 137.327 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.3392804 0.0000000 0.0041430 0.0000000 4.5355700 0.0000000 0.0041423 0.0000000 4.5102390 -------------------------- Born effective charges -------------------------- 1 O -2.0710301 0.0141409 -0.0268759 0.0310493 -2.5896266 0.0426624 0.0223350 0.0552782 -2.7365412 2 O -2.0710301 -0.0141409 -0.0268759 -0.0310493 -2.5896266 -0.0426624 0.0223350 -0.0552782 -2.7365412 3 O -2.0710301 0.0141409 -0.0268759 0.0310493 -2.5896266 0.0426624 0.0223350 0.0552782 -2.7365412 4 O -2.0710301 -0.0141409 -0.0268759 -0.0310493 -2.5896266 -0.0426624 0.0223350 -0.0552782 -2.7365412 5 O -2.6443802 0.0000000 0.3185043 0.0000000 -1.9734224 0.0000000 0.1768548 0.0000000 -2.4269359 6 O -2.6443802 0.0000000 0.3185043 0.0000000 -1.9734224 0.0000000 0.1768548 0.0000000 -2.4269359 7 O -2.3800017 0.0000000 -0.2550952 0.0000000 -2.1894746 0.0000000 -0.2168406 0.0000000 -2.4647694 8 O -2.2931302 -0.1805359 0.0241142 -0.1089477 -2.6207120 0.0523008 -0.0035958 0.1236451 -2.4017465 9 O -2.2931302 0.1805359 0.0241142 0.1089477 -2.6207120 -0.0523008 -0.0035958 -0.1236451 -2.4017465 10 O -2.2931302 -0.1805359 0.0241142 -0.1089477 -2.6207120 0.0523008 -0.0035958 0.1236451 -2.4017465 11 O -2.2931302 0.1805359 0.0241142 0.1089477 -2.6207120 -0.0523008 -0.0035958 -0.1236451 -2.4017465 12 O -2.3800017 0.0000000 -0.2550952 0.0000000 -2.1894746 0.0000000 -0.2168406 0.0000000 -2.4647694 13 Zn 1.7653561 -0.1472853 -0.0605136 -0.0747754 1.9047075 0.0504624 -0.0347135 -0.0329934 1.8458716 14 Zn 1.7653561 -0.1472853 -0.0605136 -0.0747754 1.9047075 0.0504624 -0.0347135 -0.0329934 1.8458716 15 Zn 1.7653561 0.1472853 -0.0605136 0.0747754 1.9047075 -0.0504624 -0.0347135 0.0329934 1.8458716 16 Zn 1.7653561 0.1472853 -0.0605136 0.0747754 1.9047075 -0.0504624 -0.0347135 0.0329934 1.8458716 17 Ba 2.5748207 -0.0491925 0.1097730 -0.0839700 2.7117803 0.0742147 0.1087519 0.0816811 2.8587995 18 Ba 2.5748207 0.0491925 0.1097730 0.0839700 2.7117803 -0.0742147 0.1087519 -0.0816811 2.8587995 19 Ba 2.5748207 -0.0491925 0.1097730 -0.0839700 2.7117803 0.0742147 0.1087519 0.0816811 2.8587995 20 Ba 2.5748207 0.0491925 0.1097730 0.0839700 2.7117803 -0.0742147 0.1087519 -0.0816811 2.8587995 21 Ba 2.5361745 -0.0775475 -0.0782022 -0.0446064 2.6752993 0.1289101 -0.0727847 0.1596239 2.8794692 22 Ba 2.5361745 0.0775475 -0.0782022 0.0446064 2.6752993 -0.1289101 -0.0727847 -0.1596239 2.8794692 23 Ba 2.5361745 -0.0775475 -0.0782022 -0.0446064 2.6752993 0.1289101 -0.0727847 0.1596239 2.8794692 24 Ba 2.5361745 0.0775475 -0.0782022 0.0446064 2.6752993 -0.1289101 -0.0727847 -0.1596239 2.8794692 ---------------------------------------------------------------------------- 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 (xz) -0.00000000 (xz) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 10 4 ] 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: 0.56, Number of G-points: 305, Lambda: 0.12 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/117) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 1.598 ( 0.000 0.000 0.000) 0.000 1.745 ( 0.000 0.000 0.000) 0.000 1.990 ( 0.000 0.000 0.000) 0.000 2.212 ( 0.000 0.000 0.000) 0.000 2.467 ( 0.000 0.000 0.000) 0.000 2.571 ( 0.000 0.000 0.000) 0.000 2.647 ( 0.000 0.000 0.000) 0.000 2.695 ( 0.000 0.000 0.000) 0.000 2.759 ( 0.000 0.000 0.000) 0.000 2.855 ( 0.000 0.000 0.000) 0.000 2.956 ( 0.000 0.000 0.000) 0.000 3.051 ( 0.000 0.000 0.000) 0.000 3.256 ( 0.000 0.000 0.000) 0.000 3.278 ( 0.000 0.000 0.000) 0.000 3.303 ( 0.000 0.000 0.000) 0.000 3.369 ( 0.000 0.000 0.000) 0.000 3.540 ( 0.000 0.000 0.000) 0.000 3.593 ( 0.000 0.000 0.000) 0.000 3.650 ( 0.000 0.000 0.000) 0.000 3.666 ( 0.000 0.000 0.000) 0.000 3.706 ( 0.000 0.000 0.000) 0.000 3.798 ( 0.000 0.000 0.000) 0.000 3.969 ( 0.000 0.000 0.000) 0.000 4.192 ( 0.000 0.000 0.000) 0.000 4.331 ( 0.000 0.000 0.000) 0.000 4.412 ( 0.000 0.000 0.000) 0.000 4.551 ( 0.000 0.000 0.000) 0.000 4.774 ( 0.000 0.000 0.000) 0.000 4.848 ( 0.000 0.000 0.000) 0.000 4.932 ( 0.000 0.000 0.000) 0.000 4.978 ( 0.000 0.000 0.000) 0.000 5.085 ( 0.000 0.000 0.000) 0.000 5.188 ( 0.000 0.000 0.000) 0.000 5.251 ( 0.000 0.000 0.000) 0.000 5.496 ( 0.000 0.000 0.000) 0.000 5.935 ( 0.000 0.000 0.000) 0.000 5.944 ( 0.000 0.000 0.000) 0.000 6.066 ( 0.000 0.000 0.000) 0.000 6.068 ( 0.000 0.000 0.000) 0.000 6.483 ( 0.000 0.000 0.000) 0.000 6.489 ( 0.000 0.000 0.000) 0.000 6.616 ( 0.000 0.000 0.000) 0.000 7.061 ( 0.000 0.000 0.000) 0.000 7.535 ( 0.000 0.000 0.000) 0.000 7.584 ( 0.000 0.000 0.000) 0.000 7.771 ( 0.000 0.000 0.000) 0.000 7.778 ( 0.000 0.000 0.000) 0.000 7.867 ( 0.000 0.000 0.000) 0.000 8.126 ( 0.000 0.000 0.000) 0.000 8.233 ( 0.000 0.000 0.000) 0.000 9.045 ( 0.000 0.000 0.000) 0.000 9.773 ( 0.000 0.000 0.000) 0.000 9.824 ( 0.000 0.000 0.000) 0.000 9.933 ( 0.000 0.000 0.000) 0.000 10.153 ( 0.000 0.000 0.000) 0.000 10.325 ( 0.000 0.000 0.000) 0.000 10.976 ( 0.000 0.000 0.000) 0.000 11.929 ( 0.000 0.000 0.000) 0.000 12.189 ( 0.000 0.000 0.000) 0.000 12.539 ( 0.000 0.000 0.000) 0.000 12.907 ( 0.000 0.000 0.000) 0.000 13.333 ( 0.000 0.000 0.000) 0.000 13.569 ( 0.000 0.000 0.000) 0.000 14.077 ( 0.000 0.000 0.000) 0.000 14.146 ( 0.000 0.000 0.000) 0.000 14.348 ( 0.000 0.000 0.000) 0.000 14.939 ( 0.000 0.000 0.000) 0.000 17.692 ( 0.000 0.000 0.000) 0.000 17.833 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/117) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.441 ( 17.484 -15.543 0.869) 23.410 0.515 ( 23.144 -12.281 2.816) 26.351 0.789 ( 34.212 -20.581 -1.924) 39.972 1.644 ( 4.153 -0.784 3.581) 5.540 1.793 ( 3.033 -4.633 0.624) 5.572 1.926 ( -6.402 0.027 -1.900) 6.678 2.211 ( -0.047 0.732 -1.298) 1.491 2.414 ( -4.949 0.824 -0.052) 5.017 2.489 ( -7.947 1.027 1.370) 8.129 2.610 ( 0.326 6.758 0.627) 6.795 2.675 ( -2.685 -0.402 -0.163) 2.720 2.789 ( -0.875 -2.559 -2.500) 3.683 2.853 ( -1.066 0.114 -0.498) 1.182 2.915 ( -5.359 0.880 1.840) 5.734 3.064 ( 1.099 -0.058 0.758) 1.337 3.214 ( -2.319 4.648 -1.684) 5.460 3.245 ( -6.736 -2.168 5.917) 9.224 3.254 ( -2.082 -0.562 -2.731) 3.480 3.536 ( -1.615 1.303 -1.719) 2.695 3.614 ( 1.436 10.466 4.609) 11.526 3.641 ( 4.912 5.757 -2.234) 7.891 3.648 ( 2.727 2.186 -7.697) 8.453 3.735 ( 3.803 4.586 10.665) 12.216 3.774 ( 4.509 1.416 -8.361) 9.605 3.837 ( 1.075 5.070 4.022) 6.561 3.971 ( 2.152 4.232 -3.098) 5.669 4.325 ( -5.490 -6.691 1.345) 8.759 4.365 ( -1.323 -5.538 9.643) 11.199 4.437 ( -5.744 0.135 -5.226) 7.767 4.495 ( -6.844 -11.779 -20.116) 24.294 4.815 ( 0.288 1.888 0.239) 1.924 4.864 ( 2.935 -2.717 0.898) 4.099 4.988 ( 6.953 3.956 -2.676) 8.436 5.082 ( 4.470 -5.495 -2.097) 7.388 5.208 ( 1.215 1.828 3.536) 4.162 5.252 ( 5.302 -1.181 -1.890) 5.751 5.377 ( 8.142 1.164 -5.751) 10.036 5.459 ( -3.385 -0.092 3.853) 5.130 5.786 ( -4.077 1.162 -0.704) 4.297 6.080 ( 0.803 -1.497 2.474) 3.001 6.219 ( 17.944 1.835 0.268) 18.039 6.442 ( 7.533 5.110 0.942) 9.152 6.485 ( 1.412 0.280 1.546) 2.113 6.561 ( 4.848 -4.467 -5.211) 8.403 7.095 ( 4.108 0.787 -2.592) 4.921 7.221 ( 4.967 15.849 58.910) 61.207 7.509 ( -0.714 2.443 1.593) 3.003 7.693 ( 2.775 7.417 -5.618) 9.710 7.837 ( 4.062 -1.930 5.492) 7.099 7.958 ( 9.988 3.273 -1.790) 10.662 8.120 ( -1.328 -2.537 -3.179) 4.279 8.270 ( 4.904 0.878 6.287) 8.022 9.015 ( 0.182 6.020 -4.683) 7.629 9.272 ( 39.090 72.112 -24.213) 85.524 9.712 ( -4.143 2.770 14.126) 14.979 9.908 ( 0.687 7.411 -1.347) 7.563 9.933 ( 12.148 8.082 -11.460) 18.553 10.202 ( 1.642 -6.858 -3.393) 7.825 10.943 ( -3.594 -1.379 -0.305) 3.862 11.225 ( -27.071 -64.490 -32.498) 77.123 12.194 ( 2.781 4.567 4.500) 6.988 12.511 ( 0.927 2.679 66.470) 66.530 12.537 ( 0.725 1.409 0.171) 1.594 13.020 ( 8.017 8.073 -12.375) 16.811 13.512 ( -12.451 -12.679 11.675) 21.263 13.648 ( -14.397 -27.910 2.043) 31.471 13.923 ( -14.320 0.753 -7.517) 16.191 14.085 ( -6.704 -0.820 -2.416) 7.173 14.962 ( 10.762 2.887 -12.915) 17.058 15.099 ( 4.045 -7.736 -2.133) 8.987 17.817 ( -1.155 0.939 0.561) 1.591 17.841 ( 2.575 4.815 -12.308) 13.465 ======================= Grid point 2 (3/117) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.870 ( 16.809 -14.528 0.605) 22.225 1.007 ( 21.419 -11.499 2.757) 24.466 1.492 ( 25.542 -17.454 -1.730) 30.984 1.716 ( 0.899 -0.417 -3.003) 3.162 1.827 ( -2.470 -2.459 6.331) 7.227 1.925 ( 5.610 -8.071 0.554) 9.845 2.171 ( -5.048 -0.900 -4.198) 6.627 2.321 ( -4.415 1.925 0.558) 4.849 2.343 ( -5.244 2.111 2.231) 6.078 2.538 ( -4.330 4.987 -0.019) 6.605 2.580 ( -3.781 5.213 -1.043) 6.524 2.763 ( -1.956 -0.682 -0.429) 2.116 2.805 ( -4.023 0.284 -0.782) 4.108 2.840 ( -3.907 0.543 1.120) 4.101 3.047 ( -3.806 1.908 0.101) 4.259 3.130 ( -7.902 -0.683 -0.842) 7.976 3.157 ( 1.243 2.606 2.748) 3.986 3.223 ( -1.992 -0.606 -1.712) 2.696 3.457 ( -3.767 7.447 4.580) 9.519 3.527 ( -1.177 7.301 -0.219) 7.399 3.604 ( 1.871 9.001 -0.621) 9.214 3.658 ( 0.392 1.148 -1.939) 2.287 3.793 ( -3.374 -0.824 -0.240) 3.481 3.840 ( 5.093 -1.027 9.709) 11.012 3.892 ( 9.190 0.291 -9.661) 13.337 3.958 ( 1.398 3.937 -4.808) 6.370 4.281 ( -2.593 -2.108 0.597) 3.395 4.372 ( -1.202 -1.173 -2.529) 3.036 4.429 ( 2.649 -1.360 5.837) 6.553 4.470 ( -2.308 -5.336 -8.869) 10.605 4.789 ( -2.440 1.363 -0.548) 2.847 4.914 ( 0.080 -3.617 -0.330) 3.633 5.057 ( -0.593 1.337 -1.715) 2.254 5.112 ( 1.642 -0.700 1.829) 2.556 5.309 ( 6.914 0.159 -2.204) 7.259 5.371 ( 6.975 -0.023 1.052) 7.054 5.419 ( 3.569 2.359 3.119) 5.294 5.563 ( 11.006 -1.170 -3.375) 11.571 5.771 ( 3.860 0.463 -3.255) 5.070 6.122 ( 1.897 -2.055 3.017) 4.113 6.411 ( 3.854 2.182 1.012) 4.542 6.510 ( 1.734 -0.759 1.436) 2.376 6.584 ( 13.139 4.126 3.586) 14.231 6.729 ( 10.717 -2.082 -3.545) 11.478 7.161 ( 4.416 1.434 -3.407) 5.759 7.225 ( 1.630 5.573 20.374) 21.185 7.517 ( 4.520 2.411 1.728) 5.406 7.705 ( 4.782 3.411 -3.379) 6.776 7.931 ( 4.464 -0.183 7.224) 8.494 8.074 ( 3.971 0.924 -3.049) 5.091 8.171 ( 6.560 -3.641 -2.376) 7.870 8.375 ( 7.335 1.406 4.483) 8.711 8.951 ( 0.011 6.954 -5.756) 9.027 9.289 ( 17.301 30.358 -8.113) 35.872 9.646 ( -2.280 3.353 13.722) 14.309 9.851 ( 2.002 9.138 -3.600) 10.023 10.056 ( 11.486 8.326 -8.438) 16.506 10.297 ( 2.200 -7.177 -5.802) 9.487 10.904 ( -1.991 -1.210 3.837) 4.489 11.297 ( -10.544 -29.939 -13.078) 34.330 12.221 ( 5.466 6.398 7.239) 11.100 12.543 ( 1.480 1.039 -1.354) 2.259 12.590 ( 2.615 -1.867 28.772) 28.951 13.078 ( 5.108 3.582 -5.806) 8.522 13.411 ( -10.928 -7.953 9.969) 16.794 13.608 ( -8.999 -1.561 -0.112) 9.134 13.657 ( -12.516 -5.076 -11.545) 17.768 13.957 ( -8.436 -2.058 -3.924) 9.529 15.111 ( 8.767 -0.275 -8.352) 12.112 15.253 ( 8.673 -0.120 4.129) 9.607 17.785 ( -1.996 0.180 1.989) 2.824 17.824 ( 0.101 1.967 -5.062) 5.432 ======================= Grid point 3 (4/117) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.263 ( 15.016 -11.715 -0.388) 19.049 1.444 ( 17.664 -9.689 3.048) 20.376 1.636 ( -3.948 -0.747 -8.948) 9.809 1.794 ( 2.431 1.014 9.532) 9.889 1.941 ( -1.020 -6.920 4.545) 8.342 2.082 ( -5.336 -5.957 -5.125) 9.499 2.160 ( 4.152 -8.963 -1.466) 9.986 2.267 ( 6.010 -3.423 0.328) 6.924 2.288 ( -1.102 1.824 1.418) 2.560 2.413 ( -2.346 5.270 -2.736) 6.385 2.489 ( -2.522 5.152 1.349) 5.893 2.705 ( -4.433 1.007 2.260) 5.077 2.735 ( -3.625 0.362 -1.269) 3.858 2.779 ( -1.405 -0.094 -0.958) 1.703 2.953 ( -5.362 -2.317 -1.322) 5.989 3.029 ( -1.666 2.265 -2.729) 3.918 3.166 ( -0.180 1.036 2.525) 2.735 3.188 ( -2.152 0.950 -0.405) 2.387 3.318 ( -2.134 11.617 6.346) 13.408 3.459 ( -0.085 4.875 -0.893) 4.957 3.540 ( 0.096 9.228 -1.706) 9.385 3.667 ( -1.229 -3.256 1.146) 3.664 3.760 ( -0.270 -1.985 -1.906) 2.765 3.852 ( -2.173 2.927 3.414) 4.994 3.914 ( -1.098 1.970 -3.319) 4.013 4.098 ( 11.582 -0.898 -1.846) 11.762 4.266 ( -1.782 0.629 -1.431) 2.371 4.415 ( 5.186 -0.680 -1.120) 5.349 4.439 ( 0.636 -0.152 -4.564) 4.610 4.562 ( 5.984 -4.781 3.006) 8.228 4.696 ( -7.213 -0.421 1.007) 7.295 4.929 ( -3.675 -2.958 1.366) 4.911 4.987 ( -1.972 0.871 -2.820) 3.550 5.158 ( 1.284 -1.129 1.386) 2.200 5.338 ( -0.085 4.689 -1.505) 4.925 5.478 ( 3.031 -0.603 -0.309) 3.106 5.526 ( 9.872 0.418 3.050) 10.341 5.774 ( 12.264 -0.889 -1.218) 12.357 5.896 ( 9.572 -0.670 -5.878) 11.252 6.183 ( 3.130 -1.259 1.510) 3.696 6.390 ( -3.115 1.548 0.506) 3.515 6.520 ( -1.538 -0.910 -0.061) 1.788 6.762 ( 10.000 4.295 6.860) 12.865 6.903 ( 7.258 -0.144 2.161) 7.574 7.202 ( 2.392 1.588 -1.459) 3.220 7.224 ( 1.077 2.479 2.752) 3.857 7.619 ( 8.605 2.297 0.802) 8.942 7.782 ( 5.990 0.360 -4.723) 7.636 7.990 ( 2.273 1.609 7.033) 7.564 8.135 ( 2.729 -4.138 -1.357) 5.140 8.339 ( 8.645 -1.662 -2.110) 9.053 8.493 ( 7.067 0.737 3.547) 7.941 8.890 ( 0.179 5.910 -5.476) 8.059 9.312 ( 8.259 13.648 -1.709) 16.043 9.599 ( 0.373 6.049 9.254) 11.062 9.824 ( 3.876 7.407 -3.570) 9.090 10.153 ( 9.002 8.499 -4.199) 13.073 10.375 ( 1.287 -5.000 -8.018) 9.537 10.910 ( 0.129 -2.494 6.678) 7.129 11.355 ( -5.231 -16.155 -6.958) 18.351 12.287 ( 7.469 5.757 9.551) 13.422 12.565 ( 2.148 0.940 -4.075) 4.701 12.684 ( 3.149 -2.471 14.871) 15.400 13.096 ( 0.132 2.635 -1.989) 3.304 13.305 ( -8.133 -4.006 5.705) 10.712 13.391 ( -10.773 0.561 -6.596) 12.644 13.577 ( -4.314 -1.958 -2.892) 5.550 13.846 ( -6.220 -3.157 -4.207) 8.145 15.242 ( 6.668 -0.652 -5.317) 8.554 15.386 ( 6.890 1.578 4.099) 8.171 17.754 ( -1.830 -0.298 1.758) 2.555 17.803 ( -0.579 0.991 -2.492) 2.743 ======================= Grid point 4 (5/117) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.553 ( 8.844 -1.548 -2.535) 9.330 1.586 ( -1.365 -4.379 -4.226) 6.237 1.769 ( 9.706 -4.683 7.238) 12.982 1.793 ( -0.121 1.622 4.446) 4.734 1.899 ( -4.613 -4.635 -4.038) 7.686 2.085 ( 0.239 -6.932 2.108) 7.250 2.195 ( -0.951 -0.957 1.021) 1.692 2.241 ( -2.650 2.400 -1.824) 4.014 2.336 ( -2.179 2.866 -0.297) 3.613 2.369 ( 1.350 2.586 -4.833) 5.645 2.452 ( -1.527 -0.377 3.617) 3.944 2.586 ( -6.948 2.169 0.995) 7.347 2.761 ( 1.002 0.094 -0.441) 1.099 2.816 ( 3.226 -10.824 1.135) 11.351 2.922 ( -0.952 -2.781 -4.715) 5.556 3.035 ( 1.435 -0.971 0.389) 1.776 3.114 ( -2.058 5.697 0.782) 6.108 3.147 ( -0.381 0.351 -1.225) 1.330 3.213 ( -0.349 7.527 5.689) 9.442 3.409 ( -0.062 10.431 1.010) 10.480 3.498 ( 2.503 0.760 -4.694) 5.374 3.666 ( -0.378 -0.776 1.317) 1.575 3.780 ( -3.032 0.833 2.485) 4.007 3.814 ( 1.362 -3.619 -3.059) 4.930 3.881 ( 0.682 0.691 -1.699) 1.956 4.178 ( -6.361 3.144 1.743) 7.307 4.269 ( 7.065 -1.075 2.573) 7.596 4.458 ( 0.701 1.461 -5.851) 6.072 4.522 ( 7.589 2.763 -3.018) 8.622 4.595 ( -4.675 -3.310 4.194) 7.099 4.713 ( 4.256 -4.660 2.562) 6.812 4.840 ( -5.345 -0.819 -0.147) 5.409 5.001 ( 1.702 -1.355 -2.960) 3.673 5.180 ( 0.036 -0.605 2.640) 2.709 5.261 ( -2.784 4.300 -1.985) 5.494 5.516 ( 1.193 -0.091 -0.730) 1.402 5.675 ( 6.437 -0.158 2.273) 6.829 5.978 ( 10.052 -0.770 0.015) 10.081 6.043 ( 6.368 -0.544 -5.049) 8.145 6.243 ( 2.397 -0.373 0.234) 2.437 6.311 ( -3.576 1.095 0.869) 3.839 6.471 ( -4.253 0.108 -1.072) 4.388 6.858 ( 4.015 2.509 5.450) 7.219 6.980 ( 2.097 0.374 5.385) 5.790 7.212 ( 0.327 0.298 -7.753) 7.766 7.238 ( 2.164 1.340 3.543) 4.363 7.731 ( 5.999 2.432 0.546) 6.496 7.873 ( 3.981 -1.403 -6.117) 7.432 8.013 ( 1.191 0.664 6.026) 6.179 8.213 ( 1.976 -2.583 0.673) 3.321 8.459 ( 4.310 -0.247 -1.732) 4.651 8.619 ( 6.254 -2.364 2.465) 7.126 8.838 ( -0.496 4.778 -4.463) 6.557 9.317 ( 1.504 4.207 1.605) 4.748 9.580 ( 2.872 5.886 3.081) 7.238 9.840 ( 3.520 3.668 -1.783) 5.387 10.201 ( 4.363 6.117 -0.681) 7.545 10.416 ( 0.568 -2.593 -6.395) 6.924 10.951 ( 0.800 -2.354 5.062) 5.640 11.386 ( -2.372 -7.120 -3.376) 8.229 12.391 ( 7.523 3.182 11.461) 14.074 12.578 ( 0.805 1.232 -8.386) 8.514 12.760 ( 1.987 -1.524 5.312) 5.873 13.045 ( -3.361 -0.057 2.958) 4.478 13.218 ( -6.055 -2.515 -1.339) 6.692 13.245 ( -3.628 2.668 -2.166) 4.997 13.529 ( -2.101 -0.454 -0.993) 2.367 13.792 ( -2.724 -2.394 -2.658) 4.496 15.333 ( 3.637 -0.463 -2.717) 4.563 15.468 ( 3.682 1.253 2.461) 4.602 17.733 ( -1.061 -0.331 0.930) 1.449 17.785 ( -0.484 0.436 -1.065) 1.249 ======================= Grid point 5 (6/117) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.557 ( 0.000 -0.000 0.000) 0.000 1.678 ( -0.000 0.000 0.000) 0.000 1.738 ( 0.000 -0.000 -0.000) 0.000 1.854 ( 0.000 -0.000 -0.000) 0.000 1.966 ( 0.000 0.000 -0.000) 0.000 2.127 ( 0.000 0.000 -0.000) 0.000 2.158 ( 0.000 -0.000 0.000) 0.000 2.211 ( -0.000 0.000 0.000) 0.000 2.316 ( 0.000 -0.000 0.000) 0.000 2.388 ( 0.000 0.000 -0.000) 0.000 2.389 ( -0.000 -0.000 0.000) 0.000 2.511 ( 0.000 -0.000 -0.000) 0.000 2.766 ( 0.000 -0.000 -0.000) 0.000 2.916 ( 0.000 0.000 -0.000) 0.000 2.944 ( -0.000 0.000 0.000) 0.000 3.030 ( 0.000 -0.000 -0.000) 0.000 3.040 ( 0.000 -0.000 0.000) 0.000 3.151 ( 0.000 0.000 -0.000) 0.000 3.224 ( 0.000 0.000 0.000) 0.000 3.325 ( 0.000 -0.000 0.000) 0.000 3.534 ( 0.000 0.000 0.000) 0.000 3.669 ( 0.000 -0.000 -0.000) 0.000 3.752 ( -0.000 -0.000 -0.000) 0.000 3.817 ( 0.000 0.000 0.000) 0.000 3.952 ( 0.000 -0.000 -0.000) 0.000 4.052 ( 0.000 -0.000 0.000) 0.000 4.381 ( -0.000 0.000 -0.000) 0.000 4.389 ( 0.000 -0.000 0.000) 0.000 4.585 ( 0.000 -0.000 0.000) 0.000 4.598 ( 0.000 0.000 -0.000) 0.000 4.736 ( 0.000 -0.000 -0.000) 0.000 4.826 ( 0.000 -0.000 0.000) 0.000 5.032 ( 0.000 -0.000 -0.000) 0.000 5.170 ( 0.000 0.000 -0.000) 0.000 5.215 ( 0.000 -0.000 0.000) 0.000 5.525 ( 0.000 -0.000 -0.000) 0.000 5.735 ( 0.000 -0.000 -0.000) 0.000 6.082 ( 0.000 -0.000 0.000) 0.000 6.097 ( 0.000 -0.000 0.000) 0.000 6.261 ( 0.000 -0.000 -0.000) 0.000 6.283 ( 0.000 -0.000 0.000) 0.000 6.414 ( 0.000 -0.000 -0.000) 0.000 6.880 ( 0.000 -0.000 0.000) 0.000 6.998 ( 0.000 -0.000 -0.000) 0.000 7.208 ( 0.000 -0.000 0.000) 0.000 7.256 ( 0.000 -0.000 -0.000) 0.000 7.772 ( 0.000 -0.000 -0.000) 0.000 7.911 ( 0.000 -0.000 -0.000) 0.000 8.028 ( 0.000 -0.000 0.000) 0.000 8.240 ( 0.000 -0.000 0.000) 0.000 8.494 ( 0.000 -0.000 -0.000) 0.000 8.714 ( 0.000 0.000 -0.000) 0.000 8.787 ( 0.000 -0.000 0.000) 0.000 9.308 ( 0.000 -0.000 0.000) 0.000 9.585 ( 0.000 -0.000 -0.000) 0.000 9.857 ( 0.000 -0.000 0.000) 0.000 10.207 ( 0.000 -0.000 -0.000) 0.000 10.429 ( 0.000 -0.000 -0.000) 0.000 10.973 ( 0.000 -0.000 -0.000) 0.000 11.395 ( 0.000 -0.000 0.000) 0.000 12.473 ( 0.000 -0.000 -0.000) 0.000 12.557 ( 0.000 -0.000 -0.000) 0.000 12.784 ( 0.000 -0.000 -0.000) 0.000 13.021 ( 0.000 -0.000 0.000) 0.000 13.164 ( 0.000 0.000 -0.000) 0.000 13.205 ( 0.000 -0.000 -0.000) 0.000 13.513 ( 0.000 -0.000 -0.000) 0.000 13.780 ( 0.000 -0.000 0.000) 0.000 15.365 ( 0.000 -0.000 0.000) 0.000 15.496 ( 0.000 -0.000 -0.000) 0.000 17.725 ( 0.000 -0.000 -0.000) 0.000 17.778 ( 0.000 -0.000 -0.000) 0.000 ======================= Grid point 12 (7/117) ======================= q-point: ( 0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.690 ( 19.376 -0.000 -0.463) 19.381 0.898 ( 24.436 -0.000 7.047) 25.431 1.338 ( 33.636 -0.000 -3.638) 33.832 1.712 ( 1.476 -0.000 -2.372) 2.794 1.813 ( -4.077 0.000 5.255) 6.651 1.847 ( 5.509 -0.000 0.411) 5.525 2.165 ( -6.151 0.000 -3.612) 7.133 2.350 ( -7.249 0.000 1.788) 7.467 2.351 ( -2.797 0.000 0.777) 2.903 2.586 ( -5.742 0.000 -1.373) 5.904 2.647 ( -1.082 0.000 0.009) 1.083 2.756 ( -1.169 0.000 -1.725) 2.084 2.810 ( -3.852 0.000 -1.044) 3.991 2.827 ( -4.210 0.000 2.909) 5.118 3.053 ( -5.990 0.000 2.558) 6.514 3.103 ( -6.122 0.000 0.740) 6.166 3.210 ( -1.723 0.000 -2.176) 2.776 3.215 ( -0.237 0.000 0.283) 0.369 3.510 ( -0.945 0.000 4.139) 4.246 3.609 ( -4.950 0.000 3.983) 6.353 3.679 ( 0.280 -0.000 -0.507) 0.580 3.732 ( -7.770 0.000 -0.430) 7.782 3.779 ( -3.371 0.000 -3.767) 5.056 3.808 ( 8.345 -0.000 4.530) 9.495 3.895 ( 11.093 -0.000 -9.568) 14.649 4.027 ( -0.911 0.000 -5.861) 5.932 4.220 ( 1.545 -0.000 4.666) 4.915 4.362 ( -0.828 0.000 -6.355) 6.409 4.404 ( 0.679 -0.000 -0.343) 0.761 4.426 ( 1.930 -0.000 -1.391) 2.379 4.830 ( -4.314 0.000 -0.124) 4.316 4.851 ( 1.644 -0.000 -1.042) 1.947 5.071 ( -3.135 0.000 -0.385) 3.159 5.104 ( 3.561 -0.000 0.050) 3.561 5.305 ( 8.563 -0.000 -3.618) 9.296 5.370 ( 7.292 -0.000 0.263) 7.297 5.446 ( 2.185 -0.000 5.258) 5.694 5.549 ( 11.417 -0.000 -4.631) 12.321 5.777 ( 2.942 -0.000 -1.968) 3.539 6.101 ( 2.482 -0.000 3.111) 3.979 6.441 ( 3.368 -0.000 0.171) 3.372 6.486 ( 0.869 -0.000 2.171) 2.338 6.655 ( 14.278 -0.000 3.640) 14.735 6.686 ( 11.179 -0.000 -5.035) 12.260 7.171 ( 4.401 -0.000 -7.675) 8.847 7.279 ( -2.195 0.000 25.984) 26.077 7.524 ( 2.381 -0.000 -1.004) 2.584 7.768 ( 2.608 -0.000 2.238) 3.437 7.913 ( 5.537 -0.000 12.585) 13.749 8.071 ( -1.954 0.000 -4.989) 5.358 8.153 ( 11.073 -0.000 -3.252) 11.540 8.388 ( 7.286 -0.000 3.558) 8.108 8.999 ( -2.112 0.000 -0.498) 2.170 9.648 ( -6.970 0.000 10.520) 12.619 9.775 ( 3.041 -0.000 -18.895) 19.138 9.947 ( 1.178 -0.000 -0.424) 1.252 10.215 ( 4.054 -0.000 -4.169) 5.815 10.474 ( 7.669 -0.000 1.361) 7.789 10.492 ( 7.689 -0.000 -24.355) 25.540 10.942 ( -2.825 0.000 5.810) 6.460 12.304 ( 6.754 -0.000 -1.149) 6.851 12.534 ( -0.709 0.000 32.756) 32.764 12.571 ( 0.639 -0.000 13.790) 13.805 13.174 ( 4.650 -0.000 -7.004) 8.406 13.233 ( -4.819 0.000 6.808) 8.341 13.588 ( -0.177 0.000 -5.404) 5.407 13.639 ( -15.770 0.000 -8.744) 18.032 13.937 ( -8.967 0.000 -3.375) 9.581 15.106 ( 8.287 -0.000 -9.904) 12.914 15.250 ( 10.418 -0.000 4.459) 11.333 17.785 ( -2.381 0.000 2.733) 3.625 17.848 ( -1.136 0.000 -6.925) 7.017 ======================= Grid point 13 (8/117) ======================= q-point: ( 0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.049 ( 16.757 -9.013 -0.744) 19.042 1.320 ( 21.224 -3.846 4.997) 22.141 1.648 ( -2.838 1.359 -8.057) 8.650 1.782 ( 10.103 -3.056 3.283) 11.054 1.840 ( 2.290 -1.466 11.090) 11.419 2.001 ( 7.479 -4.654 -6.664) 11.045 2.032 ( -4.941 -1.941 -1.193) 5.441 2.269 ( -1.065 1.144 0.256) 1.584 2.298 ( -2.175 -0.359 -0.118) 2.207 2.516 ( -0.374 4.535 -2.965) 5.431 2.570 ( -5.903 2.739 -0.496) 6.527 2.726 ( -4.890 0.711 -0.169) 4.944 2.732 ( -2.070 0.375 -0.508) 2.165 2.784 ( -1.397 -0.144 3.175) 3.471 2.917 ( -7.139 -1.767 0.286) 7.360 3.024 ( -4.848 -1.761 -0.552) 5.187 3.172 ( -1.641 1.372 -0.800) 2.284 3.225 ( 0.565 1.203 1.961) 2.369 3.487 ( -2.329 6.200 7.912) 10.318 3.528 ( -1.813 2.538 -0.668) 3.189 3.603 ( -3.004 -1.826 2.030) 4.060 3.667 ( -2.037 2.009 -1.247) 3.121 3.715 ( -2.960 -0.762 -4.518) 5.455 3.892 ( 0.123 0.871 3.112) 3.234 3.981 ( -1.036 3.505 -6.256) 7.245 4.092 ( 11.616 -0.043 -5.296) 12.766 4.287 ( 4.107 1.420 2.744) 5.139 4.388 ( 2.596 -1.508 -0.325) 3.020 4.416 ( 3.531 -2.136 -9.400) 10.266 4.504 ( 4.788 -1.401 6.537) 8.223 4.706 ( -8.211 1.188 -0.933) 8.349 4.871 ( -2.378 -2.778 2.046) 4.190 5.004 ( -2.609 0.775 -3.147) 4.161 5.135 ( 0.374 -1.046 1.321) 1.726 5.403 ( 2.199 2.496 -2.798) 4.347 5.455 ( 1.086 -1.521 0.482) 1.930 5.538 ( 9.088 0.588 2.932) 9.567 5.759 ( 12.735 -0.590 -3.100) 13.120 5.889 ( 9.299 -0.178 -3.499) 9.938 6.164 ( 3.790 -0.681 1.642) 4.186 6.418 ( -3.407 1.312 0.137) 3.654 6.499 ( -0.670 -1.096 0.404) 1.347 6.832 ( 8.373 3.160 0.916) 8.996 6.888 ( 8.057 -1.416 6.466) 10.428 7.213 ( 1.475 0.155 -9.333) 9.450 7.266 ( -0.574 1.609 13.236) 13.346 7.616 ( 7.648 -1.042 -3.534) 8.489 7.817 ( 4.069 2.094 2.035) 5.008 8.002 ( 1.233 -0.199 9.504) 9.586 8.066 ( 2.509 -2.449 -2.389) 4.243 8.331 ( 10.014 0.264 -4.138) 10.839 8.509 ( 6.380 0.620 3.032) 7.091 8.956 ( -1.739 1.671 -1.681) 2.939 9.508 ( -6.274 4.963 3.999) 8.944 9.752 ( 2.956 9.828 -8.058) 13.049 9.957 ( 2.718 5.056 -0.677) 5.779 10.294 ( 5.520 0.609 -7.177) 9.075 10.400 ( 10.145 18.146 -2.779) 20.974 10.794 ( -1.423 -13.599 0.137) 13.674 10.964 ( -2.567 -20.821 0.373) 20.982 12.405 ( 8.070 6.868 4.498) 11.512 12.583 ( 2.606 -0.974 3.917) 4.804 12.610 ( 1.187 -4.042 19.445) 19.897 13.150 ( -3.009 2.134 2.502) 4.457 13.252 ( 1.340 -0.514 -1.887) 2.371 13.364 ( -13.322 -2.546 -11.469) 17.762 13.595 ( 0.346 2.033 -0.058) 2.063 13.795 ( -7.378 -2.142 -4.203) 8.757 15.231 ( 6.710 -0.422 -6.724) 9.508 15.401 ( 6.537 0.258 4.573) 7.982 17.749 ( -1.997 -0.158 1.924) 2.777 17.817 ( -1.309 0.533 -2.924) 3.248 ======================= Grid point 14 (9/117) ======================= q-point: ( 0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.388 ( 11.294 -10.986 -2.581) 15.966 1.606 ( 0.480 1.920 -1.202) 2.316 1.668 ( 12.947 -4.524 -1.046) 13.754 1.833 ( -2.086 -1.630 5.817) 6.391 1.845 ( -2.801 1.532 3.606) 4.817 1.962 ( -0.647 -5.981 1.264) 6.147 2.145 ( 2.002 -3.349 -2.618) 4.699 2.283 ( 0.009 0.736 0.308) 0.798 2.369 ( 4.157 -0.719 -0.517) 4.250 2.382 ( -6.260 1.461 -4.867) 8.063 2.501 ( 1.187 5.197 -0.625) 5.367 2.624 ( -6.000 1.872 1.298) 6.417 2.704 ( -0.671 -2.012 -1.493) 2.594 2.781 ( 1.345 2.169 2.549) 3.608 2.863 ( -2.341 -3.168 -0.924) 4.046 2.997 ( -0.946 -4.819 -0.401) 4.927 3.126 ( -2.437 1.375 0.121) 2.800 3.195 ( -2.279 2.930 2.636) 4.553 3.372 ( -3.773 5.978 6.733) 9.762 3.516 ( 3.863 3.058 -3.671) 6.144 3.583 ( -1.949 6.085 -2.632) 6.910 3.630 ( 0.724 -1.992 4.789) 5.237 3.705 ( -1.542 -4.575 -4.677) 6.722 3.854 ( -0.288 3.136 1.015) 3.309 3.927 ( -0.323 3.369 -3.902) 5.165 4.248 ( -1.087 3.396 3.664) 5.113 4.262 ( 4.620 1.799 -1.024) 5.062 4.482 ( 5.491 -0.343 -4.809) 7.307 4.522 ( -1.599 -2.282 2.736) 3.905 4.569 ( 2.669 1.320 -4.464) 5.366 4.633 ( 4.548 -4.036 3.043) 6.799 4.810 ( -5.909 -2.303 4.207) 7.611 4.987 ( 0.872 -0.070 -4.945) 5.022 5.153 ( 0.066 -1.993 0.935) 2.202 5.341 ( -3.604 4.358 -1.312) 5.806 5.484 ( -0.634 -3.115 -0.879) 3.298 5.684 ( 7.364 0.967 2.206) 7.748 5.969 ( 10.681 -0.402 -0.734) 10.714 6.036 ( 6.680 -0.280 -3.871) 7.726 6.231 ( 2.808 -0.788 -0.288) 2.930 6.332 ( -4.572 1.136 1.139) 4.847 6.471 ( -3.194 -0.056 -1.224) 3.420 6.898 ( 1.995 1.879 -0.133) 2.744 6.979 ( 1.467 -0.365 10.122) 10.235 7.209 ( -0.595 -0.417 -7.773) 7.807 7.265 ( 0.787 1.452 6.011) 6.234 7.743 ( 4.613 -0.727 -1.518) 4.911 7.868 ( 3.399 1.094 -2.182) 4.185 8.012 ( -0.340 -1.550 5.001) 5.247 8.156 ( 3.555 -2.534 2.333) 4.950 8.470 ( 6.703 1.079 -4.441) 8.113 8.601 ( 4.524 -0.199 2.502) 5.174 8.909 ( -1.359 2.793 -2.986) 4.308 9.377 ( -5.597 2.372 3.505) 7.017 9.694 ( -0.760 6.651 -4.581) 8.112 9.955 ( 3.523 7.529 -2.078) 8.568 10.369 ( 4.883 1.924 -6.209) 8.130 10.385 ( 2.438 11.759 1.056) 12.056 10.833 ( -3.162 -9.958 7.571) 12.902 11.131 ( -1.375 -20.385 -3.563) 20.739 12.474 ( 5.778 6.137 11.956) 14.628 12.618 ( 2.537 2.971 -5.587) 6.817 12.718 ( 3.564 -4.612 8.215) 10.073 13.055 ( -5.068 1.266 -2.513) 5.796 13.177 ( -6.756 -2.490 -2.050) 7.486 13.289 ( 0.509 2.803 -2.233) 3.619 13.566 ( -0.033 4.026 0.170) 4.029 13.738 ( -1.887 -3.799 -2.681) 5.018 15.321 ( 3.741 -0.698 -5.254) 6.487 15.478 ( 2.150 0.031 4.224) 4.740 17.727 ( -0.945 -0.293 0.652) 1.184 17.792 ( -0.941 0.330 -0.770) 1.260 ======================= Grid point 15 (10/117) ======================= q-point: ( 0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( -1.196 -3.367 1.237) 3.781 1.646 ( 3.301 -1.765 -3.704) 5.266 1.764 ( -3.748 1.410 1.227) 4.188 1.809 ( 1.115 -6.412 -2.483) 6.966 1.918 ( 9.501 -1.130 3.427) 10.163 2.063 ( 1.733 -4.745 3.856) 6.355 2.193 ( -1.881 1.428 -1.368) 2.730 2.216 ( 1.585 -0.328 -3.398) 3.763 2.322 ( 0.167 0.888 -0.915) 1.286 2.390 ( -2.112 1.696 -3.108) 4.123 2.461 ( -0.238 6.014 0.124) 6.020 2.540 ( -0.504 2.075 3.902) 4.448 2.738 ( -0.926 -6.014 -0.554) 6.110 2.812 ( 3.283 -2.365 2.480) 4.746 2.871 ( -0.979 -5.070 -1.625) 5.413 3.030 ( -1.198 -1.195 -0.239) 1.709 3.065 ( -3.552 0.371 0.293) 3.584 3.142 ( -0.277 -1.247 0.203) 1.294 3.279 ( -2.070 5.789 5.363) 8.159 3.470 ( -3.262 8.031 -3.814) 9.470 3.551 ( 0.588 3.765 2.917) 4.799 3.663 ( -0.039 -0.173 -0.701) 0.723 3.706 ( 1.110 -2.906 -3.265) 4.510 3.872 ( 4.408 3.556 0.807) 5.721 3.952 ( 5.895 0.131 -3.349) 6.781 4.090 ( -8.181 4.745 2.579) 9.803 4.368 ( 5.024 -0.473 2.764) 5.754 4.414 ( -5.735 0.403 -2.161) 6.142 4.545 ( -0.942 -0.719 -0.561) 1.311 4.626 ( -0.767 0.211 -1.380) 1.593 4.726 ( 5.450 -0.618 2.945) 6.225 4.807 ( 1.427 -2.202 0.909) 2.777 5.009 ( 0.966 -1.738 -3.164) 3.736 5.168 ( -0.472 -1.252 2.053) 2.450 5.239 ( -2.965 3.097 -3.613) 5.607 5.488 ( -2.310 -3.973 0.221) 4.601 5.752 ( 1.238 1.788 0.462) 2.223 6.085 ( 0.942 0.271 0.008) 0.980 6.099 ( 1.199 0.198 -0.023) 1.216 6.264 ( 0.151 0.077 1.102) 1.115 6.275 ( -1.268 -0.557 -0.960) 1.685 6.417 ( -0.682 0.324 -0.725) 1.047 6.881 ( -2.290 0.042 -4.401) 4.961 6.990 ( -1.283 -0.796 4.370) 4.623 7.197 ( -0.875 -1.066 -0.656) 1.527 7.264 ( -0.683 0.825 2.407) 2.634 7.757 ( -3.560 -1.498 1.906) 4.307 7.901 ( 0.776 -0.304 -3.686) 3.779 8.032 ( 0.216 -0.611 4.564) 4.610 8.214 ( 0.482 -2.114 0.683) 2.273 8.521 ( 1.946 2.766 -3.085) 4.577 8.682 ( 3.088 -2.155 1.407) 4.020 8.842 ( -2.991 4.073 -2.758) 5.757 9.285 ( -5.247 -2.228 2.219) 6.117 9.596 ( -5.804 1.439 -3.738) 7.052 9.931 ( 1.203 7.306 -3.126) 8.037 10.279 ( -3.706 7.897 2.696) 9.130 10.418 ( 1.615 -0.600 -0.266) 1.744 10.884 ( -2.170 -9.266 4.795) 10.657 11.259 ( -0.842 -14.312 -1.436) 14.408 12.502 ( -0.711 3.371 2.874) 4.486 12.588 ( -1.149 3.371 -0.547) 3.603 12.797 ( 3.055 -0.122 -1.760) 3.528 13.029 ( 3.001 0.865 -0.622) 3.184 13.118 ( -2.605 -3.348 0.075) 4.243 13.256 ( 0.297 4.226 0.085) 4.237 13.549 ( 2.279 3.733 -0.071) 4.374 13.768 ( 2.036 -1.501 0.436) 2.567 15.357 ( 0.199 -0.784 -3.844) 3.929 15.485 ( -2.132 -1.018 3.091) 3.891 17.724 ( 0.294 -0.181 -0.450) 0.567 17.779 ( -0.392 0.064 0.534) 0.666 ======================= Grid point 16 (11/117) ======================= q-point: (-0.50 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.520 ( -3.552 -2.452 3.203) 5.375 1.670 ( -0.481 1.544 3.085) 3.484 1.733 ( 1.071 -1.427 -5.392) 5.680 1.849 ( -0.909 1.452 -7.127) 7.330 1.995 ( -0.685 5.106 5.415) 7.474 2.146 ( 2.865 -2.393 0.929) 3.847 2.174 ( 0.531 -4.402 -1.159) 4.583 2.209 ( 2.519 3.785 -2.067) 4.994 2.327 ( 0.743 1.301 -0.611) 1.618 2.340 ( -0.630 -0.212 0.986) 1.189 2.474 ( 2.769 2.293 0.180) 3.600 2.564 ( 5.671 -0.207 -0.247) 5.680 2.760 ( -0.256 -1.626 1.001) 1.927 2.904 ( -0.454 -5.012 2.697) 5.710 2.931 ( 2.477 -7.765 -0.942) 8.204 2.988 ( -1.583 3.062 -0.324) 3.462 3.020 ( -0.535 -3.736 -0.782) 3.855 3.186 ( -4.040 7.274 2.723) 8.755 3.201 ( 1.207 -2.234 -0.388) 2.569 3.312 ( -4.895 4.793 -2.265) 7.216 3.510 ( -1.687 2.352 3.932) 4.883 3.636 ( -2.081 -2.606 -0.873) 3.448 3.775 ( 3.767 1.181 -2.218) 4.528 3.881 ( -5.696 3.038 1.214) 6.569 3.925 ( 4.347 4.706 1.255) 6.528 4.128 ( 7.720 -2.845 -2.917) 8.729 4.299 ( -6.308 2.075 -3.098) 7.327 4.444 ( 0.787 -0.035 4.416) 4.486 4.464 ( -6.450 -3.299 2.240) 7.583 4.639 ( 2.840 1.513 -2.609) 4.143 4.782 ( -2.013 2.923 -1.996) 4.073 4.838 ( 4.335 -0.965 3.062) 5.394 5.017 ( -1.492 -0.207 -0.280) 1.532 5.164 ( -0.309 -1.306 1.244) 1.830 5.214 ( 0.613 -1.352 -3.232) 3.556 5.479 ( -3.089 -4.284 0.993) 5.374 5.695 ( -5.423 2.082 -2.129) 6.186 5.997 ( -9.836 1.251 -0.491) 9.928 6.054 ( -5.847 0.646 6.148) 8.509 6.242 ( -1.820 -0.358 -1.163) 2.189 6.295 ( 2.678 -0.828 -0.570) 2.860 6.469 ( 4.764 -0.071 1.093) 4.888 6.816 ( -5.725 -2.141 -9.137) 10.993 6.962 ( -3.479 -1.776 -2.403) 4.586 7.195 ( -1.306 -1.571 6.997) 7.289 7.224 ( -3.645 -0.138 -0.272) 3.658 7.673 ( -8.494 -3.496 0.836) 9.223 7.885 ( -3.235 -0.435 2.285) 3.984 8.017 ( -2.004 0.968 0.651) 2.319 8.214 ( -2.394 -2.015 -1.516) 3.477 8.492 ( -1.645 3.588 -1.447) 4.204 8.685 ( -5.262 4.189 -2.281) 7.102 8.767 ( -1.412 -2.433 3.437) 4.441 9.231 ( -6.263 -5.722 -2.432) 8.825 9.485 ( -6.913 -4.574 -1.881) 8.500 9.855 ( -3.069 5.082 -3.117) 6.706 10.152 ( -7.009 0.118 3.562) 7.863 10.441 ( 0.604 0.056 5.788) 5.820 10.911 ( -3.092 -6.133 -1.065) 6.950 11.362 ( 1.134 -9.084 2.127) 9.398 12.371 ( -8.674 1.093 -13.398) 15.998 12.575 ( -0.364 0.967 11.600) 11.646 12.824 ( 2.045 5.207 -3.511) 6.605 13.047 ( 1.075 0.468 -5.008) 5.144 13.178 ( 3.252 -4.216 3.525) 6.386 13.272 ( 6.622 2.864 -0.704) 7.249 13.579 ( 5.373 4.539 0.965) 7.099 13.824 ( 4.154 1.205 3.149) 5.350 15.333 ( -3.324 -0.445 -1.236) 3.574 15.434 ( -5.765 -2.528 0.580) 6.321 17.737 ( 1.271 0.145 -1.286) 1.814 17.778 ( -0.003 -0.343 1.479) 1.518 ======================= Grid point 17 (12/117) ======================= q-point: (-0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.397 ( -11.432 3.664 0.715) 12.026 1.637 ( -11.993 11.491 -2.460) 16.791 1.683 ( 3.483 3.691 6.259) 8.058 1.770 ( 0.834 -1.137 -7.941) 8.065 2.008 ( 3.575 1.302 0.980) 3.929 2.156 ( 4.082 -1.873 2.250) 5.023 2.244 ( 3.325 3.427 -6.055) 7.711 2.274 ( -0.831 4.501 4.439) 6.376 2.327 ( 1.759 -3.790 0.038) 4.179 2.362 ( 3.210 -1.642 0.717) 3.676 2.494 ( 0.610 4.623 -2.072) 5.103 2.692 ( 6.274 -1.368 -2.411) 6.859 2.743 ( -2.247 2.796 1.819) 4.022 2.845 ( -3.799 9.612 0.810) 10.367 2.961 ( 0.067 -6.139 2.949) 6.811 2.986 ( -2.319 0.203 0.992) 2.530 3.064 ( 0.661 -5.359 1.588) 5.628 3.116 ( 4.512 -8.181 -1.815) 9.517 3.232 ( 2.244 0.830 -1.959) 3.092 3.312 ( -0.640 -8.796 -1.750) 8.991 3.473 ( -1.089 0.984 3.727) 4.006 3.662 ( 1.267 -3.525 -0.650) 3.802 3.749 ( -4.488 -1.823 0.453) 4.865 3.850 ( 3.025 2.713 -2.810) 4.940 3.951 ( 2.763 4.898 2.130) 6.013 4.124 ( -10.306 1.988 -2.801) 10.864 4.260 ( 4.806 -0.266 0.873) 4.892 4.406 ( -2.909 -2.320 2.933) 4.738 4.431 ( -1.957 -0.014 2.934) 3.527 4.648 ( -5.157 4.509 -0.183) 6.853 4.715 ( 4.766 1.393 -2.959) 5.780 4.950 ( 6.319 -0.921 0.313) 6.394 4.985 ( -1.348 0.584 1.375) 2.012 5.158 ( -2.467 -1.441 -1.088) 3.057 5.254 ( 0.629 -4.107 -0.302) 4.166 5.450 ( -5.080 -3.748 1.309) 6.447 5.542 ( -8.844 2.190 -4.060) 9.975 5.788 ( -12.395 0.636 -0.550) 12.424 5.911 ( -9.820 0.917 8.396) 12.953 6.201 ( -2.243 0.669 -1.933) 3.035 6.367 ( 3.435 -1.062 -0.803) 3.684 6.526 ( 0.686 -0.266 0.502) 0.890 6.697 ( -9.322 -2.824 -9.484) 13.595 6.887 ( -7.494 -2.195 -1.356) 7.926 7.154 ( -5.244 -2.966 -6.846) 9.119 7.187 ( -2.902 -2.234 10.570) 11.187 7.545 ( -9.860 -4.463 -2.155) 11.036 7.799 ( -6.534 0.811 7.542) 10.012 7.964 ( -3.625 -0.635 -2.379) 4.382 8.162 ( -5.442 -1.613 -2.199) 6.087 8.401 ( -4.353 5.224 0.458) 6.815 8.513 ( -8.421 3.534 -3.770) 9.881 8.777 ( -3.176 -5.675 7.210) 9.710 9.128 ( -11.423 -7.768 -5.370) 14.821 9.480 ( -0.404 -8.082 -2.783) 8.557 9.755 ( -4.650 0.295 -2.005) 5.073 10.042 ( -8.773 -4.608 5.199) 11.190 10.450 ( 0.791 2.648 9.221) 9.626 10.887 ( -4.246 -4.564 -6.095) 8.718 11.467 ( 4.468 -3.047 6.052) 8.116 12.212 ( -8.338 -2.569 -12.954) 15.618 12.563 ( -1.277 0.791 7.749) 7.893 12.759 ( -1.619 7.663 -7.578) 10.898 13.072 ( 0.883 -0.674 -0.228) 1.134 13.276 ( 3.690 -5.653 -0.363) 6.761 13.423 ( 12.803 3.010 -1.365) 13.223 13.660 ( 9.546 6.082 2.042) 11.502 13.899 ( 6.258 2.773 5.051) 8.507 15.248 ( -6.935 -0.063 3.158) 7.620 15.342 ( -7.505 -3.421 -3.277) 8.875 17.758 ( 1.358 0.193 -1.265) 1.865 17.787 ( 0.265 -0.777 1.782) 1.962 ======================= Grid point 18 (13/117) ======================= q-point: (-0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.094 ( -15.304 10.792 -1.940) 18.826 1.253 ( -16.894 15.705 1.051) 23.090 1.723 ( -2.251 0.949 -1.763) 3.012 1.773 ( 4.664 6.920 1.896) 8.558 1.997 ( -3.841 14.471 -4.211) 15.552 2.112 ( -11.118 15.360 1.821) 19.049 2.212 ( 1.348 5.278 5.067) 7.439 2.275 ( 3.437 -4.300 -4.222) 6.938 2.301 ( 5.987 -0.352 -0.394) 6.011 2.450 ( 0.572 -3.737 -1.727) 4.156 2.498 ( 8.471 -3.839 1.380) 9.403 2.758 ( 3.601 -2.299 -2.060) 4.743 2.799 ( 2.818 -2.282 -0.494) 3.660 2.818 ( 3.287 1.813 3.946) 5.447 2.967 ( -0.302 -5.664 1.831) 5.960 3.078 ( -0.440 -8.552 -3.006) 9.076 3.119 ( 4.477 -1.756 1.380) 5.003 3.259 ( 3.704 0.040 1.026) 3.843 3.298 ( 5.557 -7.191 -2.522) 9.432 3.390 ( 0.726 -8.693 -1.695) 8.887 3.464 ( -1.736 -3.063 2.723) 4.451 3.652 ( -4.585 -1.785 3.887) 6.270 3.757 ( 0.956 -3.604 -3.458) 5.085 3.857 ( -0.401 1.414 -6.212) 6.384 3.906 ( -9.402 1.983 3.762) 10.319 3.961 ( 0.488 4.007 2.728) 4.871 4.317 ( 1.397 3.042 1.119) 3.529 4.352 ( -1.179 -2.856 2.411) 3.919 4.469 ( 2.629 1.167 -4.465) 5.311 4.545 ( 0.674 3.342 5.527) 6.494 4.781 ( 2.348 -0.151 0.569) 2.421 4.961 ( -0.580 1.569 -0.603) 1.778 5.034 ( -1.338 -0.951 3.256) 3.646 5.112 ( -1.321 -1.363 -3.669) 4.131 5.284 ( -2.588 -2.617 -0.299) 3.693 5.341 ( -7.103 -3.387 -1.937) 8.104 5.406 ( -6.320 0.815 -0.176) 6.375 5.580 ( -10.749 0.648 0.163) 10.769 5.766 ( -5.970 -0.110 6.325) 8.698 6.160 ( -0.866 1.990 -3.022) 3.720 6.370 ( -7.746 -2.907 -3.327) 8.917 6.468 ( -7.785 -3.097 -1.281) 8.476 6.578 ( -3.068 1.829 -3.107) 4.734 6.744 ( -9.766 -0.763 2.565) 10.126 7.070 ( -10.065 -8.417 -17.341) 21.745 7.151 ( -4.959 -2.332 10.346) 11.708 7.441 ( -5.104 -4.115 -3.625) 7.492 7.696 ( -4.779 0.601 7.945) 9.292 7.894 ( -6.650 -3.371 0.283) 7.461 8.052 ( -8.683 -1.753 -2.686) 9.256 8.271 ( -3.493 6.965 2.672) 8.237 8.357 ( -7.138 0.220 -6.799) 9.860 8.753 ( -9.863 -10.248 11.616) 18.364 9.016 ( -7.174 -6.892 -6.262) 11.755 9.564 ( 2.274 -6.842 -9.090) 11.602 9.707 ( -3.273 -5.571 2.102) 6.794 9.940 ( -9.123 -5.751 7.591) 13.188 10.430 ( 0.446 6.939 8.364) 10.877 10.857 ( -3.233 -5.939 -6.736) 9.545 11.587 ( 9.160 3.887 11.265) 15.031 12.114 ( -5.625 -5.697 -11.973) 14.403 12.539 ( -1.169 0.761 3.555) 3.819 12.640 ( -3.611 6.400 -12.083) 14.142 13.062 ( -2.056 1.156 3.029) 3.839 13.400 ( 4.270 -6.092 -4.361) 8.624 13.642 ( 15.235 1.940 2.143) 15.507 13.811 ( 15.632 8.498 -0.954) 17.818 14.002 ( 7.775 2.850 5.393) 9.882 15.105 ( -10.696 -1.092 5.627) 12.135 15.242 ( -5.671 -1.531 -3.848) 7.022 17.771 ( -0.679 -1.237 1.856) 2.332 17.804 ( 1.148 -0.278 -0.290) 1.217 ======================= Grid point 19 (14/117) ======================= q-point: (-0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.703 ( -16.352 14.620 -1.662) 21.997 0.812 ( -15.372 19.938 1.844) 25.243 1.387 ( -13.529 39.535 -0.388) 41.787 1.673 ( -3.928 2.933 -2.039) 5.309 1.921 ( 3.100 3.639 -5.833) 7.542 1.940 ( -0.576 6.864 5.621) 8.891 2.209 ( 0.361 1.082 1.166) 1.631 2.393 ( 5.752 -1.877 0.212) 6.054 2.436 ( 6.191 -4.498 -0.982) 7.716 2.488 ( -0.961 -5.847 -1.417) 6.092 2.667 ( 5.566 -1.367 1.289) 5.875 2.802 ( 1.194 -0.693 0.313) 1.415 2.840 ( 0.553 -1.613 0.459) 1.765 2.879 ( 2.077 -3.036 -1.364) 3.923 3.049 ( 1.593 -2.494 2.386) 3.801 3.125 ( 3.484 -4.802 1.651) 6.158 3.226 ( 2.594 -3.923 -4.801) 6.720 3.306 ( 4.180 2.387 1.686) 5.100 3.436 ( -0.237 -10.131 -2.504) 10.439 3.461 ( -2.920 -5.063 2.629) 6.409 3.487 ( 2.967 -5.662 -0.591) 6.419 3.607 ( -2.926 -2.374 7.822) 8.682 3.711 ( -8.692 1.175 -4.090) 9.678 3.784 ( -2.899 -2.129 2.300) 4.270 3.800 ( -3.069 1.375 -6.941) 7.713 3.963 ( 1.312 2.254 2.270) 3.458 4.309 ( -0.483 -2.199 0.389) 2.285 4.424 ( 5.333 -1.031 1.575) 5.655 4.452 ( 1.913 3.931 -3.825) 5.809 4.657 ( 10.559 1.890 5.498) 12.053 4.812 ( 3.577 0.833 4.017) 5.443 4.902 ( -5.429 1.566 0.213) 5.654 4.936 ( -6.557 -1.834 1.262) 6.924 5.155 ( 1.041 -2.202 -6.431) 6.876 5.169 ( -5.522 1.677 0.918) 5.844 5.278 ( -5.196 1.721 2.733) 6.118 5.361 ( -3.890 -0.947 2.181) 4.559 5.439 ( -0.855 -2.002 -0.937) 2.370 5.751 ( 2.342 -2.501 1.934) 3.934 6.113 ( -5.920 0.926 -3.567) 6.974 6.170 ( -11.366 -2.415 -1.711) 11.745 6.345 ( -12.393 -3.760 -1.614) 13.051 6.520 ( -0.995 2.654 -2.780) 3.971 6.617 ( -4.340 1.748 4.235) 6.311 6.887 ( -20.799 -13.667 -25.893) 35.914 7.088 ( -4.482 -1.183 6.300) 7.822 7.451 ( 2.556 -3.205 -3.570) 5.436 7.649 ( -2.362 -0.009 8.035) 8.375 7.801 ( -8.256 -6.021 3.574) 10.825 7.905 ( -8.853 -1.433 -3.119) 9.495 8.186 ( -1.038 4.711 2.812) 5.584 8.253 ( -3.632 -0.257 -7.529) 8.363 8.627 ( -16.236 -10.004 12.265) 22.674 8.998 ( -0.826 -3.954 -3.500) 5.345 9.643 ( 2.619 -4.815 -13.575) 14.640 9.744 ( -1.548 -9.758 6.200) 11.664 9.853 ( -6.771 -4.517 7.812) 11.281 10.361 ( -0.298 9.938 4.059) 10.739 10.877 ( -0.744 -7.272 -3.181) 7.972 11.750 ( 14.477 8.148 20.395) 26.304 12.098 ( -1.022 -7.057 -12.063) 14.014 12.493 ( -6.523 4.573 -18.516) 20.157 12.523 ( -0.614 -0.224 0.661) 0.930 12.998 ( -3.443 2.572 4.342) 6.109 13.501 ( 2.383 -4.360 -3.008) 5.809 13.899 ( 13.348 -1.173 5.091) 14.334 14.055 ( 23.464 10.048 -10.132) 27.462 14.110 ( 6.060 1.866 3.500) 7.242 14.920 ( -12.836 -2.316 5.526) 14.165 15.200 ( 2.898 2.305 0.886) 3.807 17.752 ( -4.238 -2.682 5.186) 7.215 17.826 ( 1.180 0.143 -1.344) 1.794 ======================= Grid point 20 (15/117) ======================= q-point: (-0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.347 ( 0.000 19.691 -0.000) 19.691 0.450 ( 0.000 25.237 -0.000) 25.237 0.852 ( 0.000 47.841 -0.000) 47.841 1.614 ( 0.000 1.817 -0.000) 1.817 1.825 ( 0.000 8.416 -0.000) 8.416 1.985 ( -0.000 -0.647 0.000) 0.647 2.210 ( 0.000 0.259 -0.000) 0.259 2.465 ( -0.000 -0.260 0.000) 0.260 2.522 ( -0.000 -6.272 0.000) 6.272 2.543 ( -0.000 -6.060 0.000) 6.060 2.703 ( 0.000 0.908 -0.000) 0.908 2.808 ( 0.000 0.835 -0.000) 0.835 2.852 ( -0.000 -1.136 0.000) 1.136 2.937 ( -0.000 -2.827 0.000) 2.827 3.057 ( 0.000 1.073 -0.000) 1.073 3.220 ( -0.000 -3.339 0.000) 3.339 3.264 ( -0.000 -0.957 0.000) 0.957 3.382 ( 0.000 0.093 -0.000) 0.093 3.396 ( 0.000 4.864 -0.000) 4.864 3.488 ( -0.000 -7.956 0.000) 7.956 3.568 ( -0.000 -6.148 0.000) 6.148 3.597 ( -0.000 -1.543 0.000) 1.543 3.606 ( -0.000 -1.500 0.000) 1.500 3.741 ( 0.000 1.798 -0.000) 1.798 3.778 ( -0.000 -2.660 0.000) 2.660 3.964 ( 0.000 0.459 -0.000) 0.459 4.320 ( -0.000 -1.312 0.000) 1.312 4.435 ( 0.000 2.479 -0.000) 2.479 4.533 ( -0.000 -2.081 0.000) 2.081 4.740 ( -0.000 -2.372 0.000) 2.372 4.856 ( -0.000 -3.232 0.000) 3.232 4.858 ( 0.000 0.952 -0.000) 0.952 5.042 ( 0.000 0.105 -0.000) 0.105 5.093 ( -0.000 -4.464 0.000) 4.464 5.120 ( 0.000 5.812 -0.000) 5.812 5.229 ( 0.000 4.077 -0.000) 4.077 5.245 ( -0.000 -0.838 0.000) 0.838 5.536 ( -0.000 -5.158 0.000) 5.158 5.884 ( -0.000 -5.938 0.000) 5.938 5.933 ( -0.000 -0.474 0.000) 0.474 6.079 ( 0.000 1.612 -0.000) 1.612 6.119 ( 0.000 3.828 -0.000) 3.828 6.502 ( 0.000 1.822 -0.000) 1.822 6.587 ( 0.000 0.240 -0.000) 0.240 6.620 ( 0.000 0.408 -0.000) 0.408 7.056 ( -0.000 -0.561 0.000) 0.561 7.543 ( -0.000 -2.070 0.000) 2.070 7.582 ( -0.000 -0.306 0.000) 0.306 7.792 ( 0.000 1.385 -0.000) 1.385 7.809 ( -0.000 -6.347 0.000) 6.347 8.146 ( 0.000 2.402 -0.000) 2.402 8.227 ( -0.000 -0.339 0.000) 0.339 8.470 ( 0.000 1.256 -0.000) 1.256 9.022 ( -0.000 -2.653 0.000) 2.653 9.715 ( -0.000 -5.491 0.000) 5.491 9.794 ( -0.000 -4.815 0.000) 4.815 9.842 ( -0.000 -6.672 0.000) 6.672 10.269 ( 0.000 9.933 -0.000) 9.933 10.932 ( -0.000 -5.491 0.000) 5.491 11.927 ( -0.000 -0.884 0.000) 0.884 12.212 ( -0.000 -9.879 0.000) 9.879 12.281 ( 0.000 10.285 -0.000) 10.285 12.525 ( -0.000 -1.100 0.000) 1.100 12.934 ( 0.000 3.084 -0.000) 3.084 13.549 ( -0.000 -2.487 0.000) 2.487 14.055 ( -0.000 -2.211 0.000) 2.211 14.154 ( 0.000 0.831 -0.000) 0.831 14.334 ( -0.000 -1.493 0.000) 1.493 14.779 ( -0.000 -0.915 0.000) 0.915 15.308 ( -0.000 -2.123 0.000) 2.123 17.693 ( 0.000 0.188 -0.000) 0.188 17.835 ( 0.000 0.167 -0.000) 0.167 ======================= Grid point 23 (16/117) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.273 ( 13.236 -0.000 -1.710) 13.346 1.626 ( 0.811 -0.000 0.152) 0.825 1.626 ( 12.817 -0.000 -2.751) 13.109 1.809 ( -2.640 0.000 7.874) 8.305 1.879 ( 2.331 -0.000 5.610) 6.075 1.896 ( -3.692 0.000 -1.831) 4.121 2.108 ( 3.531 -0.000 -3.118) 4.711 2.283 ( 1.490 -0.000 0.266) 1.514 2.356 ( 6.795 -0.000 -2.090) 7.109 2.405 ( -10.809 0.000 -3.973) 11.516 2.560 ( 1.884 -0.000 -3.655) 4.112 2.640 ( -5.092 0.000 -0.763) 5.148 2.702 ( -2.735 0.000 0.543) 2.789 2.815 ( 3.180 -0.000 4.611) 5.602 2.824 ( -3.029 0.000 0.763) 3.124 2.932 ( -3.958 0.000 0.299) 3.970 3.147 ( -1.779 0.000 -0.064) 1.781 3.221 ( -2.139 0.000 3.268) 3.906 3.413 ( -7.544 0.000 4.250) 8.659 3.573 ( 3.863 -0.000 -5.519) 6.737 3.589 ( 2.058 -0.000 8.372) 8.622 3.642 ( -1.123 0.000 -3.897) 4.056 3.662 ( -1.965 0.000 -3.278) 3.821 3.885 ( -0.512 0.000 1.190) 1.296 3.960 ( -1.522 0.000 -5.926) 6.118 4.253 ( 6.983 -0.000 2.313) 7.356 4.340 ( -3.305 0.000 -0.060) 3.306 4.428 ( 4.346 -0.000 3.795) 5.770 4.527 ( 4.166 -0.000 -10.993) 11.756 4.578 ( 3.782 -0.000 5.058) 6.316 4.594 ( 2.021 -0.000 -2.687) 3.362 4.783 ( -6.002 0.000 6.962) 9.192 4.991 ( 0.471 -0.000 -6.218) 6.236 5.130 ( -0.168 0.000 0.955) 0.970 5.400 ( -4.018 0.000 0.317) 4.030 5.434 ( -1.201 0.000 -2.315) 2.608 5.696 ( 7.838 -0.000 2.175) 8.134 5.964 ( 11.035 -0.000 -1.276) 11.108 6.033 ( 6.719 -0.000 -3.269) 7.472 6.223 ( 2.849 -0.000 -0.370) 2.873 6.343 ( -5.078 0.000 1.243) 5.228 6.470 ( -2.464 0.000 -1.339) 2.805 6.917 ( 0.879 -0.000 -4.105) 4.198 6.974 ( 1.456 -0.000 13.581) 13.659 7.205 ( -0.986 0.000 -7.619) 7.683 7.279 ( 0.155 -0.000 6.956) 6.957 7.733 ( 4.763 -0.000 -2.781) 5.515 7.889 ( 3.684 -0.000 1.070) 3.836 7.981 ( -1.914 0.000 0.648) 2.021 8.137 ( 4.216 -0.000 6.027) 7.355 8.482 ( 7.867 -0.000 -6.248) 10.046 8.600 ( 3.419 -0.000 3.052) 4.583 8.932 ( -1.544 0.000 -2.089) 2.597 9.397 ( -8.365 0.000 5.630) 10.083 9.766 ( -4.038 0.000 -12.794) 13.416 10.029 ( 3.134 -0.000 0.841) 3.245 10.390 ( 4.996 -0.000 -3.728) 6.234 10.667 ( 4.014 -0.000 -5.845) 7.091 10.701 ( -4.584 0.000 8.322) 9.501 10.786 ( 0.158 -0.000 2.143) 2.149 12.587 ( -0.313 0.000 26.261) 26.263 12.611 ( 9.314 -0.000 -4.749) 10.454 12.657 ( 4.318 -0.000 -3.946) 5.850 13.067 ( -7.985 0.000 -9.260) 12.227 13.152 ( -5.413 0.000 1.901) 5.737 13.320 ( 2.684 -0.000 -2.214) 3.480 13.634 ( 2.411 -0.000 3.396) 4.165 13.675 ( -3.798 0.000 -5.628) 6.789 15.314 ( 3.763 -0.000 -6.093) 7.161 15.477 ( 1.598 -0.000 4.760) 5.021 17.724 ( -0.904 0.000 0.546) 1.056 17.795 ( -1.152 0.000 -0.665) 1.330 ======================= Grid point 24 (17/117) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( 3.756 -3.995 -0.671) 5.524 1.640 ( -0.851 0.894 -2.772) 3.034 1.694 ( 2.541 -4.502 1.280) 5.326 1.777 ( -2.907 0.156 0.204) 2.919 1.937 ( 7.131 2.026 0.684) 7.445 1.993 ( 6.408 -2.931 6.821) 9.807 2.180 ( 5.177 -1.310 -2.150) 5.756 2.225 ( -6.079 0.570 -3.866) 7.227 2.330 ( 1.396 0.061 -0.910) 1.668 2.428 ( 1.990 1.395 -4.738) 5.325 2.548 ( -4.252 2.105 0.437) 4.765 2.582 ( 2.411 3.491 0.879) 4.333 2.646 ( -3.697 -2.582 0.154) 4.512 2.797 ( -2.135 -2.752 0.405) 3.506 2.836 ( 1.280 3.027 2.530) 4.148 2.931 ( -0.311 -6.491 0.932) 6.565 3.106 ( -2.267 2.331 0.962) 3.390 3.164 ( -3.576 1.505 3.053) 4.937 3.299 ( -6.180 -1.683 2.641) 6.929 3.558 ( -2.444 3.930 0.252) 4.635 3.624 ( -0.858 1.275 3.518) 3.839 3.640 ( -0.765 -2.359 -5.954) 6.450 3.706 ( 8.824 2.186 -3.239) 9.650 3.913 ( 4.642 1.234 0.377) 4.818 3.957 ( 3.126 0.132 -3.145) 4.436 4.212 ( -7.445 7.664 2.042) 10.878 4.337 ( -2.088 -3.987 5.052) 6.766 4.401 ( 0.118 -0.312 -3.501) 3.517 4.578 ( 2.410 2.805 -4.723) 5.999 4.606 ( -2.775 -1.512 1.154) 3.364 4.725 ( 6.097 0.362 4.328) 7.485 4.755 ( 3.253 -3.071 1.895) 4.858 4.992 ( 0.132 -0.193 -4.519) 4.525 5.136 ( 0.088 -1.597 -0.719) 1.753 5.304 ( -4.244 3.727 -1.848) 5.943 5.406 ( -4.067 -4.493 0.106) 6.061 5.784 ( 2.148 1.336 0.755) 2.640 6.090 ( 0.857 0.232 -0.103) 0.894 6.100 ( 2.718 -0.140 -0.136) 2.725 6.254 ( 0.374 -0.607 -1.666) 1.812 6.277 ( -2.380 0.280 2.159) 3.226 6.422 ( -1.103 0.215 -1.496) 1.871 6.882 ( -3.660 0.079 -6.568) 7.519 6.977 ( -2.295 -0.557 6.421) 6.841 7.180 ( -1.397 -0.638 -1.114) 1.897 7.278 ( -1.061 0.533 4.084) 4.253 7.733 ( -4.650 -0.914 2.185) 5.218 7.920 ( 0.013 2.557 -2.046) 3.275 7.986 ( 0.646 -3.999 0.800) 4.130 8.194 ( 1.320 -0.219 4.751) 4.936 8.574 ( 4.077 2.575 -5.837) 7.571 8.647 ( 1.698 -1.773 2.161) 3.271 8.895 ( -2.020 1.656 -2.531) 3.637 9.251 ( -9.433 -1.158 3.727) 10.208 9.625 ( -9.377 1.258 -11.005) 14.512 10.057 ( 1.984 4.976 0.587) 5.389 10.404 ( -2.658 3.876 0.052) 4.700 10.483 ( -9.125 6.820 1.982) 11.563 10.725 ( 2.731 -3.542 6.541) 7.924 10.955 ( 1.347 -17.721 -0.986) 17.799 12.582 ( -0.207 4.713 12.765) 13.609 12.653 ( -3.896 2.655 -6.898) 8.355 12.755 ( 4.869 -3.371 -5.830) 8.310 13.000 ( 3.022 -2.979 -1.205) 4.411 13.118 ( 0.237 1.947 2.290) 3.015 13.315 ( -1.653 1.843 -0.602) 2.547 13.629 ( 3.095 4.784 -2.340) 6.160 13.723 ( 3.894 -3.386 2.595) 5.775 15.345 ( 0.263 -0.461 -5.878) 5.902 15.468 ( -3.371 -0.673 4.676) 5.803 17.721 ( 0.463 -0.109 -0.742) 0.882 17.780 ( -0.631 0.037 0.879) 1.083 ======================= Grid point 25 (18/117) ======================= q-point: (-0.60 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.476 ( -2.608 -2.510 2.826) 4.592 1.633 ( -0.011 -3.019 -3.194) 4.395 1.753 ( 1.361 1.424 0.971) 2.196 1.824 ( 5.265 -3.735 -2.963) 7.102 2.042 ( 0.515 0.802 4.645) 4.742 2.065 ( 4.776 -2.623 -2.328) 5.925 2.168 ( 0.552 1.075 -1.969) 2.310 2.284 ( 3.981 1.673 -1.884) 4.711 2.344 ( -4.584 3.439 -0.395) 5.744 2.363 ( 2.725 1.813 -0.142) 3.277 2.532 ( 3.211 2.821 -2.385) 4.895 2.574 ( 0.822 1.691 2.663) 3.260 2.653 ( -0.825 -7.543 0.271) 7.592 2.797 ( -1.900 -5.398 0.159) 5.725 2.872 ( 4.416 0.096 1.942) 4.825 2.978 ( -0.743 -3.573 0.226) 3.657 3.031 ( -3.197 2.276 1.080) 4.071 3.121 ( -0.457 -1.294 2.191) 2.585 3.238 ( -3.638 -2.924 1.185) 4.816 3.452 ( -5.035 6.369 -0.438) 8.131 3.589 ( -0.401 4.558 3.404) 5.703 3.619 ( -1.533 0.447 -2.790) 3.214 3.815 ( 6.430 2.843 -2.792) 7.564 3.957 ( -5.110 5.542 2.136) 7.835 4.010 ( 0.274 5.575 0.078) 5.582 4.080 ( 8.552 -2.126 -3.333) 9.421 4.294 ( -4.937 -4.018 0.149) 6.367 4.435 ( -2.799 0.098 -0.986) 2.969 4.466 ( -3.678 2.913 2.311) 5.230 4.645 ( 3.133 -0.694 -1.581) 3.578 4.808 ( 1.112 -1.307 3.097) 3.541 4.818 ( 2.648 0.353 0.996) 2.851 4.993 ( -0.910 -1.852 -1.845) 2.768 5.154 ( 0.004 -1.252 0.782) 1.476 5.207 ( -2.844 1.854 -4.973) 6.021 5.380 ( -4.454 -6.296 1.137) 7.796 5.739 ( -4.815 2.494 -1.618) 5.659 6.018 ( -10.269 1.004 -0.841) 10.352 6.063 ( -5.302 0.362 6.573) 8.453 6.235 ( -1.834 -0.467 -2.269) 2.954 6.281 ( 2.648 -0.686 0.109) 2.738 6.469 ( 4.917 0.067 1.155) 5.051 6.787 ( -6.704 -1.053 -10.535) 12.531 6.922 ( -5.736 -2.302 -1.617) 6.389 7.165 ( -1.897 -1.493 5.592) 6.090 7.231 ( -4.360 0.702 2.921) 5.294 7.624 ( -8.878 -1.891 2.443) 9.400 7.875 ( -3.725 -0.131 0.293) 3.739 8.008 ( -2.144 -2.376 1.170) 3.408 8.189 ( -2.378 -0.051 1.656) 2.898 8.568 ( 0.094 4.493 -2.663) 5.224 8.691 ( 0.327 -2.377 0.139) 2.403 8.805 ( -5.507 4.924 -1.417) 7.522 9.121 ( -9.442 -6.260 -1.679) 11.452 9.433 ( -10.647 -1.450 -6.185) 12.398 9.990 ( -2.508 9.263 -2.160) 9.836 10.186 ( -13.351 2.939 8.179) 15.931 10.412 ( -2.144 -3.779 0.444) 4.368 10.800 ( 0.680 -3.570 3.258) 4.881 11.124 ( 1.546 -16.070 1.893) 16.254 12.424 ( -10.087 4.251 -16.849) 20.093 12.609 ( -0.068 2.314 15.621) 15.792 12.862 ( 5.589 -1.740 -6.035) 8.408 13.082 ( -0.580 1.705 3.401) 3.848 13.138 ( 5.898 1.961 -1.494) 6.393 13.294 ( 2.971 -0.663 -1.531) 3.408 13.669 ( 6.512 5.112 -1.110) 8.353 13.831 ( 5.850 -0.561 4.930) 7.671 15.321 ( -2.939 -0.769 -5.006) 5.855 15.389 ( -7.526 -2.164 3.673) 8.649 17.738 ( 1.513 -0.016 -1.598) 2.200 17.773 ( -0.398 -0.167 1.860) 1.910 ======================= Grid point 26 (19/117) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.425 ( -5.423 0.392 1.290) 5.588 1.682 ( 2.431 -2.914 -0.467) 3.824 1.794 ( 4.900 3.450 -1.633) 6.211 1.829 ( -4.906 7.693 -4.071) 9.991 2.016 ( -0.730 0.458 2.323) 2.478 2.121 ( -0.375 -0.567 3.037) 3.112 2.212 ( 4.603 -5.516 -0.944) 7.246 2.302 ( 3.535 2.428 -1.632) 4.589 2.323 ( 2.240 -0.193 -3.437) 4.107 2.408 ( 3.418 4.254 2.369) 5.950 2.510 ( -0.086 0.100 0.400) 0.421 2.659 ( 5.779 -2.012 -2.831) 6.742 2.730 ( 1.838 -5.663 1.260) 6.085 2.826 ( -1.446 -5.942 1.876) 6.396 2.929 ( 0.194 -0.637 1.588) 1.722 2.971 ( -0.861 -0.535 -3.409) 3.556 3.016 ( 1.378 -3.495 3.303) 5.002 3.171 ( 3.082 -2.061 1.930) 4.180 3.224 ( -4.477 10.639 1.608) 11.654 3.243 ( -4.427 0.843 -1.857) 4.874 3.538 ( -0.840 5.362 2.059) 5.805 3.611 ( 1.402 -0.827 -0.031) 1.628 3.753 ( -6.850 3.664 -0.144) 7.770 3.891 ( 3.164 1.248 -1.343) 3.657 4.041 ( 3.274 4.700 0.583) 5.757 4.156 ( -5.781 1.010 -5.957) 8.362 4.261 ( 2.476 0.730 0.275) 2.596 4.337 ( -2.617 -4.797 2.280) 5.921 4.441 ( -2.403 0.520 3.502) 4.280 4.705 ( 1.810 1.600 0.007) 2.416 4.748 ( -2.427 2.691 -1.573) 3.951 4.915 ( 5.392 -2.828 0.673) 6.126 4.978 ( -2.235 -1.728 -0.125) 2.827 5.129 ( -3.300 -0.575 3.634) 4.943 5.195 ( -0.159 -3.173 -6.116) 6.892 5.360 ( -5.097 -6.169 1.602) 8.161 5.592 ( -8.468 3.296 -4.085) 9.963 5.793 ( -13.747 -0.188 -1.282) 13.808 5.925 ( -10.140 0.675 9.677) 14.033 6.207 ( -1.403 0.004 -2.861) 3.186 6.354 ( 3.921 -0.415 -0.923) 4.049 6.514 ( -2.446 -0.856 0.464) 2.633 6.666 ( -5.593 -0.808 -9.580) 11.122 6.818 ( -10.081 -5.429 -2.119) 11.645 7.120 ( -8.069 -0.679 1.630) 8.260 7.148 ( -3.268 -1.842 6.714) 7.691 7.490 ( -8.046 -1.739 -1.081) 8.302 7.789 ( -7.298 -1.395 4.526) 8.700 7.956 ( -5.918 -1.660 1.921) 6.439 8.124 ( -5.477 -0.842 -1.505) 5.742 8.502 ( -2.096 5.856 -2.663) 6.766 8.608 ( -8.660 6.577 -3.124) 11.315 8.705 ( -3.350 -2.800 4.574) 6.323 9.004 ( -10.853 -7.078 -7.187) 14.817 9.338 ( -3.507 -7.101 -0.510) 7.936 9.826 ( -6.290 7.220 -3.510) 10.199 9.980 ( -11.348 -2.512 7.304) 13.727 10.435 ( -0.676 -5.565 6.069) 8.262 10.806 ( -2.787 -2.222 -2.298) 4.241 11.304 ( 3.921 -13.417 5.139) 14.893 12.204 ( -9.920 1.432 -16.297) 19.132 12.602 ( 0.284 3.444 12.310) 12.786 12.925 ( 2.724 8.414 -5.551) 10.441 13.044 ( 0.148 -1.752 -2.906) 3.396 13.199 ( 1.910 -2.095 3.355) 4.392 13.443 ( 11.634 -0.805 -3.393) 12.145 13.759 ( 9.349 4.798 -0.393) 10.516 13.941 ( 7.032 1.914 6.826) 9.986 15.238 ( -8.500 -1.160 2.353) 8.896 15.277 ( -6.974 -3.368 -3.631) 8.554 17.760 ( 0.505 0.073 -0.070) 0.515 17.775 ( 0.730 -0.492 0.519) 1.022 ======================= Grid point 27 (20/117) ======================= q-point: (-0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.258 ( -9.857 8.098 -0.669) 12.774 1.541 ( -12.148 16.411 -0.354) 20.421 1.730 ( 0.439 -0.153 -1.198) 1.285 1.864 ( 6.580 4.751 -0.471) 8.129 2.046 ( 2.675 -3.580 -0.000) 4.469 2.190 ( 3.464 -2.823 1.863) 4.841 2.280 ( -1.320 1.688 2.445) 3.251 2.307 ( 2.621 0.065 -4.990) 5.637 2.383 ( 2.628 3.330 0.610) 4.286 2.444 ( 5.809 0.001 2.093) 6.174 2.566 ( 2.742 5.220 -2.558) 6.427 2.721 ( -3.998 4.940 -0.083) 6.356 2.760 ( 3.215 -3.035 -3.456) 5.611 2.853 ( -2.739 -4.838 2.174) 5.970 2.882 ( -0.012 5.713 4.018) 6.984 2.953 ( 0.538 -2.071 0.089) 2.141 3.052 ( -0.460 -4.842 1.600) 5.120 3.091 ( -0.124 -10.031 -2.723) 10.395 3.293 ( 4.688 -0.641 -0.290) 4.740 3.306 ( 7.112 -2.426 2.821) 8.026 3.480 ( -0.791 4.073 0.795) 4.224 3.616 ( -4.240 -0.446 1.357) 4.474 3.695 ( 1.425 -3.066 -2.634) 4.285 3.898 ( -0.930 2.469 0.066) 2.639 3.958 ( -7.809 3.985 -3.286) 9.363 4.051 ( 0.669 5.310 0.374) 5.365 4.287 ( -2.506 -4.162 3.032) 5.727 4.384 ( 1.528 3.326 1.635) 4.009 4.435 ( 4.377 -4.094 -1.737) 6.240 4.612 ( -3.351 4.188 1.616) 5.602 4.770 ( 0.693 -0.966 0.486) 1.284 4.958 ( -2.234 -2.067 -1.104) 3.238 5.024 ( 2.023 -1.208 1.079) 2.591 5.064 ( -4.321 -2.633 0.545) 5.090 5.224 ( 1.018 -4.036 -5.266) 6.713 5.282 ( -9.095 -3.194 1.797) 9.805 5.423 ( -7.526 1.083 -1.780) 7.809 5.581 ( -10.639 -0.636 -2.781) 11.015 5.766 ( -7.812 0.074 8.674) 11.674 6.186 ( -0.122 0.903 -3.362) 3.483 6.315 ( -12.409 -2.623 -4.653) 13.510 6.439 ( -3.663 -0.841 -0.282) 3.769 6.604 ( -3.459 -0.086 -1.136) 3.642 6.688 ( -8.696 -4.833 -1.686) 10.091 6.959 ( -12.234 -2.799 -2.691) 12.835 7.111 ( -4.087 -2.157 7.390) 8.716 7.398 ( -3.289 -1.166 -4.843) 5.969 7.679 ( -7.335 -2.549 6.451) 10.096 7.845 ( -9.412 -2.637 3.861) 10.510 8.015 ( -7.801 -1.280 -3.033) 8.468 8.388 ( -5.104 4.726 -8.391) 10.899 8.412 ( -5.501 7.147 1.587) 9.158 8.648 ( -6.806 -2.750 6.767) 9.984 8.909 ( -4.912 -5.980 -5.964) 9.770 9.402 ( 0.664 -10.506 -1.029) 10.577 9.683 ( -4.513 2.278 -4.052) 6.479 9.844 ( -9.315 -5.000 7.735) 13.100 10.489 ( 1.139 -3.291 9.503) 10.121 10.751 ( -4.863 -2.455 -7.251) 9.069 11.504 ( 6.223 -10.839 7.960) 14.818 12.040 ( -7.459 -2.122 -14.222) 16.199 12.582 ( 0.226 4.306 7.958) 9.051 12.820 ( -1.293 12.280 -5.986) 13.723 13.084 ( 1.069 0.086 -0.294) 1.112 13.277 ( 2.980 -6.293 -1.195) 7.064 13.662 ( 13.456 0.136 -0.630) 13.472 13.910 ( 12.453 3.013 -2.464) 13.047 14.052 ( 7.296 2.781 7.322) 10.704 15.071 ( -12.670 -2.738 3.772) 13.500 15.204 ( -4.134 -2.530 -4.123) 6.363 17.753 ( -1.512 -0.710 2.462) 2.975 17.803 ( 1.737 -0.062 -1.625) 2.380 ======================= Grid point 28 (21/117) ======================= q-point: (-0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.966 ( -10.999 15.067 -0.727) 18.668 1.176 ( -9.983 20.805 0.543) 23.083 1.699 ( -1.523 2.810 -1.936) 3.736 1.931 ( 5.099 4.431 -0.053) 6.755 2.076 ( -0.615 6.079 -0.844) 6.168 2.106 ( -7.220 27.330 2.873) 28.413 2.259 ( 0.391 5.848 -1.194) 5.982 2.326 ( 5.285 -4.268 -1.390) 6.934 2.391 ( 1.523 0.071 1.985) 2.503 2.428 ( 1.608 0.324 -2.149) 2.704 2.629 ( 8.348 -2.417 1.335) 8.793 2.764 ( 0.861 -6.929 -2.312) 7.356 2.804 ( -1.571 -2.219 -1.175) 2.962 2.818 ( -1.322 -1.902 2.138) 3.152 2.975 ( 2.984 -10.539 2.086) 11.150 3.006 ( 2.672 -3.019 0.239) 4.039 3.096 ( -0.662 -7.190 0.725) 7.257 3.214 ( 1.631 -12.884 -0.179) 12.988 3.349 ( 1.886 1.541 -0.728) 2.542 3.426 ( 2.231 0.337 1.740) 2.849 3.480 ( 5.857 2.124 -1.182) 6.341 3.564 ( -1.962 -1.463 2.747) 3.680 3.711 ( -3.609 -1.126 -2.303) 4.427 3.799 ( -5.029 3.273 6.336) 8.726 3.836 ( -3.413 2.666 -8.378) 9.431 4.026 ( 0.867 4.333 0.865) 4.502 4.264 ( -2.142 -3.127 1.326) 4.015 4.415 ( 4.428 0.925 0.458) 4.546 4.522 ( 1.430 3.382 -2.980) 4.729 4.618 ( 4.428 -4.779 1.417) 6.667 4.787 ( 0.795 -4.026 5.049) 6.506 4.908 ( -6.171 -0.561 2.451) 6.663 4.928 ( -4.831 0.047 -1.766) 5.144 5.089 ( -3.551 -3.828 -5.700) 7.730 5.183 ( -1.214 -0.718 1.133) 1.809 5.300 ( -3.972 -0.923 -0.101) 4.079 5.314 ( 2.576 -2.895 -0.405) 3.896 5.427 ( -7.133 0.587 -0.467) 7.173 5.709 ( -0.266 -2.084 3.347) 3.951 6.077 ( -15.223 -3.035 -2.465) 15.717 6.177 ( -0.115 1.423 -2.418) 2.808 6.307 ( -12.501 -1.554 -1.234) 12.657 6.551 ( -2.075 -0.084 -0.628) 2.170 6.622 ( -2.182 -0.255 -2.343) 3.212 6.757 ( -12.341 -2.036 -2.912) 12.843 7.064 ( -3.697 -1.536 5.074) 6.463 7.403 ( 2.933 -2.205 -5.916) 6.962 7.621 ( -3.433 -4.374 5.279) 7.667 7.695 ( -11.446 -4.212 5.770) 13.493 7.892 ( -6.297 -0.144 -3.269) 7.097 8.270 ( -2.670 2.808 -9.634) 10.384 8.289 ( -2.721 6.354 4.798) 8.414 8.559 ( -5.397 -0.500 5.181) 7.498 8.914 ( -0.737 -5.459 -2.911) 6.230 9.516 ( 1.616 -10.792 -4.208) 11.695 9.625 ( -2.127 -2.023 -1.245) 3.189 9.766 ( -5.917 -5.414 6.878) 10.565 10.523 ( 2.043 6.627 8.605) 11.052 10.706 ( -4.233 -10.105 -7.746) 13.417 11.723 ( 7.642 -9.077 12.590) 17.300 11.957 ( -5.009 -6.471 -14.124) 16.323 12.553 ( 0.015 4.001 3.751) 5.484 12.675 ( -1.705 13.394 -5.862) 14.720 13.064 ( -0.782 4.131 1.372) 4.423 13.389 ( 2.353 -7.772 -2.497) 8.495 13.887 ( 11.817 -0.157 3.124) 12.224 14.120 ( 11.449 -0.722 -6.151) 13.017 14.147 ( 6.666 2.257 4.328) 8.262 14.873 ( -12.983 -2.894 3.293) 13.703 15.191 ( 0.842 -2.626 -1.323) 3.059 17.727 ( -2.519 -0.648 2.635) 3.702 17.827 ( 1.165 0.002 -1.331) 1.769 ======================= Grid point 29 (22/117) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.690 ( 0.000 19.272 -0.000) 19.272 0.882 ( 0.000 23.785 -0.000) 23.785 1.658 ( 0.000 2.988 -0.000) 2.988 1.666 ( 0.000 43.974 -0.000) 43.974 1.976 ( 0.000 0.204 -0.000) 0.204 1.997 ( 0.000 9.413 -0.000) 9.413 2.238 ( 0.000 3.066 -0.000) 3.066 2.415 ( -0.000 -4.256 0.000) 4.256 2.438 ( -0.000 -6.375 0.000) 6.375 2.457 ( -0.000 -0.608 0.000) 0.608 2.726 ( 0.000 1.705 -0.000) 1.705 2.776 ( -0.000 -3.594 0.000) 3.594 2.827 ( -0.000 -1.500 0.000) 1.500 2.846 ( -0.000 -7.422 0.000) 7.422 3.053 ( -0.000 -2.802 0.000) 2.802 3.145 ( -0.000 -5.603 0.000) 5.603 3.147 ( -0.000 -15.104 0.000) 15.104 3.340 ( 0.000 1.695 -0.000) 1.695 3.345 ( -0.000 -11.823 0.000) 11.823 3.443 ( 0.000 1.496 -0.000) 1.496 3.526 ( 0.000 3.477 -0.000) 3.477 3.578 ( -0.000 -2.258 0.000) 2.258 3.613 ( 0.000 2.180 -0.000) 2.180 3.747 ( 0.000 0.663 -0.000) 0.663 3.772 ( 0.000 1.969 -0.000) 1.969 3.999 ( 0.000 3.142 -0.000) 3.142 4.283 ( -0.000 -2.806 0.000) 2.806 4.477 ( -0.000 -0.220 0.000) 0.220 4.505 ( 0.000 1.860 -0.000) 1.860 4.673 ( -0.000 -5.239 0.000) 5.239 4.836 ( 0.000 0.506 -0.000) 0.506 4.865 ( -0.000 -1.013 0.000) 1.013 4.977 ( -0.000 -8.424 0.000) 8.424 5.022 ( -0.000 -1.409 0.000) 1.409 5.217 ( 0.000 3.931 -0.000) 3.931 5.218 ( -0.000 -2.187 0.000) 2.187 5.309 ( 0.000 4.450 -0.000) 4.450 5.432 ( -0.000 -6.061 0.000) 6.061 5.780 ( -0.000 -5.383 0.000) 5.383 5.914 ( -0.000 -1.549 0.000) 1.549 6.117 ( 0.000 2.237 -0.000) 2.237 6.177 ( 0.000 2.643 -0.000) 2.643 6.530 ( 0.000 0.945 -0.000) 0.945 6.598 ( 0.000 1.101 -0.000) 1.101 6.631 ( 0.000 0.919 -0.000) 0.919 7.042 ( -0.000 -1.058 0.000) 1.058 7.494 ( -0.000 -3.291 0.000) 3.291 7.569 ( -0.000 -1.282 0.000) 1.282 7.667 ( -0.000 -8.833 0.000) 8.833 7.820 ( 0.000 1.621 -0.000) 1.621 8.213 ( 0.000 5.203 -0.000) 5.203 8.232 ( 0.000 1.132 -0.000) 1.132 8.499 ( 0.000 1.982 -0.000) 1.982 8.954 ( -0.000 -4.895 0.000) 4.895 9.626 ( -0.000 -3.693 0.000) 3.693 9.634 ( -0.000 -11.274 0.000) 11.274 9.760 ( -0.000 -4.605 0.000) 4.605 10.456 ( 0.000 11.011 -0.000) 11.011 10.775 ( -0.000 -12.123 0.000) 12.123 11.891 ( -0.000 -2.739 0.000) 2.739 11.981 ( -0.000 -15.666 0.000) 15.666 12.521 ( 0.000 15.508 -0.000) 15.508 12.527 ( 0.000 2.031 -0.000) 2.031 13.010 ( 0.000 5.238 -0.000) 5.238 13.472 ( -0.000 -6.393 0.000) 6.393 14.019 ( -0.000 -1.366 0.000) 1.366 14.166 ( 0.000 0.074 -0.000) 0.074 14.299 ( -0.000 -2.388 0.000) 2.388 14.751 ( -0.000 -2.205 0.000) 2.205 15.252 ( -0.000 -4.202 0.000) 4.202 17.698 ( 0.000 0.344 -0.000) 0.344 17.837 ( 0.000 0.052 -0.000) 0.052 ======================= Grid point 34 (23/117) ======================= q-point: ( 0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.448 ( -1.526 0.000 2.183) 2.663 1.604 ( -0.568 0.000 -3.512) 3.558 1.765 ( 1.584 -0.000 1.151) 1.958 1.779 ( 7.020 -0.000 0.262) 7.025 2.049 ( 4.563 -0.000 -4.239) 6.228 2.050 ( 0.274 -0.000 5.770) 5.776 2.177 ( 1.583 -0.000 -3.466) 3.810 2.293 ( 7.193 -0.000 -2.516) 7.620 2.347 ( 0.030 -0.000 0.739) 0.740 2.449 ( -2.987 0.000 -3.600) 4.678 2.514 ( 0.244 -0.000 1.632) 1.651 2.568 ( -0.276 0.000 -2.024) 2.043 2.628 ( 0.242 -0.000 2.263) 2.275 2.747 ( -2.317 0.000 1.360) 2.687 2.892 ( 2.970 -0.000 2.245) 3.723 2.904 ( 1.833 -0.000 -0.104) 1.836 3.082 ( -2.302 0.000 1.304) 2.646 3.113 ( -2.942 0.000 2.732) 4.015 3.184 ( -5.263 0.000 2.456) 5.808 3.513 ( -4.330 0.000 1.181) 4.488 3.621 ( 0.176 -0.000 -1.921) 1.930 3.628 ( -0.085 0.000 -1.373) 1.376 3.840 ( 4.636 -0.000 -2.479) 5.258 4.014 ( 5.661 -0.000 0.372) 5.673 4.046 ( 5.384 -0.000 0.347) 5.395 4.147 ( -4.450 0.000 -3.060) 5.400 4.193 ( -6.448 0.000 2.807) 7.032 4.439 ( -0.997 0.000 -2.210) 2.424 4.510 ( -5.893 0.000 2.644) 6.459 4.630 ( 3.055 -0.000 -2.958) 4.252 4.785 ( 3.936 -0.000 5.108) 6.449 4.826 ( 1.668 -0.000 1.022) 1.956 4.973 ( -1.747 0.000 -2.038) 2.684 5.133 ( 0.544 -0.000 -3.671) 3.711 5.265 ( -2.700 0.000 -2.996) 4.033 5.286 ( -6.305 0.000 2.307) 6.714 5.764 ( -4.753 0.000 -1.274) 4.920 6.027 ( -10.863 0.000 -1.114) 10.920 6.067 ( -4.787 0.000 6.588) 8.144 6.229 ( -1.510 0.000 -3.061) 3.413 6.274 ( 2.449 -0.000 0.864) 2.597 6.470 ( 4.988 -0.000 1.119) 5.112 6.779 ( -6.963 0.000 -10.781) 12.834 6.898 ( -7.085 0.000 -1.620) 7.267 7.151 ( -1.984 0.000 4.927) 5.312 7.239 ( -4.443 0.000 4.301) 6.183 7.608 ( -8.635 0.000 2.991) 9.138 7.879 ( -4.999 0.000 1.331) 5.173 7.974 ( -1.371 0.000 -1.738) 2.214 8.194 ( -1.963 0.000 4.249) 4.681 8.639 ( 1.961 -0.000 -8.113) 8.347 8.639 ( -0.890 0.000 4.975) 5.054 8.863 ( -2.653 0.000 -1.690) 3.146 9.050 ( -13.067 0.000 -1.445) 13.147 9.423 ( -11.988 0.000 -9.323) 15.186 10.107 ( 0.139 -0.000 3.039) 3.042 10.222 ( -17.910 0.000 11.233) 21.141 10.339 ( -7.806 0.000 -7.027) 10.503 10.853 ( 7.432 -0.000 6.382) 9.796 10.881 ( 0.893 -0.000 0.705) 1.138 12.475 ( -12.091 0.000 -20.063) 23.425 12.631 ( 0.625 -0.000 18.361) 18.372 12.831 ( 5.847 -0.000 -6.046) 8.411 13.079 ( 4.175 -0.000 8.079) 9.094 13.207 ( 9.076 -0.000 -5.843) 10.794 13.263 ( -4.156 0.000 -1.204) 4.327 13.726 ( 5.544 -0.000 -4.794) 7.329 13.816 ( 7.482 -0.000 8.508) 11.330 15.313 ( -2.818 0.000 -6.363) 6.960 15.369 ( -8.147 0.000 4.804) 9.458 17.738 ( 1.614 -0.000 -1.722) 2.360 17.772 ( -0.549 0.000 2.016) 2.089 ======================= Grid point 35 (24/117) ======================= q-point: (-0.60 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.424 ( -1.481 -0.248 0.575) 1.608 1.633 ( 3.166 -1.806 -0.934) 3.762 1.822 ( 4.221 0.268 0.743) 4.295 1.894 ( 4.792 0.298 -3.445) 5.909 2.037 ( -0.460 1.244 3.503) 3.746 2.101 ( 2.101 -1.143 -0.598) 2.465 2.210 ( -1.582 4.039 0.587) 4.378 2.309 ( -1.272 -1.725 -3.354) 3.980 2.329 ( -0.256 0.673 -1.873) 2.007 2.419 ( 3.196 -0.986 -1.848) 3.821 2.560 ( -1.307 3.372 1.165) 3.800 2.617 ( 6.850 -2.987 1.827) 7.693 2.658 ( 4.549 -0.963 -0.416) 4.668 2.722 ( -1.966 -3.577 1.776) 4.452 2.942 ( 0.908 -2.802 -1.442) 3.280 2.960 ( 2.100 -0.363 -0.685) 2.239 3.003 ( -2.774 5.342 -0.002) 6.019 3.121 ( 2.224 -3.386 4.196) 5.832 3.159 ( 0.182 -3.854 4.512) 5.937 3.420 ( -4.415 5.222 -1.896) 7.096 3.600 ( -1.971 1.719 -0.058) 2.616 3.627 ( 0.908 0.920 -0.392) 1.350 3.858 ( -3.775 1.706 -0.192) 4.147 3.951 ( -0.251 10.382 0.546) 10.399 4.095 ( 2.004 -0.271 -0.227) 2.035 4.146 ( -0.178 -1.661 -0.788) 1.847 4.217 ( 2.861 -4.772 -3.338) 6.489 4.325 ( -8.376 2.722 0.097) 8.807 4.434 ( -2.834 -1.160 2.515) 3.963 4.715 ( 5.250 0.005 -1.412) 5.436 4.797 ( -3.315 2.223 1.152) 4.154 4.866 ( 3.484 -1.964 -0.646) 4.051 4.937 ( -2.942 -2.168 2.687) 4.536 5.134 ( -1.519 -0.985 -2.322) 2.944 5.162 ( -4.115 1.720 -1.497) 4.705 5.254 ( -3.500 -5.114 0.185) 6.200 5.644 ( -7.620 1.980 -3.662) 8.683 5.783 ( -16.054 -0.665 -1.445) 16.132 5.935 ( -10.372 0.323 9.848) 14.306 6.205 ( -0.909 -0.092 -3.619) 3.733 6.351 ( 4.912 0.015 -0.640) 4.953 6.504 ( -4.642 -0.237 0.347) 4.661 6.662 ( -2.862 0.286 -9.679) 10.097 6.728 ( -13.429 -3.633 -2.158) 14.078 7.115 ( -3.890 -0.344 6.170) 7.302 7.133 ( -7.470 0.131 4.320) 8.631 7.474 ( -6.807 -0.375 -0.304) 6.824 7.770 ( -8.069 -0.569 3.377) 8.766 7.911 ( -6.911 -2.086 0.451) 7.233 8.135 ( -4.832 0.896 2.198) 5.383 8.594 ( -1.617 4.223 0.781) 4.589 8.659 ( -1.310 -2.296 -1.996) 3.312 8.735 ( -9.529 7.338 -3.992) 12.672 8.871 ( -9.442 -7.885 -5.745) 13.577 9.252 ( -7.050 -2.482 -3.228) 8.141 9.923 ( -15.340 0.152 8.726) 17.649 10.025 ( -5.692 10.680 -0.033) 12.102 10.259 ( -6.110 -12.621 -0.344) 14.027 10.848 ( 1.426 5.983 1.759) 6.397 11.064 ( 6.030 -11.957 5.566) 14.502 12.239 ( -11.368 1.657 -18.217) 21.537 12.658 ( 1.469 2.146 15.057) 15.280 12.933 ( 5.372 -2.485 -6.188) 8.563 13.119 ( 0.262 5.249 2.666) 5.894 13.187 ( -0.969 0.179 0.796) 1.267 13.408 ( 12.226 -2.278 -6.092) 13.849 13.819 ( 6.983 1.823 -2.617) 7.677 13.963 ( 8.260 0.608 9.149) 12.341 15.209 ( -11.337 -1.404 4.289) 12.202 15.243 ( -4.744 -0.718 -6.173) 7.819 17.761 ( -0.669 0.035 1.989) 2.099 17.769 ( 1.761 -0.201 -1.535) 2.345 ======================= Grid point 36 (25/117) ======================= q-point: (-0.50 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.377 ( -2.658 5.230 -0.660) 5.904 1.715 ( 3.253 -1.050 0.815) 3.514 1.809 ( -6.516 12.619 -4.103) 14.783 1.890 ( 2.619 -1.955 -0.948) 3.403 2.041 ( 2.658 4.996 3.322) 6.562 2.134 ( 3.303 -3.811 1.910) 5.393 2.217 ( 2.111 -6.063 0.697) 6.458 2.306 ( -0.133 -1.680 -1.320) 2.141 2.420 ( 5.970 -3.292 -5.649) 8.854 2.457 ( 0.182 -1.273 1.015) 1.638 2.499 ( -0.942 3.702 1.556) 4.125 2.705 ( 0.724 -4.199 0.046) 4.261 2.749 ( 2.566 -3.729 0.018) 4.527 2.823 ( 7.433 0.678 1.629) 7.640 2.910 ( -2.184 -0.429 0.911) 2.405 2.954 ( -0.522 -1.540 0.862) 1.840 2.985 ( -0.362 -1.137 -1.742) 2.112 3.168 ( -5.727 5.186 0.617) 7.751 3.259 ( 3.669 0.193 1.537) 3.982 3.290 ( 6.224 2.989 1.567) 7.080 3.545 ( -1.455 1.906 -0.011) 2.397 3.652 ( 2.332 0.084 0.288) 2.351 3.714 ( -3.272 9.878 -0.231) 10.408 3.930 ( -0.340 1.717 -0.120) 1.754 4.033 ( -6.919 3.648 -4.800) 9.177 4.131 ( 0.537 3.607 -0.660) 3.706 4.218 ( -4.800 -3.188 4.152) 7.102 4.310 ( 2.942 -7.803 -1.641) 8.499 4.434 ( 1.259 -0.197 1.623) 2.064 4.684 ( -4.628 3.833 1.477) 6.188 4.763 ( -1.359 0.605 -0.514) 1.574 4.888 ( -3.153 -5.490 -2.515) 6.812 4.982 ( 4.115 -2.101 0.619) 4.662 5.053 ( -6.099 0.475 4.766) 7.754 5.154 ( 0.199 -3.660 -5.186) 6.351 5.223 ( -4.541 -3.268 -0.523) 5.619 5.452 ( -11.379 2.273 -2.263) 11.823 5.557 ( -10.079 -2.006 -3.992) 11.025 5.767 ( -8.943 0.027 9.411) 12.983 6.194 ( 0.030 0.108 -3.892) 3.894 6.295 ( -13.271 0.581 -3.663) 13.779 6.411 ( -6.483 -3.072 -1.421) 7.314 6.530 ( -7.772 -4.949 1.404) 9.320 6.662 ( -0.165 0.540 -4.380) 4.416 6.957 ( -10.744 1.431 3.710) 11.456 7.078 ( -3.645 -1.542 5.749) 6.980 7.387 ( -3.070 -0.233 -4.800) 5.702 7.634 ( -8.901 -1.998 4.429) 10.141 7.786 ( -10.406 -3.497 3.400) 11.492 8.022 ( -6.922 1.298 0.176) 7.045 8.474 ( -7.443 5.133 -7.403) 11.685 8.540 ( -3.818 6.323 -1.665) 7.571 8.624 ( -4.145 -0.644 2.935) 5.120 8.805 ( -4.242 -5.541 -3.493) 7.803 9.231 ( -1.393 -8.090 -0.601) 8.232 9.723 ( -9.126 -1.380 3.973) 10.048 9.825 ( -7.217 6.659 0.608) 9.839 10.301 ( -3.950 -14.815 2.932) 15.610 10.810 ( 0.374 6.594 -0.160) 6.607 11.283 ( 6.115 -12.551 5.899) 15.156 12.037 ( -8.474 1.086 -14.476) 16.808 12.671 ( 1.869 4.832 11.122) 12.269 13.013 ( -3.134 5.175 -2.214) 6.442 13.045 ( 4.978 0.206 -6.111) 7.885 13.217 ( 1.690 -1.251 2.661) 3.392 13.645 ( 13.731 -1.802 -4.717) 14.630 13.935 ( 8.042 0.406 -1.809) 8.253 14.095 ( 6.904 1.883 9.144) 11.612 15.021 ( -12.875 -2.504 3.233) 13.508 15.164 ( -4.481 -1.735 -4.979) 6.919 17.745 ( -1.534 -0.292 2.484) 2.934 17.801 ( 1.801 -0.084 -1.887) 2.610 ======================= Grid point 37 (26/117) ======================= q-point: (-0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.221 ( -5.195 13.525 -0.888) 14.515 1.527 ( -7.072 18.768 0.056) 20.056 1.737 ( -0.327 1.453 -0.400) 1.542 1.982 ( 4.776 -0.713 -4.213) 6.408 2.057 ( 0.865 -0.517 4.054) 4.177 2.247 ( 3.407 -4.379 -0.188) 5.551 2.287 ( 3.553 -0.867 1.434) 3.929 2.346 ( 2.141 0.892 -2.725) 3.578 2.434 ( -0.324 4.115 0.493) 4.157 2.513 ( 0.071 -11.902 3.080) 12.294 2.565 ( 5.537 -3.681 -2.269) 7.025 2.746 ( -2.407 -0.468 -1.731) 3.001 2.768 ( -1.337 9.506 0.979) 9.649 2.809 ( 0.216 -1.402 0.762) 1.610 2.889 ( -3.176 3.107 1.042) 4.563 2.939 ( -4.443 -0.949 -0.462) 4.567 2.992 ( -1.284 -1.927 -1.474) 2.744 3.085 ( 9.090 -1.998 3.267) 9.864 3.341 ( 3.260 -2.206 -0.710) 3.999 3.429 ( 5.571 -0.715 1.577) 5.834 3.537 ( 2.343 4.424 -0.468) 5.028 3.594 ( -0.086 5.605 0.904) 5.678 3.688 ( -0.256 -1.022 -1.558) 1.880 3.861 ( -4.035 3.508 3.520) 6.402 3.892 ( -4.813 3.528 -5.564) 8.159 4.097 ( -0.948 3.099 -0.004) 3.240 4.198 ( -1.237 -3.833 2.173) 4.577 4.435 ( 2.380 -4.210 1.234) 4.991 4.484 ( 5.039 -3.232 -3.810) 7.096 4.599 ( -1.900 2.270 1.322) 3.242 4.704 ( -5.194 -3.837 3.426) 7.310 4.867 ( -4.118 -4.626 -3.740) 7.235 4.932 ( -6.711 0.959 4.611) 8.199 5.034 ( -1.641 -2.277 -4.663) 5.442 5.159 ( -1.999 -2.116 2.135) 3.610 5.239 ( 4.046 -2.764 -4.125) 6.405 5.292 ( -5.674 -1.905 1.269) 6.118 5.436 ( -5.256 0.109 -2.941) 6.024 5.679 ( -2.474 -1.422 4.605) 5.417 6.037 ( -14.986 -1.399 -0.147) 15.052 6.189 ( -1.623 -0.549 -2.837) 3.314 6.263 ( -9.273 -3.233 -1.425) 9.924 6.525 ( 0.024 -1.478 0.249) 1.499 6.637 ( -0.701 1.315 -3.992) 4.261 6.766 ( -9.171 2.020 3.454) 10.006 7.037 ( -3.103 -1.490 4.154) 5.395 7.374 ( 1.681 -1.189 -6.495) 6.813 7.534 ( -5.773 -4.161 3.104) 7.764 7.636 ( -10.450 -3.197 5.453) 12.213 7.903 ( -4.800 1.177 -1.255) 5.098 8.330 ( -3.467 3.902 -6.299) 8.181 8.418 ( -3.003 7.632 1.012) 8.264 8.567 ( -2.256 0.954 2.902) 3.798 8.813 ( -0.864 -5.728 -2.056) 6.147 9.312 ( 0.232 -11.385 -0.553) 11.401 9.635 ( -2.472 0.043 -2.998) 3.886 9.686 ( -5.726 -0.441 5.477) 7.936 10.387 ( -2.080 -16.115 3.030) 16.529 10.742 ( -0.201 8.862 -1.654) 9.017 11.501 ( 4.894 -13.917 5.789) 15.848 11.905 ( -4.981 -0.248 -9.740) 10.943 12.656 ( 1.271 6.985 6.013) 9.304 12.891 ( -1.780 9.849 -3.153) 10.494 13.112 ( 1.830 0.468 -1.495) 2.409 13.268 ( 1.628 -4.377 -0.496) 4.697 13.885 ( 12.447 -0.536 -0.929) 12.493 14.079 ( 6.568 -3.167 -4.368) 8.500 14.178 ( 3.811 1.256 7.382) 8.402 14.827 ( -11.728 -2.053 2.048) 12.081 15.130 ( -1.412 -3.715 -2.506) 4.698 17.721 ( -1.613 -0.155 1.832) 2.446 17.826 ( 1.078 -0.125 -1.229) 1.640 ======================= Grid point 38 (27/117) ======================= q-point: (-0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.018 ( 0.000 17.865 -0.000) 17.865 1.281 ( 0.000 21.500 -0.000) 21.500 1.711 ( 0.000 2.766 -0.000) 2.766 2.003 ( 0.000 3.385 -0.000) 3.385 2.080 ( -0.000 -1.342 0.000) 1.342 2.290 ( 0.000 12.038 -0.000) 12.038 2.329 ( 0.000 9.074 -0.000) 9.074 2.332 ( -0.000 -5.421 0.000) 5.421 2.398 ( 0.000 2.204 -0.000) 2.204 2.503 ( 0.000 16.490 -0.000) 16.490 2.649 ( -0.000 -15.533 0.000) 15.533 2.702 ( -0.000 -5.030 0.000) 5.030 2.756 ( 0.000 1.051 -0.000) 1.051 2.800 ( -0.000 -1.383 0.000) 1.383 2.897 ( -0.000 -6.928 0.000) 6.928 2.981 ( -0.000 -12.212 0.000) 12.212 3.009 ( -0.000 -3.851 0.000) 3.851 3.195 ( -0.000 -2.961 0.000) 2.961 3.373 ( 0.000 0.626 -0.000) 0.626 3.474 ( 0.000 1.661 -0.000) 1.661 3.531 ( -0.000 -0.603 0.000) 0.603 3.599 ( 0.000 3.160 -0.000) 3.160 3.653 ( 0.000 1.958 -0.000) 1.958 3.791 ( 0.000 3.506 -0.000) 3.506 3.813 ( 0.000 2.779 -0.000) 2.779 4.058 ( 0.000 3.050 -0.000) 3.050 4.227 ( -0.000 -3.232 0.000) 3.232 4.480 ( 0.000 2.136 -0.000) 2.136 4.555 ( -0.000 -8.409 0.000) 8.409 4.566 ( 0.000 3.680 -0.000) 3.680 4.755 ( -0.000 -11.079 0.000) 11.079 4.858 ( 0.000 1.864 -0.000) 1.864 4.860 ( -0.000 -4.932 0.000) 4.932 5.002 ( -0.000 -0.823 0.000) 0.823 5.175 ( -0.000 -2.320 0.000) 2.320 5.243 ( -0.000 -0.994 0.000) 0.994 5.338 ( -0.000 -4.451 0.000) 4.451 5.371 ( 0.000 2.428 -0.000) 2.428 5.702 ( -0.000 -3.543 0.000) 3.543 5.885 ( -0.000 -1.597 0.000) 1.597 6.137 ( -0.000 -0.449 0.000) 0.449 6.212 ( 0.000 1.448 -0.000) 1.448 6.532 ( -0.000 -0.440 0.000) 0.440 6.622 ( 0.000 1.415 -0.000) 1.415 6.656 ( 0.000 2.045 -0.000) 2.045 7.021 ( -0.000 -1.279 0.000) 1.279 7.435 ( -0.000 -3.209 0.000) 3.209 7.519 ( -0.000 -5.286 0.000) 5.286 7.548 ( -0.000 -2.990 0.000) 2.990 7.847 ( 0.000 1.521 -0.000) 1.521 8.269 ( 0.000 2.951 -0.000) 2.951 8.325 ( 0.000 7.265 -0.000) 7.265 8.535 ( 0.000 1.997 -0.000) 1.997 8.858 ( -0.000 -5.880 0.000) 5.880 9.422 ( -0.000 -12.497 0.000) 12.497 9.604 ( 0.000 1.493 -0.000) 1.493 9.668 ( -0.000 -5.552 0.000) 5.552 10.519 ( -0.000 -16.577 0.000) 16.577 10.649 ( 0.000 10.751 -0.000) 10.751 11.692 ( -0.000 -16.429 0.000) 16.429 11.855 ( -0.000 -0.864 0.000) 0.864 12.606 ( 0.000 6.795 -0.000) 6.795 12.777 ( 0.000 12.534 -0.000) 12.534 13.099 ( 0.000 4.203 -0.000) 4.203 13.340 ( -0.000 -7.598 0.000) 7.598 14.016 ( 0.000 1.032 -0.000) 1.032 14.140 ( -0.000 -3.376 0.000) 3.376 14.253 ( -0.000 -2.772 0.000) 2.772 14.715 ( -0.000 -1.366 0.000) 1.366 15.166 ( -0.000 -5.304 0.000) 5.304 17.704 ( 0.000 0.283 -0.000) 0.283 17.836 ( -0.000 -0.133 0.000) 0.133 ======================= Grid point 45 (28/117) ======================= q-point: (-0.60 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.427 ( 1.236 -0.000 -1.130) 1.675 1.702 ( 4.865 -0.000 1.022) 4.971 1.847 ( -0.830 0.000 -2.701) 2.825 1.977 ( 3.899 -0.000 -2.894) 4.855 2.063 ( -2.127 0.000 3.316) 3.940 2.138 ( 2.500 -0.000 0.948) 2.674 2.153 ( -2.232 0.000 1.418) 2.644 2.226 ( -1.774 0.000 3.498) 3.922 2.395 ( 6.024 -0.000 -6.346) 8.750 2.463 ( 1.799 -0.000 -4.436) 4.787 2.542 ( -2.266 0.000 2.120) 3.103 2.647 ( -2.875 0.000 2.923) 4.100 2.727 ( 3.846 -0.000 -1.379) 4.086 2.816 ( 12.455 -0.000 4.045) 13.095 2.917 ( -0.510 0.000 0.330) 0.608 2.924 ( -4.450 0.000 -2.414) 5.063 3.013 ( -1.159 0.000 -2.333) 2.605 3.135 ( 2.374 -0.000 3.880) 4.548 3.256 ( 8.777 -0.000 6.240) 10.770 3.377 ( -3.368 0.000 -5.086) 6.100 3.557 ( -2.247 0.000 1.306) 2.599 3.652 ( 1.838 -0.000 -1.294) 2.248 3.843 ( 0.116 -0.000 -0.012) 0.116 4.005 ( -3.642 0.000 -0.946) 3.763 4.023 ( -1.661 0.000 1.367) 2.151 4.183 ( -3.372 0.000 -2.155) 4.002 4.191 ( -6.966 0.000 0.696) 7.000 4.199 ( 2.955 -0.000 -1.014) 3.124 4.414 ( 0.394 -0.000 1.521) 1.571 4.726 ( -4.478 0.000 2.432) 5.096 4.797 ( -7.141 0.000 -0.593) 7.165 4.801 ( 1.742 -0.000 -3.670) 4.062 4.962 ( 4.138 -0.000 1.669) 4.462 5.082 ( -4.763 0.000 3.262) 5.774 5.095 ( -3.063 0.000 -0.120) 3.066 5.191 ( -0.637 0.000 -5.120) 5.160 5.486 ( -16.439 0.000 -0.631) 16.451 5.526 ( -6.469 0.000 -5.652) 8.590 5.767 ( -9.401 0.000 9.453) 13.331 6.194 ( -0.126 0.000 -4.209) 4.211 6.334 ( -10.957 0.000 -4.445) 11.824 6.340 ( -14.392 0.000 -0.421) 14.398 6.492 ( -2.198 0.000 0.999) 2.414 6.668 ( 0.524 -0.000 -4.200) 4.233 6.976 ( -10.365 0.000 5.550) 11.758 7.062 ( -3.474 0.000 5.355) 6.383 7.386 ( -3.133 0.000 -4.819) 5.748 7.616 ( -9.247 0.000 3.870) 10.024 7.751 ( -10.191 0.000 2.871) 10.587 8.036 ( -7.130 0.000 1.585) 7.305 8.536 ( -9.742 0.000 -3.491) 10.349 8.607 ( -2.897 0.000 -2.622) 3.907 8.610 ( -2.599 0.000 -7.056) 7.520 8.746 ( -2.951 0.000 2.402) 3.805 9.152 ( -2.865 0.000 -1.164) 3.093 9.698 ( -10.520 0.000 7.321) 12.817 9.987 ( -9.517 0.000 -3.341) 10.087 10.073 ( -2.703 0.000 2.863) 3.937 10.900 ( 0.923 -0.000 1.463) 1.730 11.139 ( 7.440 -0.000 5.491) 9.246 12.051 ( -8.861 0.000 -14.547) 17.034 12.719 ( 2.550 -0.000 12.263) 12.526 12.986 ( 2.320 -0.000 -3.871) 4.513 13.130 ( -1.946 0.000 -4.854) 5.230 13.198 ( 2.790 -0.000 3.973) 4.855 13.623 ( 14.173 -0.000 -7.016) 15.815 13.937 ( 6.349 -0.000 -1.372) 6.496 14.112 ( 6.741 -0.000 9.929) 12.001 14.997 ( -12.549 0.000 3.269) 12.968 15.148 ( -4.943 0.000 -5.523) 7.412 17.742 ( -1.512 0.000 2.505) 2.925 17.800 ( 1.805 -0.000 -1.958) 2.663 ======================= Grid point 47 (29/117) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.416 ( 0.059 7.360 -1.124) 7.446 1.730 ( -1.890 -0.614 0.721) 2.114 1.825 ( -3.096 10.707 -3.345) 11.637 1.921 ( 3.976 0.921 -0.030) 4.082 2.108 ( 0.914 -10.860 0.004) 10.898 2.137 ( 0.809 5.950 3.188) 6.799 2.216 ( 2.994 -4.118 0.729) 5.144 2.276 ( 0.750 -8.144 2.308) 8.498 2.436 ( 1.006 4.422 -3.356) 5.642 2.499 ( -0.897 2.273 0.890) 2.601 2.524 ( 4.517 -3.522 -2.997) 6.464 2.626 ( -2.331 -4.733 1.533) 5.494 2.781 ( 2.209 -0.636 0.515) 2.356 2.847 ( -2.706 1.333 -1.394) 3.323 2.879 ( -1.585 -1.227 0.067) 2.005 2.969 ( -2.076 1.210 -1.202) 2.686 3.046 ( 4.838 -0.096 5.125) 7.048 3.144 ( 1.827 3.420 -0.079) 3.878 3.328 ( 2.185 2.304 -2.220) 3.874 3.409 ( 6.538 -1.449 0.873) 6.753 3.579 ( 3.453 0.663 1.827) 3.962 3.681 ( 1.216 0.151 -0.893) 1.516 3.788 ( -0.850 12.376 0.293) 12.409 3.922 ( -2.468 3.445 -0.057) 4.238 3.949 ( -5.496 2.483 -2.499) 6.528 4.108 ( -3.846 -1.138 0.067) 4.012 4.152 ( -0.246 -3.005 1.728) 3.475 4.271 ( 1.065 -7.971 -1.265) 8.141 4.449 ( 2.654 -3.105 0.822) 4.166 4.644 ( -3.570 2.662 0.990) 4.562 4.675 ( -6.230 -0.593 1.962) 6.559 4.778 ( -5.535 -3.765 -4.156) 7.879 4.968 ( -4.166 2.307 0.538) 4.793 5.014 ( -0.897 0.789 -0.403) 1.261 5.096 ( 0.540 -4.692 2.685) 5.433 5.221 ( 3.283 0.183 -5.190) 6.144 5.258 ( -8.704 -1.421 1.191) 8.899 5.433 ( -3.813 -0.190 -3.935) 5.482 5.660 ( -3.723 -0.565 5.208) 6.427 6.027 ( -16.467 0.126 2.061) 16.596 6.149 ( -6.505 -2.597 -2.943) 7.597 6.231 ( -0.650 -0.458 -2.631) 2.748 6.511 ( 1.043 -0.301 -0.579) 1.231 6.654 ( -0.907 0.469 -3.841) 3.974 6.804 ( -8.744 1.593 5.708) 10.563 7.015 ( -2.826 -0.834 3.708) 4.736 7.359 ( 0.711 -0.427 -6.563) 6.615 7.487 ( -6.088 -1.213 2.344) 6.636 7.591 ( -9.091 -1.510 4.837) 10.407 7.921 ( -4.997 0.674 0.026) 5.043 8.393 ( -4.313 2.542 -5.229) 7.239 8.532 ( -2.829 4.310 -2.089) 5.563 8.581 ( -1.059 0.362 1.732) 2.062 8.730 ( -0.885 -3.002 0.311) 3.145 9.150 ( -0.531 -5.721 -0.389) 5.759 9.586 ( -4.511 -2.199 3.428) 6.078 9.797 ( -4.771 9.088 -1.045) 10.317 10.107 ( -2.756 -13.797 1.234) 14.124 10.889 ( 1.069 6.373 0.910) 6.526 11.290 ( 4.488 -8.367 3.410) 10.088 11.917 ( -4.798 0.816 -8.303) 9.624 12.760 ( 2.482 3.681 7.823) 8.995 12.979 ( -2.500 0.459 -2.259) 3.400 13.116 ( 2.119 1.450 -4.423) 5.115 13.242 ( 1.518 -0.100 1.722) 2.298 13.863 ( 13.327 -1.356 -6.295) 14.802 14.036 ( 4.404 -1.199 -0.897) 4.652 14.192 ( 1.309 0.395 9.222) 9.323 14.805 ( -9.629 -0.519 1.419) 9.747 15.078 ( -3.044 -1.760 -3.291) 4.816 17.719 ( -1.279 -0.042 1.605) 2.053 17.824 ( 1.027 -0.071 -1.185) 1.570 ======================= Grid point 48 (30/117) ======================= q-point: (-0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( 0.000 14.274 -0.000) 14.274 1.628 ( 0.000 16.990 -0.000) 16.990 1.740 ( 0.000 0.413 -0.000) 0.413 2.003 ( -0.000 -4.682 0.000) 4.682 2.087 ( 0.000 5.831 -0.000) 5.831 2.217 ( -0.000 -8.758 0.000) 8.758 2.302 ( -0.000 -5.387 0.000) 5.387 2.355 ( -0.000 -13.676 0.000) 13.676 2.407 ( 0.000 5.481 -0.000) 5.481 2.463 ( 0.000 2.840 -0.000) 2.840 2.624 ( -0.000 -3.289 0.000) 3.289 2.649 ( -0.000 -8.436 0.000) 8.436 2.795 ( 0.000 1.721 -0.000) 1.721 2.830 ( -0.000 -0.867 0.000) 0.867 2.859 ( 0.000 0.094 -0.000) 0.094 2.951 ( 0.000 12.351 -0.000) 12.351 2.955 ( -0.000 -1.804 0.000) 1.804 3.205 ( 0.000 3.198 -0.000) 3.198 3.357 ( -0.000 -1.951 0.000) 1.951 3.495 ( 0.000 0.794 -0.000) 0.794 3.564 ( 0.000 3.316 -0.000) 3.316 3.681 ( 0.000 1.303 -0.000) 1.303 3.685 ( 0.000 9.148 -0.000) 9.148 3.863 ( 0.000 2.405 -0.000) 2.405 3.863 ( 0.000 4.916 -0.000) 4.916 4.084 ( -0.000 -0.596 0.000) 0.596 4.182 ( -0.000 -2.007 0.000) 2.007 4.370 ( -0.000 -12.072 0.000) 12.072 4.542 ( 0.000 3.925 -0.000) 3.925 4.570 ( -0.000 -8.757 0.000) 8.757 4.622 ( 0.000 2.540 -0.000) 2.540 4.752 ( -0.000 -6.632 0.000) 6.632 4.901 ( 0.000 3.004 -0.000) 3.004 4.993 ( -0.000 -0.192 0.000) 0.192 5.145 ( -0.000 -1.160 0.000) 1.160 5.190 ( -0.000 -4.527 0.000) 4.527 5.282 ( -0.000 -1.799 0.000) 1.799 5.395 ( 0.000 0.576 -0.000) 0.576 5.654 ( -0.000 -1.912 0.000) 1.912 5.863 ( -0.000 -0.788 0.000) 0.788 6.104 ( -0.000 -2.644 0.000) 2.644 6.230 ( 0.000 0.672 -0.000) 0.672 6.522 ( -0.000 -0.533 0.000) 0.533 6.641 ( 0.000 0.718 -0.000) 0.718 6.700 ( 0.000 2.556 -0.000) 2.556 6.998 ( -0.000 -1.166 0.000) 1.166 7.389 ( -0.000 -1.865 0.000) 1.865 7.448 ( -0.000 -2.419 0.000) 2.419 7.510 ( -0.000 -1.619 0.000) 1.619 7.871 ( 0.000 1.020 -0.000) 1.020 8.328 ( 0.000 3.400 -0.000) 3.400 8.454 ( 0.000 6.765 -0.000) 6.765 8.565 ( 0.000 1.314 -0.000) 1.314 8.759 ( -0.000 -4.895 0.000) 4.895 9.217 ( -0.000 -9.851 0.000) 9.851 9.579 ( -0.000 -4.103 0.000) 4.103 9.683 ( 0.000 7.293 -0.000) 7.293 10.218 ( -0.000 -16.718 0.000) 16.718 10.828 ( 0.000 9.305 -0.000) 9.305 11.428 ( -0.000 -12.833 0.000) 12.833 11.861 ( 0.000 1.139 -0.000) 1.139 12.739 ( 0.000 7.104 -0.000) 7.104 12.930 ( 0.000 4.224 -0.000) 4.224 13.133 ( -0.000 -0.014 0.000) 0.014 13.258 ( -0.000 -1.014 0.000) 1.014 14.047 ( 0.000 2.061 -0.000) 2.061 14.057 ( -0.000 -5.186 0.000) 5.186 14.206 ( -0.000 -2.482 0.000) 2.482 14.710 ( 0.000 0.587 -0.000) 0.587 15.079 ( -0.000 -4.171 0.000) 4.171 17.707 ( 0.000 0.110 -0.000) 0.110 17.833 ( -0.000 -0.147 0.000) 0.147 ======================= Grid point 58 (31/117) ======================= q-point: ( 0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( -0.000 -0.000 0.000) 0.000 1.693 ( 0.000 0.000 -0.000) 0.000 1.853 ( -0.000 -0.000 0.000) 0.000 2.013 ( -0.000 -0.000 0.000) 0.000 2.025 ( 0.000 0.000 -0.000) 0.000 2.186 ( -0.000 -0.000 0.000) 0.000 2.204 ( 0.000 0.000 -0.000) 0.000 2.229 ( 0.000 0.000 -0.000) 0.000 2.488 ( -0.000 -0.000 0.000) 0.000 2.495 ( 0.000 0.000 -0.000) 0.000 2.535 ( 0.000 0.000 -0.000) 0.000 2.595 ( 0.000 0.000 -0.000) 0.000 2.801 ( 0.000 0.000 -0.000) 0.000 2.831 ( -0.000 -0.000 0.000) 0.000 2.859 ( 0.000 0.000 -0.000) 0.000 2.944 ( 0.000 0.000 -0.000) 0.000 3.041 ( 0.000 0.000 -0.000) 0.000 3.246 ( 0.000 0.000 -0.000) 0.000 3.334 ( 0.000 0.000 -0.000) 0.000 3.502 ( 0.000 0.000 -0.000) 0.000 3.591 ( 0.000 0.000 -0.000) 0.000 3.694 ( 0.000 0.000 -0.000) 0.000 3.867 ( 0.000 0.000 -0.000) 0.000 3.885 ( 0.000 0.000 -0.000) 0.000 3.932 ( 0.000 0.000 -0.000) 0.000 4.065 ( -0.000 -0.000 0.000) 0.000 4.109 ( 0.000 0.000 -0.000) 0.000 4.244 ( 0.000 0.000 -0.000) 0.000 4.479 ( 0.000 0.000 -0.000) 0.000 4.582 ( 0.000 0.000 -0.000) 0.000 4.646 ( 0.000 0.000 -0.000) 0.000 4.683 ( 0.000 0.000 -0.000) 0.000 4.942 ( 0.000 0.000 -0.000) 0.000 4.993 ( -0.000 -0.000 0.000) 0.000 5.131 ( 0.000 0.000 -0.000) 0.000 5.134 ( 0.000 0.000 -0.000) 0.000 5.268 ( 0.000 0.000 -0.000) 0.000 5.399 ( 0.000 0.000 -0.000) 0.000 5.637 ( 0.000 0.000 -0.000) 0.000 5.857 ( 0.000 0.000 -0.000) 0.000 6.075 ( 0.000 0.000 -0.000) 0.000 6.236 ( 0.000 0.000 -0.000) 0.000 6.517 ( 0.000 0.000 -0.000) 0.000 6.648 ( 0.000 0.000 -0.000) 0.000 6.726 ( 0.000 0.000 -0.000) 0.000 6.986 ( 0.000 0.000 -0.000) 0.000 7.373 ( 0.000 0.000 -0.000) 0.000 7.429 ( 0.000 0.000 -0.000) 0.000 7.495 ( 0.000 0.000 -0.000) 0.000 7.880 ( 0.000 0.000 -0.000) 0.000 8.365 ( 0.000 0.000 -0.000) 0.000 8.524 ( 0.000 0.000 -0.000) 0.000 8.577 ( 0.000 0.000 -0.000) 0.000 8.710 ( 0.000 0.000 -0.000) 0.000 9.119 ( 0.000 0.000 -0.000) 0.000 9.540 ( 0.000 0.000 -0.000) 0.000 9.802 ( -0.000 -0.000 0.000) 0.000 10.013 ( 0.000 0.000 -0.000) 0.000 10.931 ( 0.000 0.000 -0.000) 0.000 11.293 ( 0.000 0.000 -0.000) 0.000 11.875 ( 0.000 0.000 -0.000) 0.000 12.810 ( 0.000 0.000 -0.000) 0.000 12.951 ( 0.000 0.000 -0.000) 0.000 13.136 ( 0.000 0.000 -0.000) 0.000 13.259 ( 0.000 0.000 -0.000) 0.000 14.002 ( 0.000 0.000 -0.000) 0.000 14.070 ( 0.000 0.000 -0.000) 0.000 14.179 ( 0.000 0.000 -0.000) 0.000 14.719 ( 0.000 0.000 -0.000) 0.000 15.038 ( 0.000 0.000 -0.000) 0.000 17.708 ( 0.000 0.000 -0.000) 0.000 17.832 ( 0.000 0.000 -0.000) 0.000 ======================= Grid point 105 (32/117) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.515 ( -2.132 0.000 25.810) 25.898 0.531 ( -4.599 0.000 25.740) 26.147 1.016 ( -0.657 0.000 50.082) 50.087 1.400 ( 4.119 -0.000 -16.324) 16.836 1.489 ( 1.606 -0.000 -20.713) 20.775 2.114 ( -1.624 0.000 8.711) 8.861 2.352 ( -2.490 0.000 6.716) 7.163 2.444 ( 0.938 -0.000 -0.258) 0.973 2.609 ( 0.525 -0.000 3.401) 3.441 2.630 ( 0.052 -0.000 -2.126) 2.127 2.722 ( 1.371 -0.000 2.210) 2.600 2.781 ( -3.999 0.000 -1.148) 4.161 2.794 ( 0.114 -0.000 -20.537) 20.538 2.889 ( 2.083 -0.000 -13.727) 13.884 2.960 ( 2.099 -0.000 -0.306) 2.121 3.046 ( 1.959 -0.000 -6.312) 6.609 3.231 ( -9.965 0.000 -1.017) 10.017 3.253 ( 1.606 -0.000 -2.359) 2.854 3.376 ( 5.100 -0.000 -4.733) 6.958 3.379 ( 4.943 -0.000 -1.147) 5.075 3.609 ( -7.634 0.000 1.585) 7.797 3.616 ( 4.754 -0.000 -3.480) 5.892 3.649 ( 0.402 -0.000 4.853) 4.869 3.833 ( 0.412 -0.000 -0.857) 0.951 3.974 ( 1.310 -0.000 9.529) 9.619 4.017 ( -2.616 0.000 3.973) 4.757 4.216 ( -0.719 0.000 1.739) 1.882 4.294 ( 1.000 -0.000 -2.767) 2.942 4.673 ( -5.516 0.000 10.394) 11.767 4.763 ( -8.988 0.000 -0.477) 9.001 4.768 ( 4.947 -0.000 0.126) 4.948 4.903 ( -4.565 0.000 3.331) 5.651 4.965 ( -1.443 0.000 -0.977) 1.742 5.008 ( -5.925 0.000 1.938) 6.234 5.067 ( 9.240 -0.000 -4.889) 10.454 5.173 ( -1.371 0.000 -2.038) 2.456 5.305 ( -2.977 0.000 3.808) 4.834 5.462 ( 5.361 -0.000 -3.130) 6.208 5.944 ( 3.200 -0.000 0.755) 3.288 5.982 ( -4.703 0.000 3.969) 6.154 6.038 ( 3.970 -0.000 -2.728) 4.817 6.152 ( 6.658 -0.000 -2.375) 7.069 6.455 ( 6.931 -0.000 -1.923) 7.193 6.467 ( -0.823 0.000 -1.822) 1.999 6.921 ( 25.230 -0.000 3.662) 25.494 7.048 ( -4.418 0.000 -1.517) 4.671 7.569 ( 1.902 -0.000 3.494) 3.978 7.745 ( 0.759 -0.000 -3.175) 3.264 7.785 ( -1.505 0.000 1.772) 2.325 7.970 ( -1.565 0.000 8.955) 9.091 7.979 ( -1.790 0.000 -7.522) 7.732 8.220 ( 1.281 -0.000 1.211) 1.763 9.079 ( -0.539 0.000 3.583) 3.623 9.472 ( 3.575 -0.000 -16.436) 16.820 9.944 ( -0.575 0.000 0.968) 1.126 9.954 ( -1.009 0.000 2.516) 2.710 10.202 ( -6.978 0.000 2.819) 7.526 10.297 ( 1.713 -0.000 -2.422) 2.967 10.566 ( -26.808 0.000 9.732) 28.520 10.927 ( 4.195 -0.000 -4.947) 6.486 12.225 ( -1.247 0.000 3.377) 3.600 12.424 ( 11.065 -0.000 -6.015) 12.594 12.726 ( 8.740 -0.000 9.360) 12.806 13.171 ( 3.386 -0.000 -11.657) 12.139 13.705 ( -1.448 0.000 9.104) 9.218 13.980 ( 21.622 -0.000 -3.652) 21.929 14.085 ( -10.852 0.000 0.759) 10.879 14.133 ( 19.384 -0.000 -1.207) 19.421 14.952 ( 6.153 -0.000 1.188) 6.266 15.006 ( -30.673 0.000 -0.933) 30.687 17.828 ( -17.074 0.000 0.056) 17.074 17.832 ( 2.948 -0.000 -0.082) 2.949 ======================= Grid point 106 (33/117) ======================= q-point: ( 0.10 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.606 ( 11.488 -6.344 15.929) 20.639 0.672 ( 9.242 -12.385 18.794) 24.331 1.347 ( 20.297 -11.294 39.301) 45.652 1.459 ( 3.073 -1.139 -16.483) 16.806 1.551 ( 5.516 -5.100 -19.001) 20.432 2.060 ( -4.066 -0.316 9.306) 10.160 2.283 ( -5.838 0.798 1.163) 6.006 2.435 ( -0.669 2.000 4.186) 4.687 2.546 ( -6.305 1.084 4.142) 7.622 2.606 ( 0.644 4.952 -1.648) 5.259 2.680 ( -7.055 1.610 -1.275) 7.348 2.761 ( 0.119 -1.805 0.304) 1.835 2.815 ( 0.499 0.249 -6.320) 6.345 2.929 ( -2.928 -0.842 -0.006) 3.047 2.946 ( 5.374 -2.597 -19.390) 20.288 3.078 ( 1.870 -0.987 -7.989) 8.264 3.123 ( -2.256 0.198 -5.139) 5.616 3.259 ( 2.015 -0.059 -4.236) 4.691 3.386 ( -9.478 1.247 1.709) 9.711 3.484 ( 4.232 4.960 -8.633) 10.818 3.547 ( 5.520 -0.367 -4.996) 7.454 3.648 ( 0.478 4.516 0.788) 4.609 3.654 ( 0.284 3.385 0.272) 3.408 3.854 ( 3.615 1.884 -1.125) 4.229 3.938 ( -4.951 1.254 3.341) 6.103 4.009 ( 0.147 -0.546 7.530) 7.551 4.251 ( 0.059 -6.772 -1.334) 6.903 4.314 ( 0.694 0.073 -2.103) 2.216 4.508 ( -9.340 -0.518 5.840) 11.028 4.559 ( -7.751 -1.572 7.123) 10.643 4.868 ( -0.286 2.667 2.964) 3.998 4.927 ( 2.774 0.209 4.171) 5.014 4.973 ( 5.537 1.064 1.942) 5.964 5.051 ( 5.758 -5.629 -1.034) 8.119 5.211 ( 2.685 0.323 -3.884) 4.733 5.219 ( 5.757 -1.867 -2.710) 6.631 5.301 ( 6.047 1.718 0.782) 6.335 5.514 ( 2.177 1.900 0.994) 3.056 5.810 ( -4.836 1.235 2.894) 5.769 6.107 ( 3.063 -1.606 -0.104) 3.460 6.217 ( 17.307 0.661 0.246) 17.321 6.298 ( 10.850 0.487 -10.155) 14.869 6.484 ( 2.888 -0.627 -4.006) 4.978 6.521 ( 2.254 -0.833 0.865) 2.554 7.001 ( 0.205 1.072 -4.210) 4.349 7.395 ( 19.356 3.345 -15.230) 24.856 7.585 ( -1.080 0.428 3.716) 3.894 7.716 ( 2.255 9.701 4.305) 10.850 7.803 ( 6.044 -0.076 -2.197) 6.432 7.968 ( 2.127 0.978 -4.757) 5.302 8.032 ( 4.819 -1.628 3.415) 6.126 8.288 ( 6.386 0.496 0.121) 6.407 9.023 ( -2.449 8.825 4.024) 10.004 9.417 ( -1.740 12.363 -4.119) 13.147 9.809 ( 7.371 25.273 8.505) 27.666 9.905 ( 0.350 7.467 0.188) 7.478 9.999 ( -0.113 9.940 15.694) 18.577 10.197 ( 0.033 -2.919 1.637) 3.347 10.759 ( -6.623 -41.445 -7.537) 42.642 11.008 ( 2.687 -6.288 -1.481) 6.997 12.227 ( 1.753 1.304 1.745) 2.796 12.501 ( 2.257 1.932 -4.722) 5.579 12.858 ( 6.677 0.050 -1.387) 6.820 13.131 ( 0.128 12.327 -4.700) 13.193 13.665 ( -2.279 1.754 9.901) 10.310 13.786 ( -19.423 1.436 -5.597) 20.264 13.958 ( -10.130 -2.957 -5.443) 11.874 14.164 ( -33.009 -6.786 18.508) 38.447 14.748 ( 12.915 -5.184 -0.141) 13.918 15.136 ( 10.764 -1.812 2.928) 11.301 17.697 ( 0.612 -0.135 -0.114) 0.637 17.861 ( 0.214 0.249 2.231) 2.255 ======================= Grid point 107 (34/117) ======================= q-point: ( 0.20 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.953 ( 16.714 -7.767 5.697) 19.290 1.025 ( 15.003 -15.158 7.690) 22.671 1.459 ( -0.664 -1.266 -15.361) 15.428 1.711 ( 7.644 -9.010 -16.534) 20.322 1.870 ( 19.435 -12.361 28.682) 36.786 2.045 ( 0.910 -1.828 10.078) 10.283 2.153 ( -8.086 -0.191 -1.415) 8.211 2.368 ( -5.976 3.097 3.636) 7.650 2.440 ( -5.497 -0.064 5.718) 7.932 2.498 ( -6.886 5.165 -3.078) 9.142 2.569 ( -0.339 4.641 -0.678) 4.703 2.758 ( -1.584 0.911 -0.792) 1.991 2.790 ( -1.980 -1.412 0.369) 2.459 2.862 ( -4.438 2.497 0.508) 5.118 2.999 ( 1.423 2.760 -4.407) 5.392 3.081 ( -8.767 -0.626 -3.567) 9.485 3.122 ( 1.206 -5.297 -7.996) 9.667 3.233 ( -1.584 2.235 2.526) 3.726 3.375 ( 11.595 -1.554 -18.056) 21.515 3.442 ( -1.746 5.095 -5.691) 7.835 3.565 ( 0.416 6.041 -3.099) 6.802 3.588 ( -0.254 7.715 5.078) 9.240 3.688 ( 5.254 -1.286 -6.798) 8.688 3.817 ( -5.723 -0.265 2.393) 6.209 3.897 ( 0.359 2.031 -0.634) 2.157 3.995 ( -2.202 0.838 4.304) 4.907 4.308 ( 0.877 -3.409 -2.932) 4.581 4.314 ( 1.541 0.334 -2.239) 2.739 4.386 ( -6.061 0.037 5.668) 8.298 4.555 ( 2.739 -2.430 4.260) 5.618 4.816 ( -2.887 1.622 2.286) 4.024 4.963 ( -1.079 -3.405 3.255) 4.832 5.037 ( 0.280 1.961 0.817) 2.143 5.158 ( 2.669 -2.118 2.285) 4.103 5.257 ( 5.349 -0.383 -3.131) 6.210 5.378 ( 9.799 -2.345 -0.105) 10.077 5.442 ( 11.237 2.316 -3.396) 11.965 5.521 ( 1.214 2.706 2.639) 3.970 5.800 ( 4.147 0.544 5.085) 6.584 6.168 ( 2.245 -1.701 1.409) 3.150 6.388 ( 4.021 1.330 -3.173) 5.292 6.494 ( 6.106 -2.662 -7.802) 10.259 6.548 ( 6.584 2.347 -0.248) 6.994 6.664 ( 16.188 0.549 -4.951) 16.937 7.023 ( 3.537 0.066 -3.664) 5.093 7.488 ( -2.190 0.245 1.557) 2.698 7.567 ( 1.769 1.086 -0.383) 2.111 7.730 ( 8.464 11.594 7.033) 15.985 7.939 ( 9.284 1.445 -3.334) 9.969 8.001 ( 1.960 -2.146 -4.642) 5.477 8.164 ( 8.329 -1.068 0.937) 8.450 8.402 ( 7.748 2.307 -0.849) 8.128 8.898 ( -0.670 11.340 3.023) 11.755 9.331 ( 1.923 7.643 0.505) 7.897 9.786 ( 4.306 15.568 1.408) 16.214 9.854 ( 1.910 5.554 2.815) 6.513 9.999 ( 7.028 5.345 9.166) 12.727 10.254 ( 3.102 -1.238 -0.162) 3.344 10.921 ( -1.997 -15.602 -2.778) 15.973 11.127 ( 0.579 -13.850 -2.240) 14.042 12.263 ( 4.085 2.285 -0.575) 4.716 12.495 ( 0.957 3.681 -3.820) 5.391 12.961 ( 5.500 1.241 -3.488) 6.630 13.009 ( -2.218 7.358 1.396) 7.811 13.469 ( -14.906 -1.098 -4.105) 15.499 13.624 ( -2.027 2.350 7.084) 7.734 13.721 ( -21.319 -10.973 10.243) 26.073 13.884 ( -9.924 -3.095 0.753) 10.423 14.988 ( 10.961 -1.775 -2.628) 11.410 15.317 ( 9.160 0.661 2.157) 9.434 17.727 ( 2.086 0.397 -2.761) 3.483 17.842 ( -2.256 0.188 2.650) 3.485 ======================= Grid point 108 (35/117) ======================= q-point: ( 0.30 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.281 ( 12.771 -7.165 1.909) 14.767 1.393 ( 8.644 -10.533 -5.568) 14.719 1.492 ( 8.242 -4.298 -2.835) 9.718 1.901 ( 4.347 -9.297 -11.674) 15.543 1.989 ( -2.918 1.870 4.190) 5.438 2.049 ( -3.297 -1.103 4.291) 5.523 2.180 ( -5.079 -0.807 4.454) 6.804 2.297 ( -0.767 0.497 -0.747) 1.180 2.361 ( -0.984 -3.281 8.114) 8.807 2.413 ( -1.923 3.036 1.154) 3.775 2.527 ( -0.696 -0.164 3.921) 3.986 2.728 ( -0.802 0.198 1.671) 1.864 2.737 ( -3.750 -1.378 0.368) 4.012 2.796 ( 0.259 3.288 2.968) 4.437 2.897 ( -6.134 -0.325 -2.602) 6.671 3.007 ( 1.307 2.365 -0.350) 2.724 3.151 ( -1.938 -3.364 -2.835) 4.807 3.209 ( -0.243 5.121 1.535) 5.352 3.377 ( 0.373 2.797 -2.553) 3.806 3.459 ( -0.327 8.467 -0.284) 8.478 3.481 ( -1.034 6.771 -4.357) 8.118 3.621 ( 4.655 -3.603 -4.715) 7.542 3.730 ( -3.568 0.256 1.232) 3.783 3.840 ( 8.447 -0.455 -9.846) 12.980 3.876 ( -1.226 0.434 0.246) 1.323 3.963 ( 2.662 -1.305 -0.915) 3.103 4.305 ( -2.454 -0.367 3.197) 4.047 4.322 ( -0.445 -0.953 -3.833) 3.974 4.380 ( 4.862 2.628 -1.422) 5.706 4.650 ( 4.572 -2.261 2.084) 5.510 4.745 ( -5.077 -0.901 2.737) 5.838 4.931 ( -5.390 2.048 -2.561) 6.309 4.997 ( -1.528 -2.302 5.186) 5.876 5.221 ( 1.406 -2.607 3.599) 4.661 5.311 ( 1.881 3.796 -1.878) 4.635 5.491 ( -0.233 1.044 2.421) 2.647 5.577 ( 10.922 -1.183 1.668) 11.112 5.675 ( 14.262 -1.138 -6.588) 15.751 5.916 ( 7.917 1.311 6.557) 10.363 6.218 ( 1.851 -1.467 1.620) 2.864 6.384 ( -2.070 0.928 -1.400) 2.666 6.510 ( -2.611 -0.557 -0.872) 2.808 6.682 ( 8.240 0.485 -10.114) 13.055 6.890 ( 9.725 3.854 -7.384) 12.804 7.140 ( 9.767 -1.616 4.251) 10.774 7.426 ( -3.171 2.118 7.529) 8.440 7.624 ( 4.322 -1.556 -2.959) 5.464 7.769 ( 5.199 8.726 4.332) 11.042 8.058 ( 1.802 -3.420 -0.523) 3.901 8.088 ( 8.524 -1.087 -1.156) 8.671 8.315 ( 7.618 -0.785 -0.970) 7.719 8.501 ( 6.936 3.393 -2.609) 8.150 8.817 ( 0.034 6.578 0.848) 6.633 9.312 ( 1.287 4.286 -3.073) 5.429 9.706 ( 2.763 13.689 2.504) 14.188 9.863 ( 1.495 0.996 5.883) 6.152 10.127 ( 10.933 5.658 5.103) 13.326 10.309 ( 3.191 0.556 -0.532) 3.283 10.987 ( -0.624 -5.353 0.162) 5.391 11.249 ( 0.432 -11.893 -1.760) 12.030 12.306 ( 2.965 3.295 -7.767) 8.943 12.484 ( 2.868 3.108 -1.808) 4.599 12.901 ( -3.687 2.585 0.392) 4.520 13.049 ( 3.943 0.009 -1.924) 4.387 13.296 ( -6.448 -0.275 -0.180) 6.457 13.489 ( -16.184 -7.033 9.789) 20.179 13.561 ( -2.860 3.122 1.513) 4.497 13.796 ( -4.266 -3.821 0.676) 5.767 15.158 ( 7.657 -1.536 -2.314) 8.145 15.441 ( 6.421 1.984 1.190) 6.825 17.748 ( 1.210 0.619 -2.078) 2.482 17.798 ( -2.883 -0.258 2.000) 3.518 ======================= Grid point 109 (36/117) ======================= q-point: ( 0.40 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( 7.495 0.507 -2.157) 7.816 1.504 ( 4.520 -5.218 -3.308) 7.655 1.749 ( 4.491 -9.595 -2.684) 10.929 1.901 ( -1.902 -0.579 3.187) 3.756 1.932 ( -2.388 0.206 3.101) 3.920 2.102 ( 2.645 -1.210 -1.101) 3.110 2.153 ( 1.917 -5.428 -3.231) 6.601 2.255 ( -6.325 1.794 -0.119) 6.576 2.296 ( -0.354 -0.298 -1.552) 1.620 2.327 ( -4.188 1.579 1.509) 4.723 2.495 ( -3.416 2.732 0.759) 4.440 2.600 ( -5.145 4.119 0.744) 6.632 2.771 ( 0.108 1.222 1.220) 1.730 2.811 ( 0.025 -1.210 -3.962) 4.143 2.944 ( 2.145 -8.840 7.823) 11.998 3.047 ( 2.818 -1.595 0.748) 3.323 3.107 ( -4.484 2.396 -1.774) 5.385 3.154 ( 1.923 3.866 2.907) 5.205 3.342 ( -0.407 9.399 5.814) 11.059 3.399 ( -1.466 0.129 -3.824) 4.098 3.434 ( 3.826 3.700 0.686) 5.367 3.682 ( -1.157 -1.277 -1.829) 2.513 3.716 ( 2.743 -2.118 -3.472) 4.905 3.818 ( -3.376 1.501 0.840) 3.789 3.871 ( 1.473 -0.449 0.758) 1.717 4.167 ( 7.231 -2.387 -6.482) 10.000 4.274 ( -0.718 1.435 -3.765) 4.092 4.334 ( 2.762 -2.924 1.693) 4.364 4.427 ( 4.579 3.924 -5.012) 7.841 4.673 ( -4.332 -2.227 3.554) 6.029 4.732 ( 0.377 -1.385 -2.282) 2.696 4.794 ( -4.853 3.156 -3.150) 6.591 5.026 ( 1.385 -2.847 4.576) 5.564 5.259 ( -0.267 3.171 3.833) 4.982 5.266 ( -1.767 -1.857 1.325) 2.885 5.491 ( 0.679 0.354 -0.849) 1.143 5.750 ( 6.682 -0.670 4.341) 7.997 5.915 ( 12.043 -1.379 -5.553) 13.334 6.032 ( 6.420 1.208 4.021) 7.671 6.263 ( 1.810 -1.172 1.561) 2.662 6.324 ( -3.102 1.121 0.025) 3.299 6.432 ( -5.663 0.469 -1.964) 6.012 6.766 ( 2.211 -0.361 -9.773) 10.027 6.940 ( 1.773 2.208 -5.921) 6.563 7.324 ( 7.268 -0.547 11.016) 13.209 7.376 ( -1.077 1.766 7.480) 7.761 7.720 ( 4.905 -2.135 -5.366) 7.577 7.766 ( 2.330 6.378 0.111) 6.791 8.107 ( 1.150 -0.903 3.131) 3.455 8.231 ( 4.436 -4.313 0.680) 6.224 8.403 ( 2.698 1.676 -1.115) 3.366 8.595 ( 6.906 0.064 -7.210) 9.984 8.780 ( -0.232 2.351 1.530) 2.814 9.277 ( -0.671 3.877 -5.973) 7.153 9.663 ( 1.994 6.541 4.324) 8.091 9.894 ( 0.981 -1.494 5.390) 5.679 10.223 ( 5.217 6.867 3.055) 9.150 10.391 ( 6.448 -1.518 3.685) 7.580 10.991 ( -1.443 0.582 -1.072) 1.889 11.344 ( 0.972 -7.007 -0.256) 7.078 12.264 ( -2.123 3.422 -16.014) 16.513 12.563 ( 7.156 0.012 2.020) 7.436 12.826 ( -4.253 -0.313 0.260) 4.272 13.103 ( 2.408 0.760 -0.129) 2.528 13.209 ( -4.245 1.052 1.496) 4.623 13.319 ( -8.986 -3.446 8.465) 12.817 13.499 ( -1.331 1.784 -1.497) 2.682 13.790 ( -0.433 -2.513 2.323) 3.450 15.273 ( 4.144 -1.922 -2.329) 5.127 15.506 ( 3.152 2.219 0.797) 3.937 17.757 ( -1.075 -0.257 0.855) 1.397 17.759 ( -0.239 0.354 -0.809) 0.914 ======================= Grid point 110 (37/117) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.545 ( 2.544 2.073 -1.128) 3.470 1.659 ( 5.777 -4.926 -0.203) 7.595 1.753 ( -3.947 -1.786 -3.384) 5.497 1.788 ( -7.162 3.661 0.054) 8.043 2.034 ( 1.746 0.783 3.573) 4.053 2.108 ( -0.118 3.100 -1.404) 3.405 2.170 ( 1.252 -2.406 -2.843) 3.929 2.193 ( -2.939 -1.165 2.375) 3.955 2.306 ( 2.102 -2.917 -0.473) 3.627 2.369 ( 0.878 -3.197 -2.120) 3.935 2.388 ( -0.496 2.936 -0.025) 2.977 2.515 ( -0.874 3.176 0.913) 3.418 2.772 ( 0.736 0.162 0.054) 0.756 2.829 ( 1.577 -0.907 -4.327) 4.694 2.987 ( -2.313 4.660 0.117) 5.204 3.028 ( 1.358 -2.201 1.041) 2.788 3.068 ( -0.954 -3.360 0.321) 3.507 3.185 ( 0.975 4.832 4.793) 6.875 3.302 ( -0.924 0.313 6.251) 6.327 3.338 ( -2.178 -0.693 0.485) 2.336 3.525 ( 5.119 -0.321 -0.049) 5.129 3.671 ( -0.783 0.686 -0.277) 1.077 3.738 ( -3.806 -4.611 -0.907) 6.047 3.794 ( 3.355 2.552 -2.271) 4.788 3.956 ( 4.369 -3.524 0.659) 5.652 4.088 ( -6.763 3.427 3.294) 8.266 4.271 ( -2.320 0.232 -7.686) 8.032 4.433 ( 4.853 -0.078 0.300) 4.863 4.506 ( 4.768 0.536 -4.898) 6.856 4.615 ( -5.955 -1.583 -1.014) 6.245 4.663 ( -0.431 -0.046 -2.109) 2.153 4.783 ( 1.532 1.618 -3.673) 4.296 5.091 ( 2.112 -2.831 3.517) 4.984 5.185 ( -2.499 3.137 3.058) 5.044 5.294 ( -0.422 -3.402 3.831) 5.141 5.502 ( 1.115 0.360 -1.662) 2.033 5.793 ( -2.540 0.487 5.318) 5.913 6.042 ( 0.429 -0.155 -4.302) 4.326 6.144 ( 6.388 -0.106 4.288) 7.694 6.263 ( -2.513 1.127 0.250) 2.766 6.293 ( -0.366 -0.938 0.675) 1.212 6.370 ( 1.416 -0.502 -3.508) 3.816 6.735 ( -4.775 -0.713 -8.634) 9.892 6.928 ( -1.120 0.353 -4.076) 4.242 7.341 ( -1.526 1.294 7.053) 7.331 7.424 ( 1.627 0.332 13.092) 13.197 7.745 ( 0.770 2.953 -4.584) 5.507 7.800 ( 2.350 -2.012 -5.128) 5.989 8.107 ( -1.319 2.207 4.597) 5.267 8.285 ( -1.535 -0.921 4.603) 4.939 8.410 ( -0.040 -1.019 -5.678) 5.769 8.677 ( 0.533 -0.031 -7.927) 7.945 8.784 ( 1.934 -2.984 2.970) 4.633 9.222 ( -0.697 3.365 -6.877) 7.687 9.651 ( -2.430 -2.598 4.823) 5.993 9.921 ( -1.402 -3.344 4.625) 5.877 10.228 ( 0.658 1.751 1.695) 2.524 10.530 ( 6.914 -0.528 9.097) 11.438 10.924 ( -3.217 4.744 -4.190) 7.100 11.405 ( 1.910 -1.328 0.445) 2.368 12.170 ( -4.370 0.666 -16.532) 17.113 12.694 ( 6.254 -0.722 1.847) 6.561 12.749 ( -4.697 0.785 -0.916) 4.849 13.051 ( -6.220 0.120 2.687) 6.776 13.196 ( 1.978 -0.734 -0.424) 2.152 13.277 ( 0.452 -1.040 7.961) 8.042 13.490 ( 2.125 1.227 -1.709) 2.990 13.815 ( 1.648 0.042 2.487) 2.984 15.329 ( 0.476 -2.363 -2.600) 3.545 15.511 ( -0.570 1.755 0.954) 2.078 17.733 ( -1.257 -0.486 0.716) 1.526 17.771 ( 1.345 0.550 -0.633) 1.585 ======================= Grid point 111 (38/117) ======================= q-point: (-0.40 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.550 ( -9.995 2.834 -3.355) 10.917 1.574 ( -4.743 0.696 -7.555) 8.948 1.680 ( 0.154 6.460 3.793) 7.493 1.778 ( -1.130 -0.605 2.892) 3.164 1.967 ( 0.038 8.369 0.126) 8.370 2.079 ( 2.132 4.624 2.461) 5.656 2.170 ( -0.646 -0.682 -1.202) 1.526 2.255 ( 2.040 -5.219 -1.975) 5.942 2.293 ( -0.286 2.494 -3.825) 4.575 2.384 ( 2.612 -4.169 0.116) 4.922 2.482 ( 2.850 -2.316 3.883) 5.345 2.559 ( 6.041 -2.159 -0.797) 6.464 2.790 ( 1.181 0.067 0.830) 1.445 2.856 ( 1.029 1.360 1.602) 2.340 2.931 ( 0.007 4.636 0.002) 4.636 3.074 ( 1.427 -2.317 0.434) 2.756 3.105 ( 0.650 -3.858 -0.615) 3.961 3.149 ( 0.247 3.776 2.464) 4.516 3.216 ( -3.987 2.558 6.567) 8.098 3.386 ( -1.277 -8.282 -1.327) 8.484 3.580 ( -0.227 -2.155 2.095) 3.014 3.642 ( -0.553 2.584 -1.339) 2.963 3.716 ( -1.175 -3.009 -2.751) 4.243 3.813 ( -1.709 2.829 -3.168) 4.578 3.921 ( -1.339 -1.402 1.539) 2.475 4.097 ( -0.584 -1.324 -6.659) 6.814 4.217 ( 0.207 -1.962 -0.995) 2.209 4.478 ( -2.347 2.792 -4.039) 5.442 4.489 ( -1.465 0.824 -3.405) 3.797 4.582 ( 2.798 -2.320 3.245) 4.872 4.693 ( -0.507 -1.181 0.184) 1.299 4.800 ( 4.520 2.873 -3.147) 6.212 5.108 ( -2.208 0.663 6.452) 6.851 5.167 ( 1.370 -0.994 -0.137) 1.699 5.323 ( 0.312 -3.204 2.616) 4.148 5.513 ( 0.047 -0.042 -0.486) 0.490 5.686 ( -9.189 0.534 3.309) 9.782 5.933 ( -9.802 0.543 -4.146) 10.656 6.167 ( -3.948 1.054 5.356) 6.737 6.269 ( -2.093 -0.213 2.688) 3.413 6.308 ( 4.903 -1.199 1.676) 5.318 6.436 ( 3.765 -0.517 -5.449) 6.643 6.632 ( -6.501 -2.151 -9.946) 12.076 6.881 ( -4.029 -0.330 -4.316) 5.913 7.284 ( -5.333 1.029 6.410) 8.402 7.424 ( -1.341 1.523 9.125) 9.348 7.726 ( -2.702 -1.810 -0.468) 3.285 7.824 ( -0.174 -0.966 -7.622) 7.685 8.029 ( -4.556 4.698 5.763) 8.720 8.235 ( -3.284 1.532 3.402) 4.971 8.396 ( -4.081 -3.821 -6.010) 8.208 8.602 ( -6.759 0.631 -1.309) 6.913 8.878 ( 2.745 -5.643 0.090) 6.276 9.195 ( 0.936 0.964 -8.107) 8.218 9.629 ( -7.612 -11.069 5.936) 14.686 9.911 ( -3.779 -4.351 3.787) 6.896 10.232 ( -2.076 -4.545 2.158) 5.443 10.636 ( 3.884 1.435 13.942) 14.543 10.802 ( -3.798 5.792 -9.293) 11.590 11.436 ( 3.764 5.196 0.391) 6.428 12.078 ( -5.069 -2.070 -14.077) 15.105 12.648 ( -5.262 1.932 -2.903) 6.312 12.739 ( -1.542 2.273 4.333) 5.130 13.001 ( 0.478 -1.561 -0.596) 1.738 13.239 ( 2.194 -1.150 0.689) 2.571 13.350 ( 4.527 -2.776 5.360) 7.545 13.550 ( 6.527 1.855 1.141) 6.881 13.849 ( 3.425 2.527 1.733) 4.596 15.327 ( -2.787 -2.534 -3.309) 5.014 15.459 ( -4.290 0.878 1.807) 4.737 17.724 ( -0.261 -0.112 0.048) 0.288 17.796 ( 1.973 0.071 -0.003) 1.974 ======================= Grid point 112 (39/117) ======================= q-point: (-0.30 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.234 ( -16.569 7.356 -3.284) 18.423 1.406 ( -11.198 12.261 2.826) 16.844 1.599 ( -4.635 4.843 -7.708) 10.215 1.772 ( 2.256 0.675 -1.210) 2.647 1.880 ( -1.184 7.353 -1.397) 7.578 2.155 ( 6.586 2.801 2.551) 7.598 2.181 ( 1.459 -0.923 2.409) 2.964 2.286 ( -0.659 0.468 1.361) 1.583 2.336 ( 4.014 0.647 2.851) 4.966 2.462 ( 1.593 -6.239 -0.488) 6.458 2.532 ( -3.877 -2.594 9.201) 10.316 2.673 ( 4.548 -1.406 -0.769) 4.822 2.786 ( -0.409 1.760 4.959) 5.278 2.812 ( 1.348 2.392 2.010) 3.403 2.931 ( 3.261 0.980 -3.041) 4.565 3.104 ( 0.144 -3.135 -1.277) 3.388 3.109 ( 0.631 4.419 2.352) 5.045 3.158 ( 1.495 -3.348 -3.155) 4.837 3.259 ( 5.206 -4.582 1.563) 7.109 3.411 ( -2.199 -5.546 -5.926) 8.409 3.562 ( -4.716 4.648 -11.236) 13.041 3.592 ( -0.840 -2.061 1.852) 2.895 3.714 ( -0.451 -2.594 -1.003) 2.817 3.802 ( 1.619 -3.837 -2.936) 5.095 3.971 ( 1.865 -2.858 1.048) 3.570 4.023 ( -5.175 -2.076 -4.263) 7.019 4.293 ( 3.153 -1.160 -0.692) 3.430 4.399 ( -3.037 2.722 -3.401) 5.310 4.433 ( -1.761 1.164 0.805) 2.259 4.619 ( -2.459 0.401 2.394) 3.455 4.735 ( 5.930 -1.733 4.646) 7.729 4.867 ( 5.240 2.291 -3.853) 6.896 5.074 ( -1.537 -0.165 4.611) 4.863 5.189 ( 0.363 0.285 2.930) 2.966 5.360 ( -0.004 -2.695 -1.366) 3.022 5.466 ( -8.594 -0.728 1.681) 8.787 5.516 ( -7.853 -0.351 1.016) 7.927 5.747 ( -10.239 -0.254 -3.921) 10.967 6.055 ( -7.834 1.599 8.560) 11.713 6.196 ( -6.095 0.739 3.087) 6.873 6.382 ( 0.948 -1.405 0.005) 1.695 6.453 ( -1.343 0.005 -11.128) 11.209 6.559 ( -4.150 -3.481 -4.590) 7.100 6.783 ( -6.722 0.308 -7.549) 10.113 7.150 ( -9.330 1.508 3.612) 10.118 7.378 ( -4.192 0.153 5.063) 6.575 7.670 ( -6.775 -3.947 5.804) 9.755 7.804 ( -0.875 1.332 -9.148) 9.286 7.897 ( -5.850 4.753 5.590) 9.384 8.179 ( -1.660 1.550 2.911) 3.693 8.314 ( -9.193 -4.933 -4.865) 11.511 8.461 ( -8.981 -0.517 0.668) 9.021 8.962 ( 1.555 -4.832 2.294) 5.571 9.223 ( 2.358 -2.853 -10.716) 11.337 9.608 ( -10.717 -19.268 8.460) 23.616 9.892 ( -3.414 -5.359 2.578) 6.857 10.227 ( -5.445 -7.515 3.275) 9.841 10.595 ( -5.580 5.544 6.401) 10.141 10.761 ( 3.626 2.026 -3.523) 5.446 11.448 ( 7.033 12.802 -0.435) 14.613 12.004 ( -4.848 -3.122 -10.214) 11.729 12.531 ( -5.611 2.905 -2.607) 6.836 12.659 ( -4.088 2.653 6.076) 7.789 13.048 ( 3.113 0.160 -4.477) 5.456 13.289 ( 2.435 -0.720 1.812) 3.119 13.480 ( 6.560 -3.923 2.432) 8.022 13.683 ( 10.544 2.272 5.778) 12.236 13.898 ( 5.579 3.703 0.083) 6.696 15.270 ( -5.699 -1.771 -5.334) 8.005 15.362 ( -6.683 -0.523 4.327) 7.979 17.725 ( 0.603 0.279 -0.925) 1.138 17.839 ( 2.500 -1.035 0.826) 2.828 ======================= Grid point 113 (40/117) ======================= q-point: (-0.20 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.876 ( -15.938 8.963 4.071) 18.733 1.054 ( -13.676 17.457 10.922) 24.720 1.470 ( -4.567 2.665 -15.360) 16.244 1.669 ( -4.972 6.625 -16.084) 18.092 1.863 ( -17.427 8.651 22.618) 29.835 1.979 ( -0.082 4.877 10.425) 11.510 2.285 ( 6.794 0.009 2.087) 7.108 2.323 ( 5.826 -2.039 0.752) 6.218 2.382 ( -0.196 -1.487 6.745) 6.910 2.524 ( 0.800 -6.748 -0.640) 6.825 2.590 ( 6.432 -4.856 -1.184) 8.145 2.748 ( 2.770 -0.395 -1.128) 3.017 2.833 ( 1.840 -0.084 1.177) 2.186 2.853 ( 4.557 1.018 3.184) 5.651 2.986 ( 4.067 2.364 -5.130) 6.960 3.072 ( 0.198 3.967 -3.832) 5.520 3.154 ( 1.599 -2.495 -2.266) 3.731 3.190 ( -0.212 0.135 -9.490) 9.493 3.343 ( -1.610 -1.233 -11.119) 11.303 3.428 ( 3.917 -5.450 -1.123) 6.805 3.478 ( 1.323 -0.318 -6.987) 7.118 3.624 ( -0.976 -6.303 -0.352) 6.388 3.745 ( -0.427 -3.731 -1.613) 4.087 3.829 ( -2.047 -2.232 1.041) 3.203 3.982 ( -2.806 -3.811 -0.038) 4.733 4.024 ( 0.103 -3.897 2.320) 4.536 4.282 ( 0.310 5.418 -1.902) 5.751 4.332 ( -1.651 2.468 -1.701) 3.422 4.463 ( 2.640 -2.688 4.090) 5.561 4.591 ( 2.044 2.903 2.942) 4.611 4.838 ( 2.292 -1.662 4.295) 5.144 4.912 ( 2.441 1.918 -2.718) 4.126 5.085 ( 1.328 -1.641 2.142) 3.008 5.165 ( -4.427 0.457 4.826) 6.565 5.290 ( -3.858 1.061 -5.437) 6.750 5.354 ( -8.837 -1.929 2.187) 9.306 5.397 ( -5.896 -0.969 -1.144) 6.083 5.596 ( -8.767 -2.297 0.275) 9.067 5.915 ( -6.724 2.061 9.968) 12.200 6.084 ( -4.856 1.106 -0.830) 5.049 6.351 ( -7.594 -3.875 -4.676) 9.723 6.378 ( -5.480 0.157 -12.816) 13.939 6.495 ( -6.561 -0.945 -0.651) 6.660 6.634 ( -7.666 2.189 -7.455) 10.915 6.963 ( -10.294 1.794 2.398) 10.720 7.282 ( -7.605 -0.689 3.542) 8.418 7.595 ( -6.226 -3.568 7.547) 10.414 7.750 ( -1.928 2.481 -4.316) 5.339 7.800 ( -1.166 3.247 1.403) 3.724 8.143 ( -1.802 2.612 -2.182) 3.851 8.179 ( -11.565 -7.750 2.115) 14.081 8.318 ( -7.913 -0.703 0.185) 7.946 9.023 ( 1.254 -2.974 3.847) 5.022 9.300 ( 3.298 -6.118 -13.680) 15.344 9.640 ( -10.895 -29.544 12.404) 33.844 9.898 ( -1.966 -5.794 1.286) 6.252 10.181 ( -7.670 -7.473 4.485) 11.610 10.451 ( -6.423 3.601 4.073) 8.416 10.811 ( 4.333 2.158 -3.421) 5.928 11.442 ( 9.443 22.445 -8.189) 25.690 11.955 ( -1.472 -1.713 0.639) 2.347 12.400 ( -5.539 4.437 1.252) 7.207 12.597 ( -2.030 0.102 5.758) 6.106 13.077 ( 1.504 0.759 -5.598) 5.846 13.349 ( 5.821 2.550 3.025) 7.038 13.628 ( 6.742 -1.542 1.798) 7.146 13.876 ( 12.245 0.920 8.448) 14.905 13.977 ( 7.203 3.261 -1.930) 8.139 15.143 ( -9.282 -0.311 -5.921) 11.014 15.270 ( -5.340 -1.644 5.566) 7.887 17.740 ( 1.724 0.377 -2.052) 2.706 17.902 ( 2.474 -3.073 1.505) 4.223 ======================= Grid point 114 (41/117) ======================= q-point: (-0.10 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.595 ( -7.902 6.425 20.080) 22.515 0.699 ( -11.716 14.157 19.099) 26.504 1.329 ( -26.542 10.409 36.426) 46.257 1.390 ( -1.084 2.251 -16.267) 16.458 1.536 ( -2.516 4.234 -19.778) 20.382 2.073 ( 4.779 -0.109 8.434) 9.695 2.363 ( 0.526 -0.392 5.883) 5.920 2.397 ( 2.312 -2.154 1.022) 3.321 2.498 ( 9.237 -1.769 2.446) 9.718 2.596 ( 0.385 -6.605 -1.040) 6.698 2.694 ( 2.898 1.807 0.896) 3.531 2.813 ( 2.295 -1.998 -3.541) 4.669 2.849 ( -0.432 -1.129 -0.721) 1.407 2.887 ( 1.035 1.872 -0.059) 2.140 2.935 ( -2.160 5.794 -20.157) 21.084 3.038 ( 1.028 2.780 -8.107) 8.631 3.179 ( 4.997 0.222 -9.012) 10.307 3.236 ( 2.741 -2.375 0.239) 3.635 3.350 ( 0.769 -0.102 -2.224) 2.355 3.523 ( 0.923 -2.585 -5.364) 6.026 3.552 ( 4.365 -3.066 0.186) 5.337 3.586 ( -9.272 -3.820 -9.875) 14.074 3.756 ( -5.459 -4.031 3.074) 7.450 3.798 ( -1.371 -4.009 0.895) 4.331 3.968 ( -1.144 -0.235 5.385) 5.510 4.034 ( -1.560 -1.601 4.200) 4.758 4.252 ( 0.949 5.489 -0.561) 5.598 4.299 ( 0.305 2.598 -2.759) 3.802 4.555 ( 5.890 -2.950 6.686) 9.386 4.670 ( 9.531 2.917 -0.391) 9.975 4.841 ( -4.305 -1.885 2.916) 5.531 4.928 ( 2.585 1.176 1.068) 3.035 5.030 ( -5.918 0.044 0.459) 5.936 5.128 ( -6.844 -2.517 -2.757) 7.796 5.171 ( -8.416 0.450 2.866) 8.902 5.260 ( -3.547 2.652 -2.994) 5.345 5.357 ( 4.004 -1.176 -3.647) 5.542 5.443 ( -12.347 -0.875 0.791) 12.403 5.853 ( 0.714 0.286 6.205) 6.252 6.026 ( -1.387 0.406 -5.336) 5.528 6.176 ( -12.158 -1.790 -1.486) 12.379 6.210 ( -13.513 0.076 -3.794) 14.036 6.388 ( -1.195 1.797 -3.898) 4.455 6.515 ( -3.864 1.281 -0.829) 4.154 6.807 ( -5.163 1.351 7.096) 8.879 7.154 ( -7.355 0.147 1.338) 7.477 7.551 ( -2.120 -2.170 5.253) 6.066 7.727 ( 1.387 0.963 -3.169) 3.591 7.782 ( 0.685 1.011 2.382) 2.677 8.039 ( -8.306 -4.066 -2.141) 9.492 8.074 ( -6.796 0.128 1.538) 6.969 8.231 ( -2.602 -0.227 0.953) 2.780 9.064 ( 0.493 -1.945 3.958) 4.438 9.398 ( 4.115 -4.158 -15.525) 16.591 9.813 ( -5.409 -38.457 10.923) 40.343 9.923 ( -1.133 -5.517 0.727) 5.679 10.130 ( -8.397 -14.566 7.256) 18.312 10.324 ( -6.209 1.960 5.605) 8.591 10.864 ( 4.395 1.554 -6.429) 7.941 11.233 ( -5.643 37.777 -24.825) 45.555 12.085 ( 16.292 -1.326 17.396) 23.870 12.288 ( -2.647 4.229 4.379) 6.639 12.606 ( 1.824 -1.556 9.496) 9.794 13.099 ( 1.611 -3.167 -6.573) 7.472 13.487 ( 16.112 5.369 8.883) 19.166 13.720 ( 5.417 5.213 4.778) 8.908 14.045 ( 5.204 -0.375 -3.661) 6.374 14.094 ( 7.837 1.014 6.707) 10.364 14.976 ( -7.932 0.024 -3.861) 8.822 15.216 ( -3.310 -0.627 1.731) 3.788 17.777 ( 3.118 0.099 -2.172) 3.801 17.965 ( -1.121 -5.650 -1.264) 5.898 ======================= Grid point 116 (42/117) ======================= q-point: ( 0.10 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.846 ( 14.026 -0.000 14.356) 20.070 0.901 ( 21.444 -0.000 3.304) 21.697 1.454 ( -0.069 0.000 -16.587) 16.587 1.621 ( 7.705 -0.000 -17.838) 19.431 1.747 ( 23.913 -0.000 32.860) 40.640 2.038 ( 0.399 -0.000 10.191) 10.199 2.151 ( -8.965 0.000 -1.497) 9.090 2.417 ( -8.500 0.000 4.731) 9.728 2.421 ( -5.180 0.000 4.421) 6.811 2.555 ( -5.267 0.000 -1.397) 5.449 2.621 ( -1.843 0.000 -3.113) 3.617 2.756 ( 0.017 -0.000 2.133) 2.133 2.787 ( -3.164 0.000 -1.580) 3.537 2.877 ( -2.215 0.000 2.088) 3.043 3.012 ( 3.123 -0.000 -10.094) 10.566 3.053 ( -6.980 0.000 -4.284) 8.190 3.098 ( 0.419 -0.000 -7.718) 7.729 3.250 ( -3.000 0.000 1.388) 3.306 3.356 ( 10.993 -0.000 -16.273) 19.638 3.509 ( -3.302 0.000 -10.066) 10.594 3.635 ( 4.170 -0.000 -0.243) 4.177 3.638 ( -2.520 0.000 -7.122) 7.555 3.688 ( 2.381 -0.000 -0.153) 2.386 3.816 ( -6.318 0.000 4.957) 8.031 3.922 ( -0.186 0.000 -0.391) 0.433 3.987 ( -2.111 0.000 5.285) 5.691 4.268 ( 3.349 -0.000 -0.375) 3.370 4.322 ( 0.728 -0.000 -2.446) 2.552 4.395 ( -3.236 0.000 6.092) 6.898 4.525 ( 1.950 -0.000 4.790) 5.172 4.849 ( -4.815 0.000 1.061) 4.930 4.909 ( 0.118 -0.000 5.146) 5.147 5.065 ( -1.462 0.000 -0.686) 1.615 5.130 ( 4.812 -0.000 3.142) 5.747 5.251 ( 6.212 -0.000 -2.612) 6.739 5.352 ( 10.308 -0.000 -0.868) 10.345 5.468 ( 10.484 -0.000 -2.957) 10.893 5.548 ( -0.276 0.000 3.919) 3.929 5.805 ( 4.088 -0.000 4.471) 6.058 6.151 ( 2.727 -0.000 1.691) 3.209 6.414 ( 2.705 -0.000 -2.444) 3.645 6.456 ( 6.713 -0.000 -8.270) 10.652 6.571 ( 5.624 -0.000 -1.722) 5.882 6.664 ( 18.989 -0.000 -4.096) 19.426 7.025 ( 2.700 -0.000 -4.893) 5.589 7.489 ( -0.917 0.000 -0.857) 1.255 7.570 ( -0.377 0.000 3.766) 3.785 7.859 ( 4.556 -0.000 6.521) 7.955 7.920 ( 4.081 -0.000 -6.952) 8.061 8.003 ( 6.011 -0.000 -8.150) 10.127 8.150 ( 8.119 -0.000 3.330) 8.775 8.423 ( 8.092 -0.000 0.626) 8.117 9.018 ( -3.065 0.000 2.360) 3.868 9.419 ( -2.213 0.000 -10.153) 10.391 9.891 ( -1.682 0.000 6.449) 6.664 9.945 ( 1.161 -0.000 0.210) 1.180 10.250 ( 1.207 -0.000 6.511) 6.621 10.279 ( 8.599 -0.000 2.165) 8.868 10.496 ( 8.589 -0.000 1.279) 8.684 11.014 ( 0.266 -0.000 1.722) 1.742 12.289 ( 4.542 -0.000 -1.308) 4.727 12.533 ( 1.098 -0.000 -2.053) 2.329 12.959 ( 6.154 -0.000 -4.084) 7.386 13.136 ( -6.270 0.000 -16.128) 17.304 13.494 ( -13.348 0.000 -1.433) 13.425 13.529 ( -22.003 0.000 30.899) 37.933 13.649 ( -1.232 0.000 6.932) 7.040 13.859 ( -9.609 0.000 -2.137) 9.844 14.968 ( 11.809 -0.000 -2.490) 12.069 15.322 ( 9.910 -0.000 2.686) 10.267 17.732 ( 2.299 -0.000 -3.528) 4.210 17.844 ( -2.507 0.000 3.115) 3.999 ======================= Grid point 117 (43/117) ======================= q-point: ( 0.20 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.124 ( 12.011 -7.051 6.869) 15.530 1.270 ( 18.267 -3.095 -2.912) 18.755 1.472 ( 5.243 0.196 -8.475) 9.968 1.756 ( 6.143 -5.193 -14.472) 16.558 2.003 ( -6.593 -0.531 -2.077) 6.932 2.049 ( -0.394 1.060 9.270) 9.339 2.133 ( 7.454 -3.141 21.545) 23.013 2.296 ( -0.670 0.142 3.092) 3.167 2.309 ( -5.329 -1.203 0.632) 5.500 2.500 ( -3.637 4.489 -0.221) 5.782 2.537 ( -4.645 0.004 -1.442) 4.863 2.717 ( -4.187 0.112 -0.360) 4.204 2.754 ( -1.191 0.589 2.688) 2.998 2.856 ( 1.106 2.526 3.241) 4.255 2.900 ( -6.977 0.141 -2.130) 7.296 3.016 ( -1.714 -1.284 -0.348) 2.170 3.108 ( 0.724 -0.414 -4.816) 4.887 3.256 ( 1.254 0.639 0.978) 1.714 3.426 ( -2.384 2.116 -6.496) 7.236 3.501 ( 2.314 0.002 -12.835) 13.042 3.558 ( -3.478 -0.714 -8.245) 8.977 3.656 ( 0.145 6.425 6.468) 9.118 3.730 ( -1.635 -0.641 4.843) 5.152 3.824 ( 13.664 -1.041 -13.904) 19.522 3.894 ( -1.724 0.889 -0.768) 2.086 3.955 ( -1.983 -0.310 3.214) 3.790 4.277 ( -1.536 -1.165 -0.725) 2.060 4.340 ( 1.435 1.300 -0.536) 2.009 4.435 ( 6.648 2.887 1.605) 7.424 4.596 ( 3.756 -3.015 2.100) 5.255 4.735 ( -7.750 -0.199 2.594) 8.175 4.931 ( 0.083 -1.321 4.261) 4.462 4.986 ( -5.389 0.740 -0.159) 5.442 5.180 ( 0.538 -1.444 2.892) 3.277 5.354 ( 4.316 1.026 -1.590) 4.712 5.495 ( -1.908 -0.161 3.666) 4.136 5.564 ( 10.047 -0.284 -0.266) 10.054 5.668 ( 13.622 0.110 -4.976) 14.502 5.933 ( 8.407 0.540 7.112) 11.025 6.197 ( 1.960 -0.696 1.345) 2.477 6.401 ( -2.096 0.738 -2.134) 3.081 6.496 ( -1.171 -0.667 -0.703) 1.519 6.690 ( 7.357 0.317 -9.985) 12.407 6.936 ( 9.059 1.288 -7.772) 12.006 7.116 ( 9.931 -0.859 2.415) 10.256 7.451 ( -2.884 0.750 4.273) 5.210 7.598 ( 2.980 -0.957 1.538) 3.487 7.896 ( 2.194 5.129 2.700) 6.198 7.965 ( 1.640 -4.037 -1.392) 4.574 8.116 ( 6.824 1.049 -3.066) 7.555 8.294 ( 7.400 -0.999 0.324) 7.474 8.547 ( 6.672 1.453 0.929) 6.891 8.940 ( -2.788 5.136 0.674) 5.882 9.361 ( -2.272 1.419 -8.140) 8.569 9.869 ( -2.085 0.621 8.681) 8.949 9.945 ( 2.577 8.316 -0.237) 8.710 10.221 ( 5.669 6.905 1.571) 9.071 10.409 ( 9.857 9.218 2.835) 13.790 10.757 ( 4.455 -18.102 -1.582) 18.709 11.032 ( -2.476 -8.948 4.089) 10.145 12.361 ( 4.504 2.227 -6.889) 8.527 12.541 ( 1.718 2.288 -1.948) 3.461 12.958 ( -8.006 2.756 -11.643) 14.396 13.054 ( 4.493 -0.043 -0.127) 4.495 13.293 ( -6.324 0.598 10.975) 12.680 13.367 ( -9.965 -5.415 9.363) 14.707 13.632 ( -1.223 4.171 3.166) 5.377 13.726 ( -5.568 -3.939 -1.082) 6.906 15.135 ( 7.501 -0.868 -2.133) 7.847 15.462 ( 6.294 0.501 1.443) 6.477 17.757 ( 1.225 0.294 -2.630) 2.916 17.794 ( -3.253 -0.125 2.393) 4.041 ======================= Grid point 118 (44/117) ======================= q-point: ( 0.30 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( 8.302 -8.025 -0.058) 11.547 1.513 ( 7.453 -1.097 -5.230) 9.171 1.629 ( 9.591 -2.451 0.443) 9.909 1.822 ( -0.859 -5.418 -3.901) 6.731 1.977 ( -5.598 2.054 4.114) 7.244 2.021 ( 5.202 -4.971 -3.632) 8.060 2.122 ( -0.744 0.409 4.347) 4.430 2.277 ( -2.080 -0.411 -3.775) 4.329 2.311 ( -8.263 2.009 -0.158) 8.505 2.352 ( -1.973 0.650 2.868) 3.541 2.537 ( 0.685 2.053 2.271) 3.137 2.668 ( -3.494 0.616 2.660) 4.434 2.709 ( -1.216 -2.023 1.882) 3.019 2.823 ( -1.830 1.476 -1.509) 2.794 2.882 ( 2.356 1.045 5.955) 6.489 3.020 ( 0.155 -3.321 1.700) 3.734 3.104 ( -0.948 0.869 -1.819) 2.228 3.239 ( -1.717 3.474 1.842) 4.290 3.379 ( -2.788 -0.871 -6.938) 7.527 3.454 ( 0.789 2.995 -1.508) 3.444 3.558 ( 0.330 -1.062 -6.942) 7.030 3.590 ( -0.364 3.415 2.715) 4.378 3.750 ( 2.201 1.750 4.856) 5.611 3.856 ( -1.705 1.808 0.220) 2.495 3.886 ( -0.866 1.577 -0.332) 1.829 4.130 ( 15.252 -1.416 -14.015) 20.762 4.291 ( 2.141 -1.780 -0.517) 2.832 4.321 ( -1.433 3.495 1.348) 4.011 4.499 ( 3.407 3.864 -3.107) 6.016 4.628 ( -4.967 -2.426 3.846) 6.734 4.687 ( 1.746 -3.550 -0.204) 3.962 4.848 ( -5.713 2.651 -1.464) 6.466 4.981 ( 1.287 -2.033 5.136) 5.672 5.199 ( -0.775 -3.198 2.458) 4.108 5.343 ( -2.569 4.056 1.382) 4.996 5.466 ( -1.404 -2.712 -0.193) 3.060 5.746 ( 8.669 0.145 3.378) 9.306 5.900 ( 12.719 -0.422 -5.243) 13.763 6.053 ( 5.343 1.091 5.471) 7.724 6.236 ( 1.334 -1.613 0.622) 2.183 6.346 ( -2.756 1.083 -0.284) 2.975 6.438 ( -5.320 0.210 -1.321) 5.486 6.764 ( 2.022 -0.007 -9.766) 9.973 6.967 ( -0.584 0.885 -6.875) 6.956 7.309 ( 7.655 -0.994 9.696) 12.394 7.403 ( -1.828 1.196 5.547) 5.962 7.684 ( 5.026 -1.684 -2.416) 5.825 7.868 ( -0.514 4.671 -0.622) 4.740 8.036 ( 1.637 -4.921 0.869) 5.259 8.208 ( 4.697 0.349 0.279) 4.718 8.407 ( 4.180 -1.081 -1.544) 4.585 8.624 ( 4.353 2.291 -0.272) 4.927 8.852 ( -1.886 5.191 -1.266) 5.666 9.299 ( -3.938 -0.824 -5.929) 7.166 9.793 ( -5.002 4.461 8.025) 10.456 9.922 ( 3.103 7.110 -0.006) 7.758 10.323 ( 6.997 -1.588 1.517) 7.333 10.435 ( 4.220 12.527 2.860) 13.525 10.913 ( 0.210 -8.391 0.094) 8.394 11.116 ( -1.507 -16.897 2.686) 17.175 12.339 ( -2.585 4.637 -16.171) 17.020 12.583 ( 5.572 1.045 -1.033) 5.763 12.839 ( -2.774 1.853 -2.396) 4.107 13.108 ( 0.356 -1.985 7.438) 7.706 13.238 ( -3.299 2.187 3.986) 5.618 13.270 ( -2.875 -0.776 3.855) 4.871 13.545 ( -2.760 2.956 -1.560) 4.334 13.742 ( 1.802 -2.766 2.686) 4.256 15.238 ( 3.519 -1.722 -2.265) 4.525 15.531 ( 2.265 0.723 0.909) 2.546 17.748 ( -2.409 -0.432 1.390) 2.814 17.769 ( 0.883 0.432 -1.401) 1.711 ======================= Grid point 119 (45/117) ======================= q-point: ( 0.40 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.550 ( 0.842 -2.795 -1.334) 3.209 1.567 ( 4.543 -4.847 -1.700) 6.857 1.727 ( 1.858 0.002 -0.647) 1.968 1.836 ( -7.650 1.806 -0.025) 7.860 1.957 ( 8.095 -6.294 2.651) 10.591 2.131 ( -1.336 -0.588 -3.381) 3.683 2.161 ( 1.643 -1.813 2.195) 3.288 2.180 ( 2.293 0.058 -0.554) 2.360 2.288 ( -1.571 1.570 -1.495) 2.678 2.320 ( 3.158 -1.098 -1.077) 3.513 2.472 ( -3.329 5.063 0.143) 6.061 2.584 ( -2.033 4.230 0.483) 4.719 2.740 ( -1.746 -5.855 0.487) 6.129 2.795 ( -0.124 -0.614 -3.148) 3.210 2.931 ( 1.032 -3.831 5.816) 7.041 3.031 ( -2.555 -2.011 -1.695) 3.667 3.060 ( -1.759 2.415 0.429) 3.018 3.192 ( 0.225 0.292 4.944) 4.957 3.327 ( -4.150 -1.318 -2.552) 5.047 3.431 ( 0.704 8.069 0.774) 8.136 3.584 ( 3.299 2.456 -0.748) 4.180 3.607 ( 1.243 -1.909 -1.034) 2.502 3.733 ( -1.663 2.203 4.123) 4.961 3.848 ( 3.996 2.903 -2.768) 5.662 3.917 ( 4.419 -1.058 0.211) 4.549 4.164 ( -7.098 5.593 4.585) 10.133 4.284 ( 0.700 0.916 -10.060) 10.126 4.416 ( 6.346 -0.938 1.913) 6.694 4.513 ( 0.657 -2.316 -2.283) 3.318 4.601 ( -0.289 1.915 -2.117) 2.869 4.661 ( -3.417 -0.266 -4.087) 5.334 4.798 ( 1.008 0.164 -2.814) 2.993 5.039 ( 2.142 -2.709 4.799) 5.913 5.208 ( -2.615 -2.646 1.301) 3.941 5.259 ( -2.337 1.632 4.125) 5.014 5.474 ( -1.090 -3.301 -1.067) 3.637 5.817 ( -0.760 2.048 5.440) 5.863 6.046 ( 2.476 0.564 -4.445) 5.120 6.138 ( 5.466 -0.408 3.971) 6.769 6.259 ( -1.794 -1.949 -0.146) 2.654 6.295 ( -1.727 1.528 1.004) 2.515 6.363 ( 0.013 -0.394 -3.524) 3.546 6.729 ( -4.891 0.007 -7.488) 8.944 6.923 ( -3.321 -0.828 -4.984) 6.047 7.367 ( -1.213 1.491 6.714) 6.983 7.411 ( 1.285 -1.443 12.099) 12.253 7.760 ( 0.791 -2.322 -2.290) 3.356 7.802 ( -1.873 3.248 -4.758) 6.058 8.095 ( 0.270 -3.508 1.823) 3.962 8.260 ( 0.751 -0.302 2.238) 2.380 8.436 ( -0.145 2.015 -2.281) 3.047 8.674 ( 2.992 0.094 -6.129) 6.821 8.781 ( -2.407 2.564 0.710) 3.588 9.228 ( -5.439 -2.934 -4.758) 7.800 9.659 ( -7.538 2.298 5.802) 9.786 9.908 ( 0.086 3.361 1.577) 3.714 10.341 ( -1.026 10.556 2.582) 10.916 10.477 ( 4.738 -5.443 4.995) 8.777 10.931 ( -3.681 -3.300 -0.229) 4.949 11.253 ( 0.475 -14.636 0.692) 14.660 12.200 ( -6.566 2.873 -17.338) 18.761 12.689 ( 5.887 -1.138 -2.555) 6.518 12.794 ( 0.017 4.664 2.960) 5.524 13.076 ( -4.960 1.941 4.939) 7.264 13.208 ( 1.877 -0.181 5.386) 5.707 13.258 ( 0.427 1.176 1.082) 1.654 13.519 ( 2.492 1.769 -2.052) 3.681 13.813 ( 4.230 -0.281 2.791) 5.075 15.282 ( -0.325 -2.674 -2.643) 3.774 15.530 ( -1.918 0.351 0.942) 2.165 17.724 ( -1.074 -0.560 0.427) 1.284 17.780 ( 1.092 0.474 -0.361) 1.244 ======================= Grid point 120 (46/117) ======================= q-point: (-0.50 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.543 ( -1.236 -1.920 -3.912) 4.529 1.596 ( -9.040 -0.318 -2.346) 9.345 1.746 ( 3.047 1.652 -0.931) 3.589 1.779 ( 2.869 1.134 3.692) 4.811 2.082 ( 0.316 3.626 2.206) 4.256 2.135 ( -0.059 -1.180 -1.543) 1.944 2.165 ( 2.926 -4.065 0.959) 5.100 2.192 ( 1.413 5.852 0.081) 6.021 2.295 ( -0.496 -2.753 -1.462) 3.157 2.360 ( 1.495 1.856 0.071) 2.385 2.464 ( 5.425 -0.094 -0.877) 5.496 2.543 ( 1.339 0.509 -0.884) 1.683 2.764 ( -0.186 -3.982 -0.517) 4.020 2.826 ( 1.862 -3.457 -4.947) 6.316 2.956 ( -1.980 -2.517 0.570) 3.253 3.023 ( -0.860 -3.932 0.189) 4.029 3.045 ( 2.390 -0.091 3.334) 4.103 3.236 ( 0.997 -2.262 5.322) 5.868 3.262 ( -3.080 -0.140 0.210) 3.090 3.328 ( -3.889 10.913 4.753) 12.522 3.575 ( -2.506 -0.972 1.403) 3.032 3.624 ( 0.202 0.659 1.076) 1.278 3.735 ( 3.349 2.838 -1.509) 4.642 3.876 ( -2.001 3.902 -3.597) 5.672 3.938 ( -1.015 2.935 1.428) 3.418 4.070 ( 0.867 -1.148 -2.410) 2.807 4.215 ( -2.988 1.616 -4.184) 5.389 4.475 ( -3.629 -1.602 0.287) 3.977 4.534 ( 2.385 -2.770 4.138) 5.521 4.555 ( 0.733 4.620 -6.985) 8.407 4.675 ( 1.461 -0.903 -5.031) 5.316 4.825 ( 2.880 0.014 -2.972) 4.138 5.091 ( -0.438 -2.340 5.613) 6.096 5.161 ( -1.481 -0.004 0.505) 1.565 5.265 ( -0.093 -3.132 3.389) 4.615 5.480 ( -1.895 -3.711 -0.328) 4.180 5.712 ( -8.727 2.455 3.806) 9.832 5.948 ( -10.026 1.044 -3.977) 10.837 6.187 ( -3.416 0.967 3.352) 4.883 6.251 ( -0.084 -1.698 4.380) 4.698 6.293 ( 2.746 -0.434 0.395) 2.808 6.426 ( 4.681 -0.636 -5.991) 7.630 6.605 ( -7.902 -0.746 -7.026) 10.600 6.859 ( -5.333 -2.235 -4.709) 7.457 7.311 ( -4.775 1.969 6.758) 8.506 7.431 ( -1.753 -1.021 11.203) 11.385 7.689 ( -7.759 -2.084 0.420) 8.045 7.802 ( 0.764 -1.239 -7.356) 7.499 8.094 ( -2.529 0.782 3.588) 4.459 8.229 ( -4.691 -0.089 3.348) 5.764 8.384 ( -2.562 2.303 -5.450) 6.448 8.629 ( -6.283 2.348 -6.699) 9.479 8.787 ( 1.791 -4.206 1.124) 4.708 9.164 ( -5.474 -5.296 -3.656) 8.449 9.516 ( -9.086 -1.804 4.221) 10.179 9.863 ( -3.737 0.058 3.229) 4.939 10.231 ( -4.147 3.649 3.390) 6.481 10.602 ( 3.065 -5.832 8.057) 10.408 10.851 ( -6.495 0.473 -4.005) 7.645 11.383 ( 2.026 -10.130 -1.136) 10.393 12.054 ( -6.783 -0.222 -13.351) 14.977 12.712 ( -2.025 4.359 -2.961) 5.645 12.798 ( 3.318 4.063 5.424) 7.546 12.991 ( -1.380 1.330 0.211) 1.928 13.248 ( 2.211 1.039 1.400) 2.816 13.302 ( 4.216 -2.297 3.536) 5.963 13.587 ( 7.358 2.295 0.093) 7.708 13.891 ( 5.499 2.249 2.122) 6.309 15.272 ( -3.466 -3.447 -3.206) 5.845 15.464 ( -5.863 -0.399 1.377) 6.036 17.720 ( 0.121 -0.298 -0.370) 0.490 17.798 ( 1.299 0.160 0.447) 1.383 ======================= Grid point 121 (47/117) ======================= q-point: (-0.40 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.364 ( -12.631 6.508 -2.608) 14.447 1.521 ( -2.369 2.472 -6.797) 7.611 1.723 ( -6.873 6.359 3.149) 9.879 1.801 ( 4.993 3.710 3.171) 6.982 2.013 ( -1.540 6.070 -1.521) 6.445 2.155 ( 0.563 -0.884 -1.461) 1.798 2.185 ( 5.255 0.764 0.532) 5.337 2.267 ( 4.436 -2.456 -3.323) 6.062 2.352 ( 4.066 -2.428 -0.192) 4.740 2.378 ( 1.265 0.617 2.644) 2.995 2.534 ( 2.466 1.049 4.950) 5.629 2.641 ( 6.237 -2.795 -2.257) 7.197 2.782 ( -1.669 -1.396 1.271) 2.520 2.887 ( 2.211 0.274 -0.115) 2.230 2.951 ( 0.338 -0.780 -0.407) 0.943 3.040 ( -7.003 4.275 6.314) 10.353 3.080 ( 1.044 -3.999 0.548) 4.169 3.158 ( 0.171 -5.085 2.281) 5.575 3.222 ( 1.753 4.341 1.709) 4.984 3.305 ( 0.162 -4.365 0.570) 4.405 3.544 ( -2.305 -1.316 3.326) 4.255 3.648 ( 1.956 -1.398 -0.708) 2.507 3.708 ( -7.234 5.393 -9.535) 13.128 3.752 ( -0.048 0.151 -3.030) 3.034 3.962 ( 2.168 1.545 -0.470) 2.704 4.004 ( -4.926 -0.353 -5.748) 7.579 4.264 ( 5.171 -1.695 -1.202) 5.573 4.435 ( -1.819 -0.500 0.859) 2.073 4.454 ( -4.285 2.579 -1.324) 5.173 4.622 ( -0.077 0.071 -2.507) 2.509 4.709 ( 5.251 -0.984 3.015) 6.135 4.886 ( 3.679 -0.366 -4.492) 5.817 5.072 ( -2.309 -0.640 5.307) 5.823 5.174 ( 0.352 -1.629 1.954) 2.568 5.297 ( -0.423 -3.935 1.610) 4.273 5.454 ( -5.392 -2.142 -0.237) 5.807 5.510 ( -11.972 0.795 1.756) 12.126 5.744 ( -11.919 -0.172 -3.783) 12.506 6.087 ( -6.660 1.959 6.898) 9.786 6.199 ( -5.744 -0.450 2.913) 6.456 6.354 ( -0.532 -1.621 -0.647) 1.825 6.448 ( -2.203 -0.578 -11.330) 11.556 6.521 ( -1.061 -0.880 -1.260) 1.867 6.765 ( -7.419 -2.399 -6.531) 10.171 7.182 ( -8.595 2.165 5.930) 10.664 7.385 ( -5.164 0.274 5.413) 7.486 7.575 ( -9.396 -6.160 5.846) 12.665 7.812 ( -0.085 -0.866 -6.907) 6.962 7.999 ( -5.077 5.671 6.327) 9.898 8.135 ( -8.039 -3.932 0.013) 8.949 8.297 ( -5.043 1.468 -6.233) 8.150 8.465 ( -9.315 1.292 -3.389) 9.996 8.863 ( 1.551 -5.820 0.772) 6.073 9.120 ( -7.343 -9.165 0.029) 11.743 9.403 ( -6.748 -3.731 1.052) 7.782 9.803 ( -4.912 -3.776 4.122) 7.442 10.150 ( -5.119 -2.141 4.782) 7.325 10.690 ( -1.233 3.251 11.710) 12.215 10.717 ( -4.425 -5.415 -9.571) 11.854 11.501 ( 3.921 -5.874 -5.185) 8.761 11.953 ( -4.811 -2.145 -6.961) 8.729 12.611 ( -3.258 6.239 -3.794) 7.996 12.754 ( -1.526 8.156 8.380) 11.793 13.029 ( 3.275 -2.258 -3.220) 5.117 13.287 ( 2.749 -0.565 1.354) 3.116 13.431 ( 8.573 -1.366 0.683) 8.708 13.724 ( 10.469 2.375 3.532) 11.302 13.967 ( 6.529 4.038 0.759) 7.714 15.222 ( -5.470 -3.567 -4.505) 7.933 15.345 ( -8.747 -1.456 2.753) 9.285 17.729 ( 0.940 0.152 -1.153) 1.496 17.823 ( 1.130 -0.745 1.221) 1.822 ======================= Grid point 122 (48/117) ======================= q-point: (-0.30 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.065 ( -12.081 11.515 2.371) 16.857 1.345 ( -10.246 14.029 5.750) 18.299 1.542 ( -4.785 5.621 -9.112) 11.727 1.789 ( -2.311 6.262 -11.040) 12.901 1.984 ( 4.953 5.759 5.208) 9.210 2.195 ( -2.761 7.224 6.274) 9.958 2.283 ( 2.139 6.635 3.354) 7.736 2.296 ( 2.501 -0.104 1.744) 3.051 2.369 ( -6.223 0.974 9.844) 11.686 2.431 ( 2.245 -2.378 0.315) 3.285 2.494 ( 6.884 -5.061 -1.188) 8.626 2.743 ( 3.331 -0.146 0.433) 3.362 2.785 ( 1.380 -4.623 -0.825) 4.894 2.896 ( 1.808 3.850 4.206) 5.982 2.981 ( 5.359 -3.301 -0.351) 6.304 3.057 ( 0.915 -7.842 -0.059) 7.896 3.100 ( 0.320 0.226 -1.716) 1.760 3.249 ( 3.558 3.438 -2.509) 5.548 3.268 ( -0.219 -9.745 -4.157) 10.597 3.350 ( 4.542 -0.785 -1.654) 4.897 3.498 ( -5.060 2.676 -11.734) 13.056 3.538 ( -3.701 -1.608 0.815) 4.117 3.696 ( -1.024 -1.748 -3.592) 4.124 3.755 ( -1.344 -5.528 -0.363) 5.700 3.932 ( -2.839 -1.163 -1.094) 3.257 3.993 ( 1.513 0.642 0.756) 1.809 4.340 ( 2.513 0.695 -3.749) 4.566 4.367 ( -2.981 1.465 0.203) 3.328 4.435 ( 1.301 -0.487 3.617) 3.874 4.625 ( 2.848 0.768 1.074) 3.139 4.810 ( 2.699 -1.544 2.929) 4.272 4.929 ( 1.446 -0.331 -5.057) 5.270 5.065 ( 0.545 -0.928 3.814) 3.963 5.159 ( -6.408 -1.058 4.654) 7.990 5.292 ( -5.581 -4.281 1.889) 7.283 5.307 ( -5.050 0.534 -3.033) 5.914 5.382 ( -6.069 -1.310 -1.784) 6.460 5.553 ( -10.843 -2.256 -1.182) 11.138 5.954 ( -7.351 2.096 10.783) 13.217 6.104 ( -4.146 0.944 -3.032) 5.222 6.275 ( -9.280 -3.857 -4.402) 10.972 6.393 ( -4.650 1.098 -6.862) 8.362 6.498 ( -2.630 0.832 -1.876) 3.336 6.637 ( -8.018 -1.631 -6.496) 10.448 7.004 ( -9.786 2.575 5.481) 11.508 7.276 ( -7.044 -0.015 1.396) 7.181 7.498 ( -7.215 -6.994 8.463) 13.138 7.791 ( -1.594 1.180 -3.788) 4.276 7.879 ( -2.741 5.298 3.770) 7.057 8.021 ( -11.607 -8.596 -0.844) 14.468 8.182 ( -6.328 0.469 -4.676) 7.882 8.312 ( -6.191 1.178 -1.640) 6.512 8.945 ( 1.694 -5.755 1.540) 6.194 9.070 ( -11.189 -16.088 7.881) 21.121 9.361 ( -1.939 -3.670 -3.237) 5.264 9.781 ( -3.572 -6.811 2.975) 8.246 10.094 ( -5.573 -4.202 6.772) 9.725 10.538 ( -6.270 5.135 -4.907) 9.474 10.786 ( 1.499 -5.104 5.340) 7.538 11.601 ( 3.833 -2.539 -16.001) 16.649 11.925 ( 0.698 -1.793 3.871) 4.323 12.495 ( -3.163 6.170 -4.099) 8.055 12.663 ( -1.202 8.084 9.829) 12.783 13.077 ( 0.626 -0.425 -2.268) 2.391 13.369 ( 5.752 -1.672 1.468) 6.167 13.617 ( 12.421 0.362 -2.253) 12.629 13.899 ( 10.889 1.712 5.822) 12.466 14.047 ( 7.042 4.398 -0.764) 8.338 15.125 ( -8.711 -1.889 -5.600) 10.527 15.225 ( -6.750 -3.421 3.973) 8.547 17.747 ( 1.706 0.427 -1.916) 2.601 17.850 ( -0.001 -2.463 2.065) 3.214 ======================= Grid point 123 (49/117) ======================= q-point: (-0.20 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.789 ( -6.895 13.631 13.028) 20.076 1.005 ( -12.123 17.975 13.888) 25.747 1.441 ( -0.361 4.711 -14.484) 15.235 1.661 ( -1.682 8.863 -17.829) 19.981 1.711 ( -16.586 29.769 25.834) 42.763 2.079 ( 4.087 1.296 7.628) 8.750 2.331 ( -1.608 -2.711 6.021) 6.796 2.383 ( 3.878 -0.242 -3.102) 4.972 2.434 ( 8.220 -4.367 3.025) 9.787 2.482 ( 0.391 -5.205 0.358) 5.232 2.686 ( 7.423 -2.990 -0.910) 8.054 2.771 ( 0.557 -1.625 -1.351) 2.185 2.827 ( -0.533 -1.460 -1.560) 2.202 2.896 ( -0.803 -1.612 1.468) 2.324 3.049 ( -0.079 5.297 -5.832) 7.878 3.107 ( -0.612 0.737 -7.639) 7.699 3.172 ( 4.089 -2.970 -3.832) 6.343 3.193 ( 4.612 1.628 -8.846) 10.109 3.350 ( 3.644 0.223 -1.639) 4.002 3.441 ( -1.534 -5.419 -5.016) 7.542 3.472 ( 3.270 -5.334 0.205) 6.260 3.503 ( -4.694 -4.037 0.806) 6.243 3.667 ( -3.038 -4.884 -5.160) 7.727 3.750 ( -4.624 -1.998 3.014) 5.870 3.923 ( -0.216 -3.241 3.299) 4.630 4.006 ( -0.431 -0.588 1.693) 1.844 4.311 ( -1.216 0.896 -0.311) 1.542 4.374 ( 3.093 4.001 -3.252) 6.012 4.502 ( 5.466 -2.515 5.037) 7.847 4.713 ( 7.450 0.909 0.490) 7.521 4.814 ( -3.174 -0.992 0.981) 3.467 4.941 ( 0.777 0.277 -0.937) 1.249 5.016 ( -8.101 -1.797 2.152) 8.572 5.069 ( -6.314 -3.381 0.531) 7.182 5.195 ( -5.310 1.317 1.625) 5.707 5.302 ( -3.470 0.762 -1.311) 3.787 5.319 ( 4.088 -2.217 -5.934) 7.539 5.410 ( -9.128 -2.653 0.301) 9.511 5.861 ( -1.598 0.512 8.337) 8.504 6.035 ( -3.659 0.487 -4.739) 6.007 6.141 ( -6.834 -1.431 0.392) 6.993 6.220 ( -12.296 0.917 -4.728) 13.206 6.429 ( -1.377 2.607 -4.285) 5.201 6.534 ( -4.141 0.349 -2.579) 4.891 6.844 ( -5.854 2.445 8.151) 10.329 7.158 ( -6.417 0.261 -0.091) 6.423 7.479 ( -1.892 -5.685 5.959) 8.450 7.759 ( 0.825 2.328 -2.346) 3.406 7.806 ( -3.927 1.064 2.905) 5.000 7.909 ( -9.701 -9.545 0.493) 13.619 8.073 ( -5.291 -0.417 -2.970) 6.082 8.236 ( -1.565 1.321 -1.118) 2.333 8.977 ( -6.440 -9.812 5.698) 13.047 9.103 ( -3.757 -19.439 13.180) 23.784 9.391 ( 1.685 -4.592 -4.188) 6.439 9.796 ( -2.767 -8.050 0.452) 8.524 10.045 ( -5.099 -3.683 8.627) 10.677 10.393 ( -4.709 5.205 -3.221) 7.722 10.861 ( 2.457 -3.211 2.909) 4.981 11.588 ( -3.020 4.482 -28.024) 28.540 12.049 ( 9.545 -3.301 10.081) 14.269 12.395 ( -0.817 6.568 -1.723) 6.840 12.613 ( 1.389 4.577 12.048) 12.963 13.061 ( -2.019 -0.372 -0.712) 2.173 13.511 ( 7.501 -2.631 4.340) 9.056 13.838 ( 16.200 4.277 -5.806) 17.733 14.051 ( 7.326 1.608 1.228) 7.600 14.123 ( 4.223 2.072 1.613) 4.973 14.969 ( -9.052 -1.239 -1.020) 9.193 15.186 ( -2.013 -2.954 -1.737) 3.974 17.779 ( 2.537 0.085 -1.876) 3.156 17.858 ( -3.676 -4.785 2.545) 6.549 ======================= Grid point 124 (50/117) ======================= q-point: (-0.10 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.629 ( -3.392 10.365 21.239) 23.875 0.714 ( -1.893 17.968 19.413) 26.520 1.294 ( -0.654 28.469 37.042) 46.723 1.426 ( 3.641 3.028 -15.405) 16.116 1.565 ( 1.852 7.951 -19.714) 21.338 2.114 ( -1.296 0.143 8.641) 8.739 2.328 ( -1.960 -1.737 6.013) 6.559 2.427 ( 0.591 -1.076 -2.357) 2.658 2.536 ( 0.531 -6.925 -0.502) 6.964 2.578 ( 1.319 -3.534 4.113) 5.581 2.735 ( -0.363 0.502 2.947) 3.011 2.789 ( -1.469 -0.521 -3.203) 3.562 2.806 ( -0.992 -0.235 -9.021) 9.079 2.912 ( 2.656 0.236 -10.953) 11.273 2.981 ( 0.119 4.000 -7.076) 8.130 3.078 ( 1.145 2.983 -8.430) 9.015 3.206 ( -3.642 -2.938 -2.024) 5.098 3.255 ( -2.885 0.753 -1.130) 3.188 3.389 ( 0.405 1.279 -1.953) 2.369 3.402 ( 7.355 2.005 -3.338) 8.322 3.524 ( -1.823 -8.687 0.767) 8.909 3.580 ( 1.532 -6.295 1.495) 6.649 3.635 ( -3.880 0.098 0.607) 3.929 3.746 ( 3.065 -5.938 -1.528) 6.855 3.967 ( 1.191 -2.144 6.912) 7.334 3.994 ( -2.216 -1.570 2.946) 4.006 4.295 ( 0.447 1.721 -0.989) 2.035 4.351 ( 0.046 6.723 -4.115) 7.882 4.650 ( -1.541 -2.515 9.601) 10.044 4.731 ( 2.152 -1.848 -0.950) 2.992 4.812 ( -8.400 2.828 -0.634) 8.886 4.902 ( -2.190 -2.156 3.459) 4.627 4.911 ( -3.688 -0.762 -1.736) 4.146 5.046 ( 7.722 -2.090 -4.766) 9.312 5.098 ( -1.514 6.126 -0.453) 6.327 5.220 ( -2.832 3.922 -2.567) 5.476 5.296 ( -3.052 -1.063 3.481) 4.750 5.438 ( 4.859 -2.801 -3.931) 6.849 5.904 ( -4.242 -3.678 2.336) 6.081 5.971 ( 4.740 -0.199 2.699) 5.458 6.081 ( 1.842 3.089 -2.162) 4.196 6.146 ( 5.837 -0.473 -0.502) 5.878 6.454 ( 5.772 0.435 -2.187) 6.187 6.483 ( -0.265 1.033 -3.022) 3.204 6.865 ( 12.011 -3.852 8.170) 15.029 7.072 ( -0.827 1.356 -1.544) 2.215 7.541 ( 3.128 -3.109 3.637) 5.717 7.720 ( -6.075 -3.469 1.200) 7.098 7.763 ( -1.144 -1.203 0.184) 1.670 7.891 ( 0.345 -5.641 3.567) 6.683 8.019 ( 0.028 2.096 -2.549) 3.300 8.223 ( 1.314 0.489 -0.739) 1.585 8.975 ( -6.020 -14.055 9.095) 17.791 9.264 ( -1.545 -23.022 15.017) 27.530 9.502 ( 5.557 -9.028 1.403) 10.694 9.832 ( -1.498 -9.265 -1.181) 9.460 10.003 ( -3.915 -2.459 10.253) 11.247 10.275 ( -3.454 5.314 -0.460) 6.354 10.927 ( 2.736 -0.360 0.191) 2.767 11.324 ( -9.968 25.283 -26.784) 38.158 12.197 ( 0.846 -2.768 3.677) 4.680 12.419 ( 6.643 -0.415 -5.948) 8.926 12.695 ( 8.607 -1.728 13.387) 16.008 13.046 ( -1.462 -5.622 0.541) 5.834 13.639 ( 2.119 -3.781 9.031) 10.017 14.011 ( -0.692 -0.915 -7.960) 8.042 14.090 ( -7.581 0.079 -0.847) 7.629 14.209 ( 19.929 4.847 -5.246) 21.170 14.877 ( -6.396 -3.154 5.963) 9.296 15.128 ( -6.227 4.691 -9.317) 12.149 17.774 ( -9.383 -3.282 3.538) 10.552 17.832 ( 2.261 -0.162 -0.379) 2.299 ======================= Grid point 127 (51/117) ======================= q-point: ( 0.20 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( 9.870 -0.000 1.952) 10.061 1.494 ( 7.745 -0.000 -5.414) 9.450 1.624 ( 11.811 -0.000 0.805) 11.839 1.762 ( -0.674 0.000 -7.327) 7.358 1.973 ( 4.806 -0.000 -4.839) 6.820 1.997 ( -6.743 0.000 5.221) 8.529 2.131 ( -1.362 0.000 7.776) 7.894 2.269 ( -0.992 0.000 -2.696) 2.872 2.329 ( -10.237 0.000 -1.942) 10.419 2.353 ( 0.621 -0.000 4.476) 4.519 2.561 ( 3.234 -0.000 3.120) 4.494 2.637 ( -4.584 0.000 0.325) 4.595 2.741 ( -2.048 0.000 3.141) 3.750 2.825 ( -2.633 0.000 -1.025) 2.825 2.922 ( 2.808 -0.000 4.497) 5.301 2.958 ( -3.140 0.000 2.207) 3.838 3.123 ( 1.214 -0.000 -1.465) 1.903 3.265 ( -1.272 0.000 0.856) 1.534 3.378 ( -4.583 0.000 -6.172) 7.687 3.487 ( -1.784 0.000 -10.142) 10.298 3.488 ( 1.049 -0.000 -3.074) 3.248 3.674 ( -0.927 0.000 4.355) 4.453 3.757 ( 3.818 -0.000 6.175) 7.260 3.877 ( -0.156 0.000 -1.436) 1.445 3.898 ( -3.151 0.000 0.831) 3.259 4.119 ( 17.941 -0.000 -17.103) 24.787 4.274 ( 2.468 -0.000 -0.756) 2.581 4.365 ( -0.375 0.000 2.408) 2.437 4.538 ( -3.443 0.000 -1.896) 3.931 4.616 ( 0.508 -0.000 3.965) 3.997 4.631 ( 1.925 -0.000 0.277) 1.945 4.874 ( -6.065 0.000 -0.681) 6.103 4.962 ( 1.590 -0.000 5.217) 5.454 5.167 ( -1.177 0.000 2.324) 2.605 5.402 ( 0.692 -0.000 -0.565) 0.894 5.416 ( -5.793 0.000 1.688) 6.034 5.749 ( 9.689 -0.000 2.678) 10.052 5.897 ( 12.802 -0.000 -4.806) 13.674 6.064 ( 5.033 -0.000 6.419) 8.157 6.219 ( 0.882 -0.000 -0.188) 0.902 6.356 ( -2.654 0.000 -0.473) 2.696 6.440 ( -5.014 0.000 -0.996) 5.113 6.764 ( 1.946 -0.000 -9.779) 9.970 6.974 ( -1.515 0.000 -7.250) 7.407 7.298 ( 7.666 -0.000 9.138) 11.928 7.414 ( -2.029 0.000 4.549) 4.981 7.668 ( 5.213 -0.000 -1.520) 5.431 7.917 ( -1.462 0.000 -4.655) 4.879 7.982 ( 1.627 -0.000 6.539) 6.738 8.214 ( 4.634 -0.000 -2.229) 5.143 8.392 ( 4.541 -0.000 -1.850) 4.903 8.647 ( 3.875 -0.000 1.800) 4.273 8.911 ( -2.878 0.000 -0.097) 2.880 9.283 ( -5.991 0.000 -8.021) 10.011 9.815 ( -6.005 0.000 9.973) 11.642 10.043 ( 4.019 -0.000 0.676) 4.076 10.286 ( 1.198 -0.000 -5.528) 5.656 10.653 ( 9.946 -0.000 3.037) 10.399 10.783 ( 6.302 -0.000 1.414) 6.459 10.887 ( -8.844 0.000 6.181) 10.790 12.392 ( -2.261 0.000 -16.917) 17.068 12.584 ( 2.654 -0.000 -2.594) 3.711 12.873 ( 0.151 -0.000 -6.252) 6.254 13.063 ( -3.524 0.000 17.119) 17.478 13.266 ( -3.421 0.000 5.452) 6.437 13.273 ( 2.764 -0.000 -0.406) 2.793 13.580 ( -5.036 0.000 -3.616) 6.200 13.710 ( 4.066 -0.000 4.155) 5.813 15.222 ( 3.332 -0.000 -2.392) 4.102 15.536 ( 1.892 -0.000 1.095) 2.186 17.744 ( -2.510 0.000 1.383) 2.865 17.773 ( 0.880 -0.000 -1.424) 1.674 ======================= Grid point 128 (52/117) ======================= q-point: ( 0.30 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.459 ( 7.441 -3.897 1.919) 8.616 1.522 ( -1.572 -1.428 -5.635) 6.022 1.757 ( 2.741 2.560 0.884) 3.854 1.835 ( -2.082 -2.793 5.517) 6.525 1.880 ( 4.233 -1.045 -3.384) 5.520 2.087 ( 5.640 -2.363 -3.628) 7.110 2.148 ( -4.575 0.283 -2.554) 5.248 2.185 ( 5.090 -0.050 3.878) 6.400 2.317 ( 1.534 0.522 -1.280) 2.065 2.320 ( -1.201 0.815 -1.060) 1.798 2.546 ( -2.934 3.184 -0.170) 4.333 2.618 ( -1.123 -3.508 1.148) 3.858 2.677 ( -3.227 3.067 2.356) 5.037 2.794 ( -1.691 -0.926 -0.544) 2.003 2.903 ( -0.822 1.152 3.081) 3.391 2.969 ( -1.315 -4.382 1.408) 4.787 3.107 ( -2.411 2.170 -1.161) 3.445 3.211 ( -3.849 0.319 1.329) 4.084 3.309 ( -1.801 0.706 -0.049) 1.936 3.481 ( -0.788 -5.219 -7.930) 9.526 3.525 ( 2.644 2.541 -1.826) 4.096 3.709 ( 6.415 3.880 3.250) 8.171 3.769 ( -3.843 1.328 7.427) 8.468 3.884 ( 4.234 1.283 -2.561) 5.112 3.908 ( 3.895 -0.411 -0.994) 4.041 4.285 ( -5.892 6.921 4.244) 10.031 4.294 ( 3.590 0.489 -9.834) 10.480 4.410 ( 9.998 -0.266 -3.198) 10.500 4.436 ( -5.058 -5.065 2.389) 7.546 4.626 ( -2.639 -0.307 0.616) 2.727 4.677 ( 2.575 2.042 -5.149) 6.108 4.796 ( -1.241 -0.190 -2.625) 2.910 5.005 ( 2.036 -1.040 5.672) 6.116 5.153 ( -1.864 -2.260 1.520) 3.300 5.302 ( -5.093 2.319 1.369) 5.761 5.407 ( -2.124 -3.349 0.398) 3.986 5.852 ( 0.857 1.398 5.291) 5.540 6.055 ( 3.893 0.258 -4.248) 5.768 6.133 ( 4.052 -0.091 4.167) 5.813 6.226 ( -1.390 -1.327 -0.931) 2.135 6.320 ( -1.614 1.079 1.484) 2.444 6.355 ( -1.692 -0.489 -4.099) 4.462 6.732 ( -4.459 0.223 -6.749) 8.092 6.907 ( -5.237 -0.673 -5.626) 7.716 7.381 ( 0.983 -0.406 11.511) 11.560 7.394 ( -0.886 0.219 6.020) 6.089 7.726 ( -0.144 -1.168 -1.694) 2.062 7.857 ( -3.188 2.488 -5.394) 6.742 8.024 ( 0.732 -3.283 4.268) 5.434 8.269 ( 2.054 0.718 -0.162) 2.182 8.447 ( 1.952 -0.300 -4.748) 5.142 8.688 ( 1.536 0.854 1.309) 2.191 8.847 ( -2.754 3.690 -1.756) 4.928 9.152 ( -10.040 -3.991 -5.764) 12.245 9.682 ( -10.023 0.329 9.827) 14.041 10.048 ( 1.880 10.371 -1.274) 10.617 10.332 ( 0.293 -9.386 -3.675) 10.085 10.587 ( -5.744 15.615 4.747) 17.302 10.857 ( -0.529 -3.991 5.331) 6.680 10.953 ( 2.914 -16.862 0.578) 17.122 12.257 ( -8.198 2.582 -19.225) 21.059 12.649 ( 4.016 -2.220 -3.588) 5.825 12.906 ( 4.577 7.103 3.007) 8.969 13.050 ( -1.177 -5.089 11.648) 12.766 13.220 ( -1.568 1.925 5.608) 6.133 13.294 ( -0.549 1.197 -1.879) 2.295 13.548 ( 3.009 1.162 -4.198) 5.294 13.807 ( 6.207 -0.321 3.682) 7.224 15.246 ( -0.715 -1.188 -3.139) 3.431 15.530 ( -2.837 -0.161 1.352) 3.147 17.716 ( -0.970 -0.253 0.264) 1.036 17.787 ( 0.947 0.188 -0.227) 0.992 ======================= Grid point 129 (53/117) ======================= q-point: (-0.60 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.506 ( -0.464 -1.723 -3.582) 4.002 1.554 ( -3.457 -3.761 0.836) 5.176 1.754 ( 2.832 0.344 -2.764) 3.972 1.812 ( 2.907 1.351 3.027) 4.409 2.064 ( 7.912 -3.070 2.526) 8.855 2.112 ( -0.024 -0.946 -2.484) 2.658 2.147 ( -1.008 0.358 3.595) 3.750 2.253 ( 2.717 -0.523 -0.757) 2.869 2.306 ( 1.569 4.372 -2.480) 5.266 2.373 ( 2.663 -0.329 0.516) 2.732 2.483 ( 2.068 2.155 -1.597) 3.387 2.574 ( -3.613 2.537 -2.350) 5.001 2.656 ( -0.101 -5.826 0.133) 5.829 2.784 ( -0.247 -1.624 -0.931) 1.889 2.906 ( -0.414 -2.046 1.083) 2.352 2.973 ( -1.720 -1.960 -0.835) 2.738 3.051 ( -1.192 -0.228 0.417) 1.283 3.169 ( -2.194 -3.248 0.673) 3.977 3.287 ( 0.349 2.356 4.550) 5.136 3.482 ( -3.539 -0.067 1.552) 3.865 3.525 ( 1.356 2.507 -4.402) 5.245 3.691 ( -2.564 2.007 5.095) 6.047 3.793 ( 6.326 4.058 0.770) 7.555 3.943 ( 2.906 3.290 -3.716) 5.752 3.997 ( 3.236 2.339 -1.144) 4.153 4.094 ( -5.401 5.655 5.471) 9.544 4.254 ( -4.986 1.800 -4.627) 7.036 4.429 ( -3.816 -3.569 1.621) 5.471 4.502 ( 2.430 -0.055 1.677) 2.953 4.602 ( 0.769 -1.245 -2.675) 3.049 4.685 ( 2.193 3.160 -10.302) 10.997 4.810 ( 1.490 -1.292 -2.826) 3.446 5.052 ( 0.673 -1.729 5.650) 5.947 5.136 ( -2.871 -2.852 0.082) 4.048 5.234 ( -1.320 -0.076 2.552) 2.875 5.397 ( -3.335 -5.008 1.012) 6.101 5.763 ( -8.371 2.862 3.979) 9.700 5.965 ( -10.978 0.765 -3.888) 11.671 6.189 ( -2.894 -0.814 -1.212) 3.241 6.223 ( 2.123 -1.059 7.060) 7.448 6.295 ( 0.446 0.619 1.092) 1.332 6.412 ( 5.419 -0.864 -7.069) 8.949 6.605 ( -8.309 0.649 -4.199) 9.332 6.810 ( -7.098 -2.889 -5.239) 9.282 7.348 ( -4.063 2.005 6.705) 8.092 7.398 ( -2.268 -2.041 11.963) 12.346 7.658 ( -8.848 -1.474 1.137) 9.041 7.793 ( -1.284 0.252 -7.771) 7.880 8.052 ( -2.084 -3.671 2.731) 5.027 8.258 ( -2.364 2.185 2.399) 4.015 8.441 ( -1.067 2.751 -5.632) 6.358 8.681 ( -3.894 3.125 -7.947) 9.385 8.748 ( -2.650 0.765 2.357) 3.628 9.027 ( -10.145 -9.402 -2.553) 14.066 9.511 ( -9.985 -0.012 8.113) 12.865 9.947 ( -2.732 9.546 -1.437) 10.032 10.334 ( -10.557 6.756 4.997) 13.493 10.433 ( -1.178 -12.506 1.184) 12.617 10.851 ( -2.496 0.546 1.492) 2.959 11.144 ( 2.922 -14.983 -0.970) 15.296 12.073 ( -7.963 1.990 -14.252) 16.446 12.737 ( 3.726 -1.711 -3.928) 5.678 12.892 ( 1.706 7.079 8.762) 11.393 13.064 ( -0.785 5.228 1.121) 5.404 13.236 ( 3.716 -2.278 5.922) 7.353 13.271 ( -0.236 -1.516 -1.732) 2.314 13.630 ( 8.052 2.363 -2.176) 8.669 13.925 ( 7.426 1.443 2.902) 8.102 15.217 ( -3.895 -2.506 -4.020) 6.133 15.449 ( -7.185 -1.002 1.826) 7.481 17.714 ( 0.435 -0.289 -0.687) 0.863 17.801 ( 0.845 0.141 0.763) 1.147 ======================= Grid point 130 (54/117) ======================= q-point: (-0.50 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.440 ( -7.553 1.962 0.451) 7.817 1.542 ( 2.299 0.512 -7.712) 8.063 1.801 ( 0.520 3.051 0.780) 3.192 1.867 ( 4.197 2.422 4.585) 6.671 2.063 ( -2.321 1.140 1.942) 3.234 2.176 ( 2.030 2.014 -2.234) 3.629 2.184 ( 1.797 -1.799 2.525) 3.584 2.239 ( 1.290 0.387 -3.350) 3.611 2.307 ( 2.482 -0.732 1.523) 3.003 2.425 ( 2.992 2.796 -2.105) 4.605 2.517 ( 0.895 -3.300 1.816) 3.872 2.590 ( 6.795 -1.598 -3.188) 7.674 2.737 ( 2.767 -3.488 -0.138) 4.454 2.827 ( 1.622 -5.977 -1.339) 6.336 2.905 ( -0.586 -0.451 -1.175) 1.388 2.964 ( -1.012 -4.513 0.272) 4.633 3.071 ( 0.456 -2.859 2.272) 3.681 3.191 ( 0.406 -4.564 -1.355) 4.779 3.266 ( -2.720 7.518 5.179) 9.526 3.369 ( -2.141 7.715 8.552) 11.715 3.518 ( -0.772 -0.224 -1.945) 2.105 3.656 ( -0.000 1.813 3.108) 3.598 3.774 ( -8.820 7.146 1.956) 11.518 3.848 ( 2.641 5.409 -4.208) 7.344 3.995 ( -4.081 2.700 -4.912) 6.933 4.025 ( 0.334 2.881 -4.167) 5.077 4.232 ( 3.759 -2.324 -2.098) 4.892 4.400 ( -2.170 -2.857 3.725) 5.172 4.490 ( -4.130 0.263 0.526) 4.172 4.635 ( 1.370 1.995 -8.394) 8.736 4.699 ( 4.069 -0.338 0.289) 4.093 4.857 ( 2.015 -2.557 -3.642) 4.884 5.049 ( -2.333 -1.477 4.021) 4.877 5.134 ( -0.742 -3.106 1.535) 3.543 5.238 ( -0.951 -2.373 3.005) 3.946 5.378 ( -4.623 -5.643 0.802) 7.339 5.551 ( -12.867 3.174 1.042) 13.294 5.739 ( -13.719 -0.530 -3.789) 14.243 6.118 ( -5.618 1.431 4.261) 7.195 6.182 ( -5.740 -1.303 4.542) 7.435 6.336 ( -1.117 -0.262 -1.548) 1.927 6.430 ( -3.131 -1.458 -7.650) 8.393 6.523 ( 1.475 0.837 -2.272) 2.835 6.703 ( -8.548 -4.336 -5.381) 10.992 7.226 ( -8.219 2.702 6.820) 11.017 7.367 ( -5.080 -2.492 9.425) 10.993 7.494 ( -10.905 -2.216 2.322) 11.368 7.776 ( -1.764 -2.670 -5.520) 6.381 8.013 ( -6.171 -3.030 1.766) 7.098 8.156 ( -6.093 4.683 4.730) 9.024 8.342 ( -6.556 4.127 -7.304) 10.647 8.495 ( -9.244 1.594 -9.028) 13.019 8.774 ( 0.804 -4.044 1.641) 4.437 8.952 ( -8.759 -9.034 1.451) 12.667 9.382 ( -5.679 -0.719 4.025) 6.998 9.804 ( -5.829 4.822 1.167) 7.654 10.131 ( -9.819 -0.371 6.629) 11.853 10.516 ( -3.498 -14.203 -1.063) 14.666 10.778 ( -2.787 4.497 1.087) 5.401 11.314 ( 2.846 -13.173 -5.568) 14.582 11.938 ( -4.890 0.504 -6.262) 7.961 12.734 ( -1.229 6.860 -1.961) 7.239 12.911 ( 3.973 6.473 8.011) 11.039 12.991 ( -0.655 0.951 -1.736) 2.085 13.271 ( 0.670 -1.027 2.601) 2.876 13.401 ( 9.523 -2.936 -1.464) 10.072 13.767 ( 10.163 2.345 0.844) 10.464 14.035 ( 7.662 3.522 1.598) 8.583 15.156 ( -5.542 -3.572 -5.048) 8.305 15.311 ( -10.490 -2.215 2.472) 11.002 17.730 ( 1.289 -0.025 -1.431) 1.926 17.813 ( 0.263 -0.364 1.586) 1.649 ======================= Grid point 131 (55/117) ======================= q-point: (-0.40 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( -7.877 9.518 1.785) 12.483 1.532 ( -0.965 7.291 -4.972) 8.878 1.675 ( -6.503 9.363 2.735) 11.724 1.884 ( 0.429 4.120 -1.827) 4.527 2.076 ( 4.827 3.149 2.157) 6.154 2.153 ( 0.722 -1.391 -2.159) 2.668 2.264 ( 4.967 -2.568 -0.041) 5.592 2.304 ( 1.044 -2.475 -1.050) 2.884 2.387 ( 5.519 -3.299 -0.047) 6.430 2.449 ( 3.108 -0.102 -1.565) 3.481 2.602 ( 2.376 3.882 5.859) 7.419 2.702 ( 1.423 -1.197 -0.730) 1.998 2.755 ( 0.547 2.883 2.523) 3.870 2.883 ( -2.438 -7.352 -0.005) 7.745 2.932 ( 2.110 -2.644 1.384) 3.655 3.025 ( -4.557 8.489 4.642) 10.694 3.046 ( 2.888 -6.241 0.735) 6.916 3.112 ( -0.370 -3.594 2.597) 4.449 3.262 ( 3.512 -2.825 -1.213) 4.668 3.376 ( 4.638 4.240 0.850) 6.341 3.495 ( -2.345 -0.344 1.962) 3.077 3.597 ( -6.365 3.531 -4.638) 8.631 3.680 ( 2.258 -1.481 0.938) 2.859 3.729 ( -5.884 6.493 -11.556) 14.503 3.933 ( -1.310 0.586 -0.249) 1.457 4.029 ( 1.518 2.848 -1.825) 3.708 4.315 ( 1.920 -3.028 -2.681) 4.477 4.378 ( -3.487 -1.275 -0.119) 3.715 4.440 ( 1.122 1.550 2.440) 3.101 4.625 ( 1.174 -0.344 -1.257) 1.754 4.785 ( 2.889 -1.306 1.082) 3.350 4.896 ( -0.181 -3.245 -4.691) 5.707 5.040 ( -0.960 -1.835 3.391) 3.974 5.136 ( -3.351 -1.907 2.012) 4.349 5.211 ( -6.628 -4.036 4.544) 8.992 5.317 ( -9.515 -0.541 1.242) 9.611 5.344 ( -3.268 -1.908 -5.211) 6.440 5.519 ( -12.098 -1.809 -2.293) 12.446 5.984 ( -8.533 1.301 11.582) 14.445 6.114 ( -2.555 0.280 -4.096) 4.836 6.225 ( -8.873 -1.878 -3.054) 9.570 6.400 ( -5.367 -0.723 -3.788) 6.609 6.519 ( -0.711 1.414 -4.886) 5.136 6.589 ( -7.145 -3.369 -3.226) 8.533 7.050 ( -9.750 2.719 7.372) 12.522 7.276 ( -7.363 -0.467 2.071) 7.663 7.379 ( -6.427 -5.428 6.640) 10.717 7.753 ( -4.556 -5.187 -0.818) 6.952 7.907 ( -8.672 -2.603 -0.832) 9.092 7.992 ( -7.502 5.500 3.894) 10.084 8.170 ( -8.465 -0.553 -7.568) 11.368 8.360 ( -3.886 3.268 -6.649) 8.366 8.831 ( -0.395 -6.339 4.234) 7.633 8.877 ( -7.592 -6.634 4.481) 11.033 9.338 ( -0.893 -0.916 -1.754) 2.171 9.694 ( -5.094 -1.703 2.933) 6.119 10.015 ( -7.591 -4.817 8.287) 12.227 10.531 ( -6.930 -9.734 -11.867) 16.841 10.726 ( 0.919 2.558 10.278) 10.632 11.456 ( 1.765 -11.605 -13.852) 18.157 11.895 ( 0.041 -1.125 3.512) 3.688 12.620 ( -2.969 8.228 -4.579) 9.874 12.852 ( 0.640 11.756 9.518) 15.140 13.056 ( 3.128 -2.383 -1.570) 4.234 13.314 ( 2.455 -3.163 3.941) 5.618 13.611 ( 12.897 -1.649 -4.604) 13.793 13.931 ( 10.348 1.664 3.258) 10.975 14.125 ( 6.617 4.426 -0.017) 7.961 15.078 ( -7.405 -3.196 -5.764) 9.913 15.155 ( -9.561 -4.365 2.759) 10.866 17.754 ( 1.728 0.281 -1.829) 2.532 17.817 ( -0.928 -1.280 2.204) 2.712 ======================= Grid point 132 (56/117) ======================= q-point: (-0.30 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.035 ( -5.399 13.920 8.668) 17.264 1.317 ( -8.798 17.493 10.594) 22.263 1.542 ( -0.457 6.682 -10.925) 12.814 1.816 ( -0.423 8.338 -11.748) 14.413 2.116 ( 3.845 4.680 4.315) 7.436 2.238 ( 1.333 -1.463 2.051) 2.850 2.290 ( -8.678 20.640 14.675) 26.771 2.360 ( 4.701 -2.301 0.871) 5.306 2.380 ( 2.115 1.172 -1.286) 2.739 2.449 ( 1.239 1.828 2.339) 3.216 2.605 ( 9.296 -5.396 -3.558) 11.322 2.731 ( -0.322 -4.379 -0.285) 4.400 2.809 ( 1.212 -1.009 2.245) 2.743 2.850 ( -3.608 -2.089 0.704) 4.228 3.011 ( 0.032 -9.442 1.208) 9.519 3.061 ( 2.505 -6.895 1.686) 7.527 3.094 ( -0.762 -2.828 -1.187) 3.160 3.199 ( 5.464 -1.960 -1.122) 5.912 3.341 ( 1.742 -3.508 -0.159) 3.920 3.419 ( 1.983 1.126 -6.027) 6.444 3.442 ( -0.248 5.317 -9.066) 10.513 3.485 ( -1.446 2.976 -0.145) 3.312 3.606 ( -3.574 -0.807 -6.371) 7.349 3.720 ( -1.439 -1.687 1.326) 2.583 3.897 ( -0.881 0.585 2.034) 2.293 4.022 ( -0.012 2.100 -1.056) 2.351 4.298 ( -2.823 -2.003 1.911) 3.954 4.408 ( 3.747 -0.569 -6.293) 7.346 4.475 ( 3.716 -0.243 4.087) 5.529 4.688 ( 2.680 -3.008 3.586) 5.393 4.805 ( -0.423 -0.676 -2.688) 2.804 4.916 ( -0.003 -4.160 -0.638) 4.209 4.980 ( -8.609 -1.814 0.634) 8.821 5.025 ( -8.619 -1.075 3.735) 9.455 5.189 ( -0.315 -2.303 -0.046) 2.325 5.254 ( 0.406 -2.845 -1.571) 3.276 5.318 ( -1.270 -0.740 -5.332) 5.531 5.366 ( -7.466 -2.083 0.192) 7.754 5.868 ( -4.274 0.275 10.538) 11.375 6.041 ( -6.680 0.199 -2.349) 7.084 6.130 ( -1.573 -0.102 -1.472) 2.157 6.230 ( -11.461 -0.245 -3.973) 12.132 6.476 ( -1.008 2.590 -5.255) 5.945 6.526 ( -2.870 -1.026 -1.847) 3.564 6.885 ( -7.082 2.156 9.091) 11.724 7.159 ( -6.315 -0.285 0.029) 6.322 7.374 ( -0.431 -5.522 4.880) 7.382 7.718 ( -7.364 -9.373 1.960) 12.080 7.789 ( -5.250 -0.878 -1.406) 5.505 7.833 ( -6.985 1.672 2.309) 7.544 8.076 ( -1.641 1.280 -5.338) 5.729 8.279 ( -1.535 3.252 -5.041) 6.193 8.790 ( -8.048 -6.905 12.259) 16.209 8.924 ( 2.073 -7.014 1.650) 7.498 9.353 ( 2.027 -1.014 -4.217) 4.788 9.662 ( -3.460 -6.316 1.448) 7.346 9.960 ( -5.647 -5.899 10.219) 13.081 10.454 ( -4.909 -0.841 -12.911) 13.838 10.773 ( 1.700 -4.136 11.532) 12.369 11.531 ( -1.401 -8.291 -21.575) 23.156 11.974 ( 5.314 -4.185 9.560) 11.711 12.500 ( -2.584 6.230 -6.303) 9.232 12.777 ( 1.662 11.887 11.497) 16.620 13.079 ( -0.396 1.817 -0.639) 1.966 13.428 ( 4.815 -5.926 6.177) 9.821 13.850 ( 13.010 -1.710 -7.725) 15.227 14.081 ( 7.357 0.945 3.178) 8.070 14.174 ( 3.245 3.873 -1.413) 5.246 14.929 ( -10.734 -3.164 1.384) 11.276 15.113 ( -1.396 -5.149 -4.873) 7.225 17.777 ( 0.441 -0.353 0.071) 0.570 17.807 ( -1.356 -1.368 0.972) 2.157 ======================= Grid point 133 (57/117) ======================= q-point: (-0.20 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.858 ( -1.769 14.793 14.631) 20.881 1.058 ( -1.110 20.306 14.605) 25.037 1.499 ( 2.844 5.240 -13.297) 14.572 1.728 ( 1.816 9.682 -16.539) 19.251 1.888 ( -1.458 35.747 21.095) 41.532 2.134 ( -0.534 2.453 7.522) 7.930 2.294 ( -0.889 -2.879 2.371) 3.834 2.409 ( 0.021 -1.109 -1.046) 1.525 2.449 ( 0.660 -2.920 -0.378) 3.017 2.501 ( 1.951 -4.224 5.250) 7.015 2.718 ( -4.343 -3.355 -2.650) 6.094 2.750 ( 1.904 -2.136 -1.906) 3.438 2.818 ( 0.875 1.971 -0.674) 2.259 2.850 ( 0.339 -6.154 -0.125) 6.164 3.054 ( -2.134 -0.818 -8.002) 8.322 3.091 ( 0.579 -2.642 0.101) 2.707 3.142 ( -0.830 -5.718 -5.681) 8.103 3.275 ( -0.114 0.183 -0.564) 0.603 3.357 ( -0.705 -4.470 -4.539) 6.409 3.399 ( -0.843 -2.272 0.096) 2.426 3.447 ( 0.936 1.960 -2.955) 3.667 3.465 ( 1.264 -1.582 -3.474) 4.022 3.633 ( -0.317 -0.786 -0.915) 1.247 3.671 ( 1.477 -1.619 0.485) 2.244 3.922 ( 1.919 -2.102 4.141) 5.025 3.990 ( -1.607 1.147 -0.883) 2.163 4.293 ( -0.729 -1.732 1.319) 2.296 4.425 ( -0.125 1.835 -4.700) 5.048 4.600 ( 2.699 -2.523 7.541) 8.397 4.689 ( -0.239 -3.201 0.912) 3.337 4.838 ( -7.176 -0.908 -1.651) 7.420 4.871 ( -5.871 -0.664 3.277) 6.757 4.900 ( 3.643 -1.451 -2.495) 4.648 5.000 ( 5.983 -2.747 -3.185) 7.314 5.183 ( 0.470 2.722 -0.982) 2.932 5.266 ( -3.163 -1.072 0.119) 3.342 5.278 ( -1.014 1.446 -1.223) 2.148 5.370 ( 3.312 -4.520 -3.928) 6.843 5.848 ( -4.741 -2.386 5.839) 7.891 5.964 ( 3.899 -0.839 3.830) 5.529 6.126 ( 2.065 1.958 -3.588) 4.580 6.144 ( 3.968 0.327 0.043) 3.982 6.469 ( 3.682 1.046 -3.483) 5.175 6.496 ( -0.302 0.504 -3.928) 3.972 6.826 ( 1.779 -0.636 10.284) 10.456 7.082 ( -1.898 -0.160 0.223) 1.918 7.470 ( 5.687 -4.496 2.293) 7.604 7.651 ( -7.575 -4.718 0.977) 8.978 7.702 ( -6.626 -5.566 3.706) 9.414 7.828 ( 5.240 -0.729 1.030) 5.389 8.061 ( 1.972 2.820 -4.381) 5.571 8.242 ( 0.604 1.760 -4.116) 4.517 8.748 ( -5.437 -7.598 14.772) 17.479 9.040 ( 2.893 -8.694 5.221) 10.545 9.424 ( 5.225 -2.575 -3.858) 6.986 9.674 ( -2.593 -8.061 -1.957) 8.691 9.940 ( -3.694 -4.903 11.444) 12.987 10.364 ( -2.829 3.517 -8.247) 9.401 10.867 ( 2.730 -5.598 8.499) 10.537 11.503 ( -4.259 -0.724 -23.070) 23.471 12.125 ( 4.377 -5.256 6.779) 9.630 12.427 ( -0.129 1.903 -6.983) 7.238 12.745 ( 4.160 7.768 13.701) 16.290 13.034 ( -1.795 2.724 0.176) 3.267 13.558 ( 2.442 -5.869 8.300) 10.455 13.986 ( -1.488 -1.327 -7.861) 8.110 14.083 ( -6.559 -0.769 -0.904) 6.665 14.261 ( 10.491 1.880 -4.130) 11.430 14.822 ( -5.271 -3.685 6.098) 8.863 15.142 ( 0.366 -2.252 -8.839) 9.129 17.741 ( -4.273 -0.847 3.227) 5.422 17.828 ( 1.994 -0.216 -0.925) 2.209 ======================= Grid point 134 (58/117) ======================= q-point: (-0.10 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.791 ( 9.019 13.331 11.078) 19.540 0.972 ( 8.368 18.916 13.149) 24.510 1.497 ( 1.924 3.710 -15.279) 15.840 1.691 ( 5.954 9.833 -17.039) 20.554 1.717 ( 12.427 27.378 28.343) 41.319 2.079 ( -3.346 2.407 9.092) 9.982 2.262 ( -4.774 -1.283 0.441) 4.963 2.401 ( -1.863 -1.424 1.517) 2.793 2.489 ( -2.411 -4.378 3.811) 6.286 2.519 ( -1.503 -4.563 1.943) 5.182 2.630 ( -8.611 -3.465 -3.309) 9.854 2.777 ( -0.425 -0.913 -2.609) 2.796 2.816 ( 0.529 1.709 -1.223) 2.167 2.904 ( -0.361 -4.003 -0.324) 4.032 2.975 ( -4.213 -0.755 -5.020) 6.597 3.128 ( -0.160 1.391 -2.862) 3.186 3.140 ( 4.913 2.994 -12.581) 13.834 3.261 ( 0.649 -1.040 -5.763) 5.892 3.350 ( -7.299 -1.429 1.392) 7.567 3.409 ( 1.139 -2.800 -3.749) 4.816 3.491 ( 0.668 -6.741 1.384) 6.914 3.518 ( -0.437 -7.907 0.280) 7.924 3.608 ( 3.686 -0.720 -4.324) 5.728 3.802 ( 5.204 -3.507 -0.466) 6.293 3.936 ( -3.883 1.265 -0.243) 4.091 3.981 ( 1.195 -2.476 4.963) 5.674 4.297 ( -0.216 -1.389 -0.389) 1.458 4.374 ( -2.387 3.929 -4.150) 6.193 4.523 ( -6.361 0.970 4.567) 7.891 4.608 ( -10.202 3.249 2.416) 10.976 4.828 ( -0.130 -1.852 3.312) 3.797 4.882 ( 8.590 -2.702 0.984) 9.058 5.002 ( 3.694 1.667 4.797) 6.280 5.124 ( 4.873 0.859 -4.108) 6.431 5.209 ( 4.393 1.126 -3.998) 6.046 5.257 ( 2.358 -2.614 2.294) 4.202 5.274 ( 5.703 3.694 -3.071) 7.456 5.452 ( 1.925 -4.710 0.184) 5.092 5.783 ( -3.031 -1.426 4.417) 5.544 6.143 ( 3.789 1.890 -2.067) 4.712 6.202 ( 15.645 -1.183 3.303) 16.033 6.281 ( 10.048 -1.018 -6.622) 12.077 6.503 ( 2.448 1.092 -6.345) 6.888 6.534 ( 3.047 0.298 -0.902) 3.192 6.964 ( 3.796 -3.007 -1.892) 5.199 7.246 ( 20.342 -11.425 0.090) 23.331 7.559 ( -5.207 -2.615 5.798) 8.220 7.592 ( 1.147 -1.987 4.720) 5.248 7.743 ( 6.454 -6.163 -1.077) 8.989 7.957 ( 6.852 -0.535 0.549) 6.895 8.072 ( 3.303 3.075 -3.222) 5.545 8.275 ( 4.711 -0.648 -2.927) 5.584 8.787 ( -1.043 -11.328 12.610) 16.983 9.186 ( 3.660 -9.963 9.470) 14.225 9.573 ( 7.678 -6.486 -1.555) 10.170 9.728 ( 0.927 -9.805 -3.558) 10.471 9.939 ( -1.711 -2.845 11.884) 12.339 10.282 ( -1.323 5.008 -3.879) 6.471 10.961 ( 2.390 -1.994 5.452) 6.278 11.335 ( -5.701 13.838 -18.582) 23.860 12.199 ( 1.635 -1.459 3.262) 3.930 12.449 ( 1.455 -3.320 -6.699) 7.616 12.831 ( 6.597 -2.100 9.040) 11.387 12.993 ( -1.031 0.041 1.222) 1.599 13.617 ( -1.779 -4.560 7.992) 9.372 13.783 ( -16.711 1.424 -5.481) 17.645 13.981 ( -6.610 0.320 -7.115) 9.717 14.248 ( -17.682 1.814 5.172) 18.512 14.830 ( 7.127 2.225 -0.688) 7.498 15.173 ( 6.036 1.233 -1.142) 6.265 17.701 ( 0.128 0.340 0.388) 0.532 17.854 ( 0.267 -0.494 1.305) 1.421 ======================= Grid point 138 (59/117) ======================= q-point: ( 0.30 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( -2.268 0.000 3.025) 3.780 1.501 ( 1.221 -0.000 -5.268) 5.408 1.762 ( 1.508 -0.000 -2.141) 2.619 1.818 ( 3.481 -0.000 3.020) 4.608 2.036 ( 8.543 -0.000 2.234) 8.830 2.105 ( 0.249 -0.000 -2.204) 2.218 2.146 ( 0.675 -0.000 2.631) 2.716 2.248 ( 1.654 -0.000 -1.671) 2.351 2.346 ( 4.666 -0.000 -4.378) 6.398 2.366 ( 1.828 -0.000 1.443) 2.329 2.531 ( 1.122 -0.000 -0.089) 1.126 2.549 ( -3.606 0.000 -0.778) 3.689 2.648 ( -3.015 0.000 0.482) 3.053 2.754 ( -1.655 0.000 -1.008) 1.938 2.911 ( 0.178 -0.000 0.816) 0.835 2.930 ( 0.208 -0.000 0.980) 1.002 3.054 ( -3.574 0.000 -2.481) 4.351 3.133 ( -3.566 0.000 -0.982) 3.699 3.327 ( 0.934 -0.000 9.694) 9.739 3.435 ( -1.257 0.000 -7.033) 7.145 3.581 ( 2.738 -0.000 -2.229) 3.530 3.697 ( -4.635 0.000 5.616) 7.282 3.832 ( 4.746 -0.000 1.654) 5.026 3.973 ( 4.882 -0.000 -3.624) 6.080 4.012 ( 7.324 -0.000 -1.523) 7.481 4.220 ( -6.917 0.000 -0.726) 6.955 4.234 ( -6.991 0.000 9.346) 11.671 4.384 ( -0.437 0.000 -3.230) 3.259 4.528 ( -6.187 0.000 -0.625) 6.219 4.556 ( 7.068 -0.000 -2.454) 7.482 4.728 ( 1.384 -0.000 -9.253) 9.355 4.795 ( 1.222 -0.000 -2.732) 2.993 5.036 ( 1.243 -0.000 6.332) 6.453 5.100 ( -3.195 0.000 0.203) 3.201 5.242 ( -2.275 0.000 -0.624) 2.359 5.342 ( -3.905 0.000 3.251) 5.081 5.792 ( -8.278 0.000 4.073) 9.226 5.972 ( -11.700 0.000 -3.896) 12.332 6.177 ( -2.282 0.000 -2.363) 3.285 6.215 ( 2.965 -0.000 7.065) 7.662 6.303 ( -0.871 0.000 2.251) 2.413 6.402 ( 5.907 -0.000 -8.121) 10.042 6.615 ( -8.151 0.000 -2.843) 8.632 6.779 ( -8.122 0.000 -5.646) 9.892 7.368 ( -3.665 0.000 6.592) 7.543 7.378 ( -2.530 0.000 12.047) 12.309 7.643 ( -8.088 0.000 1.005) 8.151 7.799 ( -3.482 0.000 -8.542) 9.224 8.012 ( -1.400 0.000 4.822) 5.021 8.280 ( -1.589 0.000 0.953) 1.853 8.462 ( 0.532 -0.000 -8.313) 8.330 8.702 ( -0.382 0.000 1.395) 1.447 8.827 ( -2.030 0.000 -1.771) 2.694 8.881 ( -17.192 0.000 -5.499) 18.050 9.510 ( -10.554 0.000 10.455) 14.855 10.145 ( 0.623 -0.000 0.383) 0.731 10.200 ( -6.032 0.000 -6.588) 8.932 10.423 ( -17.344 0.000 8.535) 19.331 10.895 ( 0.188 -0.000 -0.819) 0.840 10.946 ( 6.906 -0.000 2.118) 7.223 12.097 ( -8.621 0.000 -15.109) 17.396 12.712 ( 4.894 -0.000 -3.105) 5.796 12.985 ( -1.862 0.000 15.505) 15.616 13.099 ( 8.857 -0.000 -4.391) 9.886 13.229 ( 1.305 -0.000 5.669) 5.818 13.237 ( -4.705 0.000 -2.250) 5.215 13.655 ( 8.032 -0.000 -3.079) 8.602 13.938 ( 8.311 -0.000 3.380) 8.972 15.193 ( -4.027 0.000 -4.545) 6.072 15.438 ( -7.702 0.000 2.152) 7.997 17.711 ( 0.556 -0.000 -0.802) 0.975 17.802 ( 0.686 -0.000 0.873) 1.110 ======================= Grid point 139 (60/117) ======================= q-point: (-0.60 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( -3.126 -0.500 1.697) 3.592 1.547 ( 4.262 0.048 -5.685) 7.105 1.832 ( 4.991 1.048 -1.611) 5.349 1.887 ( 2.987 -0.152 4.045) 5.031 2.099 ( -0.895 2.950 0.912) 3.215 2.149 ( 3.280 -1.087 4.285) 5.504 2.159 ( 3.798 -2.872 -2.701) 5.475 2.287 ( 1.098 0.148 -2.882) 3.088 2.309 ( -4.930 4.164 2.371) 6.875 2.404 ( 1.451 -5.298 0.616) 5.528 2.524 ( -2.008 3.554 -3.597) 5.441 2.587 ( 5.489 1.719 -2.417) 6.239 2.667 ( 7.463 -4.113 0.260) 8.526 2.743 ( -1.271 -3.316 -0.254) 3.560 2.904 ( 0.329 1.557 -0.583) 1.695 2.954 ( 0.611 0.069 -0.781) 0.994 3.011 ( -1.747 -2.642 0.732) 3.251 3.122 ( 1.157 -2.707 -1.858) 3.481 3.347 ( 1.492 3.118 6.176) 7.077 3.401 ( -3.285 -1.946 2.047) 4.332 3.585 ( 0.197 4.815 -0.749) 4.877 3.657 ( -1.650 -1.596 2.508) 3.399 3.869 ( -1.248 0.472 1.166) 1.772 3.981 ( -2.256 8.863 -0.726) 9.174 4.058 ( 1.400 3.576 -0.842) 3.931 4.118 ( -2.601 7.428 -0.226) 7.874 4.168 ( -0.928 -5.090 -1.942) 5.526 4.343 ( -3.880 -3.724 2.444) 5.907 4.458 ( -2.675 -2.426 -0.502) 3.646 4.670 ( 5.066 0.432 -4.687) 6.916 4.706 ( -0.350 1.558 -6.309) 6.508 4.815 ( 0.449 -1.561 -2.263) 2.785 5.036 ( -2.119 0.275 1.961) 2.901 5.071 ( -1.284 -3.371 2.974) 4.675 5.222 ( -0.870 0.470 1.048) 1.441 5.284 ( -4.904 -4.121 3.002) 7.074 5.602 ( -12.706 2.025 0.723) 12.887 5.726 ( -15.331 -0.683 -3.702) 15.787 6.134 ( -2.984 0.423 -1.296) 3.280 6.163 ( -7.568 -0.676 9.405) 12.090 6.345 ( 1.437 1.031 -0.566) 1.857 6.400 ( -6.424 -1.603 -7.992) 10.378 6.540 ( 2.184 0.866 -1.620) 2.854 6.634 ( -9.245 -2.717 -4.609) 10.682 7.266 ( -7.995 1.500 6.683) 10.528 7.326 ( -5.434 -1.466 10.701) 12.090 7.479 ( -10.397 -0.248 1.136) 10.461 7.738 ( -3.628 -1.253 -6.375) 7.441 7.966 ( -5.597 -1.606 4.392) 7.294 8.217 ( -4.628 1.842 2.502) 5.574 8.428 ( -4.423 4.142 -8.525) 10.459 8.511 ( -15.798 0.351 -10.574) 19.013 8.727 ( -0.163 -1.229 3.175) 3.409 8.818 ( -3.583 -5.285 -0.751) 6.429 9.366 ( -7.241 -0.673 10.042) 12.399 9.968 ( -6.286 12.844 -2.662) 14.545 10.129 ( -15.277 -0.066 7.594) 17.060 10.243 ( -5.200 -15.819 -1.384) 16.709 10.861 ( -0.363 4.650 -1.741) 4.978 11.101 ( 4.811 -9.151 -2.675) 10.679 11.957 ( -5.298 0.989 -7.013) 8.845 12.795 ( 3.836 0.030 -1.466) 4.107 12.962 ( 0.021 3.064 8.198) 8.752 13.107 ( -1.472 7.582 0.764) 7.761 13.229 ( -0.092 -4.667 -0.935) 4.761 13.343 ( 10.294 -2.210 0.367) 10.535 13.798 ( 9.306 0.998 -0.355) 9.366 14.082 ( 8.520 1.502 2.236) 8.935 15.108 ( -5.663 -1.509 -6.056) 8.428 15.279 ( -11.480 -1.140 2.779) 11.866 17.729 ( 1.524 -0.046 -1.623) 2.227 17.809 ( -0.158 -0.101 1.814) 1.823 ======================= Grid point 140 (61/117) ======================= q-point: (-0.50 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.388 ( -2.305 5.474 2.204) 6.335 1.617 ( 5.074 2.814 -6.680) 8.849 1.825 ( -3.197 5.592 3.386) 7.277 1.914 ( 0.401 0.869 2.112) 2.319 2.120 ( 5.405 4.001 2.873) 7.313 2.171 ( -0.299 -0.507 1.367) 1.489 2.226 ( 2.168 -0.499 -1.283) 2.568 2.264 ( 0.009 -1.416 -1.678) 2.196 2.320 ( 4.134 -4.914 -2.422) 6.863 2.443 ( -1.723 1.164 -3.781) 4.315 2.503 ( 1.915 -7.789 1.799) 8.220 2.697 ( 5.661 -1.004 -0.180) 5.752 2.746 ( -1.157 -6.433 -0.587) 6.563 2.814 ( 2.266 1.983 -1.022) 3.179 2.938 ( 3.397 -0.076 1.047) 3.556 2.955 ( 3.757 0.326 0.118) 3.772 3.033 ( 0.196 -4.421 4.086) 6.023 3.187 ( 1.162 -1.046 -1.524) 2.183 3.248 ( -5.218 5.347 0.763) 7.510 3.426 ( 2.386 0.034 8.318) 8.653 3.534 ( -0.505 4.861 -1.144) 5.019 3.644 ( -0.516 0.018 0.940) 1.072 3.741 ( -3.738 10.106 0.822) 10.807 3.898 ( -6.852 11.333 -7.348) 15.145 3.940 ( 0.432 0.729 1.253) 1.512 4.078 ( 1.296 2.516 -3.327) 4.368 4.236 ( 0.948 -5.953 -3.481) 6.961 4.321 ( -4.268 -4.914 3.961) 7.619 4.465 ( 1.676 -0.092 1.008) 1.958 4.631 ( -1.570 1.566 -6.229) 6.612 4.761 ( 1.366 -1.351 0.256) 1.938 4.828 ( -1.782 -3.991 -2.364) 4.969 5.015 ( -1.041 -0.555 1.577) 1.969 5.078 ( -1.418 -3.840 -0.054) 4.093 5.171 ( -5.880 -0.928 5.780) 8.298 5.255 ( -4.499 -4.279 1.260) 6.335 5.361 ( -10.075 2.067 -4.712) 11.313 5.486 ( -12.884 -1.897 -2.254) 13.216 6.000 ( -9.670 0.497 12.152) 15.538 6.115 ( -0.691 -0.150 -4.201) 4.260 6.209 ( -9.265 0.037 -3.749) 9.995 6.363 ( -7.726 -3.193 -2.743) 8.798 6.514 ( -3.737 -2.041 -1.677) 4.576 6.563 ( -0.560 0.816 -3.691) 3.821 7.099 ( -9.639 2.706 7.253) 12.363 7.247 ( -6.869 -2.217 7.223) 10.211 7.329 ( -6.332 -0.861 0.336) 6.400 7.666 ( -7.016 -3.741 -1.760) 8.144 7.864 ( -8.222 -2.236 3.578) 9.242 8.085 ( -10.967 4.316 6.409) 13.415 8.179 ( -7.442 1.207 -14.374) 16.231 8.404 ( -2.549 1.483 -9.788) 10.223 8.749 ( -0.492 -3.045 3.955) 5.015 8.795 ( -3.090 -2.953 1.642) 4.579 9.304 ( -2.702 -2.436 7.057) 7.939 9.755 ( -6.535 8.346 -0.173) 10.602 9.933 ( -10.471 -4.062 8.005) 13.792 10.281 ( -6.398 -16.233 -5.809) 18.390 10.814 ( 0.573 5.718 0.494) 5.768 11.251 ( 2.931 -10.536 -9.135) 14.249 11.894 ( -0.641 0.784 2.272) 2.487 12.771 ( -2.347 7.745 -2.684) 8.526 12.975 ( -0.102 -1.633 -1.494) 2.215 13.059 ( 4.629 7.068 9.198) 12.489 13.267 ( 0.799 -2.934 2.168) 3.734 13.564 ( 12.470 -3.022 -3.834) 13.391 13.952 ( 9.219 0.765 2.377) 9.552 14.196 ( 6.725 3.306 0.754) 7.531 15.024 ( -5.720 -2.634 -7.047) 9.451 15.084 ( -12.708 -3.243 2.627) 13.376 17.757 ( 1.874 0.133 -1.972) 2.723 17.802 ( -1.294 -0.565 2.413) 2.796 ======================= Grid point 141 (62/117) ======================= q-point: (-0.40 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.268 ( -2.354 12.357 5.925) 13.905 1.597 ( -1.156 12.495 0.765) 12.571 1.674 ( -3.527 9.003 -0.138) 9.670 1.929 ( 2.129 2.935 -2.172) 4.227 2.142 ( 0.674 -2.371 1.696) 2.992 2.198 ( 3.244 4.512 -2.125) 5.950 2.293 ( 1.815 -4.204 0.445) 4.601 2.314 ( 3.106 -4.124 0.063) 5.163 2.434 ( 2.501 -0.815 -0.848) 2.764 2.476 ( 4.512 -8.132 -4.879) 10.502 2.599 ( 0.316 -8.881 3.735) 9.640 2.745 ( -1.760 -0.518 1.381) 2.297 2.766 ( -2.366 2.913 -0.383) 3.772 2.833 ( 2.928 -2.347 1.398) 4.004 2.913 ( -2.043 2.675 0.243) 3.375 2.969 ( -5.321 2.853 2.892) 6.694 3.050 ( -1.028 -0.591 6.369) 6.479 3.172 ( 7.262 -0.724 4.243) 8.441 3.291 ( 2.997 -2.248 -3.869) 5.385 3.449 ( 0.709 1.357 -1.512) 2.151 3.496 ( 1.004 3.933 -1.021) 4.186 3.604 ( 1.254 7.774 0.582) 7.896 3.688 ( -0.293 1.096 0.091) 1.138 3.696 ( -3.821 7.714 -11.034) 13.995 3.925 ( -1.339 1.713 2.344) 3.197 4.065 ( -0.006 2.419 -2.528) 3.498 4.248 ( -3.377 -3.696 2.515) 5.603 4.349 ( 2.167 -5.952 -6.113) 8.803 4.494 ( 2.683 1.881 2.153) 3.921 4.637 ( 1.141 -2.637 1.470) 3.228 4.767 ( -1.890 -3.713 -1.060) 4.300 4.816 ( -4.663 -6.062 1.269) 7.752 4.946 ( -6.108 -1.883 -2.474) 6.854 5.033 ( -9.129 1.457 4.456) 10.263 5.140 ( 4.295 -2.222 -2.455) 5.424 5.207 ( -1.352 -3.011 0.848) 3.408 5.291 ( -0.976 -1.895 -6.297) 6.648 5.329 ( -7.459 -2.274 -0.151) 7.799 5.869 ( -6.028 -0.131 11.590) 13.065 6.048 ( -7.929 0.832 0.091) 7.973 6.128 ( 1.089 -0.248 -2.998) 3.199 6.201 ( -10.496 -3.047 -2.987) 11.330 6.499 ( -0.509 -0.867 -2.321) 2.529 6.523 ( -1.797 1.638 -4.454) 5.075 6.925 ( -8.024 2.559 8.949) 12.289 7.144 ( -6.657 -1.372 2.234) 7.154 7.302 ( 0.778 -2.610 1.547) 3.132 7.577 ( -7.367 -6.099 -0.088) 9.565 7.747 ( -8.627 -2.977 4.831) 10.326 7.878 ( -6.579 2.601 -1.608) 7.255 8.114 ( 0.546 2.587 -7.364) 7.824 8.338 ( -1.549 3.068 -8.349) 9.029 8.730 ( -3.740 -0.953 8.259) 9.116 8.816 ( 0.956 -5.029 0.862) 5.192 9.319 ( 0.506 -3.340 2.973) 4.500 9.619 ( -3.725 2.354 0.354) 4.421 9.846 ( -6.525 -6.577 9.385) 13.188 10.307 ( -4.800 -14.074 -10.758) 18.354 10.787 ( 1.211 4.501 5.933) 7.545 11.358 ( 0.145 -10.265 -15.777) 18.823 11.929 ( 3.840 -0.848 9.659) 10.429 12.630 ( -4.028 8.316 -7.348) 11.805 12.951 ( 0.321 5.844 6.330) 8.621 13.113 ( 3.016 2.741 1.676) 4.407 13.331 ( 2.833 -4.548 7.282) 9.041 13.802 ( 11.898 -3.366 -7.481) 14.452 14.087 ( 5.385 0.097 4.378) 6.941 14.247 ( 3.309 4.106 -0.741) 5.325 14.868 ( -12.244 -3.345 2.255) 12.892 15.016 ( -1.233 -5.476 -7.502) 9.369 17.770 ( -1.672 -0.311 2.226) 2.801 17.795 ( 1.214 -0.322 -1.356) 1.849 ======================= Grid point 142 (63/117) ======================= q-point: (-0.30 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.127 ( -0.306 15.339 9.938) 18.280 1.411 ( -0.682 19.478 11.226) 22.491 1.600 ( 1.430 5.945 -9.833) 11.579 1.889 ( 1.206 8.476 -9.521) 12.805 2.174 ( -1.191 -0.514 5.631) 5.779 2.232 ( 2.539 -1.383 -1.526) 3.270 2.351 ( -1.711 -0.675 1.366) 2.291 2.356 ( -1.559 -1.175 1.747) 2.620 2.445 ( 0.873 -0.029 1.793) 1.994 2.548 ( 0.959 19.596 5.609) 20.406 2.632 ( -1.231 -4.625 -5.408) 7.221 2.676 ( 0.233 -9.349 3.223) 9.892 2.763 ( 0.600 -1.705 0.023) 1.807 2.847 ( -0.063 -1.090 2.675) 2.889 2.919 ( -0.899 -5.216 1.601) 5.529 2.965 ( -0.714 -10.103 -1.448) 10.232 3.069 ( 0.414 -2.358 5.127) 5.658 3.217 ( -3.764 -2.356 1.884) 4.824 3.341 ( 1.414 -1.182 -3.640) 4.080 3.425 ( 0.306 4.278 -8.584) 9.595 3.477 ( -2.604 2.296 -0.390) 3.493 3.566 ( 2.875 10.080 -8.322) 13.384 3.622 ( 2.444 0.452 -0.915) 2.648 3.677 ( -0.598 1.012 0.456) 1.261 3.906 ( 1.099 0.390 3.013) 3.231 4.026 ( -0.926 2.679 -2.819) 3.997 4.243 ( -1.567 -3.598 1.977) 4.394 4.418 ( -0.027 -3.094 -6.136) 6.872 4.572 ( 6.016 -0.701 4.396) 7.484 4.634 ( -2.462 -2.052 2.443) 4.030 4.763 ( -8.426 -7.501 1.068) 11.332 4.829 ( 4.342 -4.286 -0.495) 6.121 4.890 ( -2.959 0.314 0.487) 3.015 4.967 ( 5.039 -0.914 -2.393) 5.653 5.185 ( 0.271 -1.562 0.546) 1.677 5.246 ( -1.854 -1.420 -0.145) 2.340 5.291 ( 1.429 -0.282 -5.015) 5.222 5.294 ( 2.036 -3.836 -3.221) 5.407 5.818 ( -4.060 -1.239 8.981) 9.934 5.946 ( 0.510 -0.955 5.199) 5.311 6.135 ( 2.174 -1.058 -1.284) 2.737 6.160 ( 3.130 1.334 -4.211) 5.414 6.482 ( -0.872 0.295 -3.435) 3.556 6.509 ( 2.432 1.085 -4.891) 5.569 6.831 ( -1.331 0.980 10.156) 10.290 7.069 ( -3.077 -1.190 1.839) 3.777 7.396 ( 6.949 -3.612 0.165) 7.833 7.541 ( -3.287 -6.453 -0.781) 7.284 7.633 ( -7.443 -2.573 6.782) 10.393 7.833 ( 2.735 0.732 -1.508) 3.208 8.116 ( 3.155 3.194 -5.870) 7.390 8.287 ( 0.078 3.278 -7.193) 7.905 8.688 ( -2.494 -0.347 10.305) 10.609 8.898 ( 2.136 -7.346 1.513) 7.799 9.378 ( 2.625 -3.601 0.903) 4.547 9.577 ( -1.207 -1.816 -1.491) 2.642 9.833 ( -3.359 -6.949 11.107) 13.525 10.338 ( -1.928 -7.882 -12.740) 15.105 10.799 ( 1.741 -0.345 10.371) 10.522 11.403 ( -2.312 -8.643 -18.834) 20.851 12.046 ( 5.946 -2.833 11.493) 13.246 12.494 ( -3.382 5.527 -9.183) 11.239 12.909 ( 1.428 8.742 9.112) 12.707 13.099 ( -0.464 4.050 -0.582) 4.118 13.440 ( 1.824 -6.837 9.723) 12.026 13.963 ( 3.069 -1.657 -10.926) 11.469 14.076 ( -6.850 0.519 3.228) 7.590 14.286 ( 3.802 0.828 -1.071) 4.036 14.749 ( -4.235 -4.137 4.245) 7.285 15.073 ( 2.621 -4.956 -8.252) 9.977 17.734 ( -2.529 -0.110 2.580) 3.614 17.824 ( 1.668 -0.223 -1.203) 2.068 ======================= Grid point 143 (64/117) ======================= q-point: (-0.20 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.041 ( 5.864 14.572 7.728) 17.506 1.305 ( 6.718 18.778 10.557) 22.565 1.576 ( 1.719 5.032 -11.527) 12.695 1.844 ( 3.646 7.613 -11.185) 14.013 2.124 ( -2.980 7.351 7.709) 11.061 2.184 ( -2.828 6.051 4.421) 8.009 2.281 ( 2.915 9.191 4.792) 10.767 2.349 ( -4.186 -5.138 0.732) 6.668 2.448 ( -2.698 -0.507 3.429) 4.393 2.472 ( 1.707 4.553 3.904) 6.235 2.575 ( -6.581 -2.039 -3.203) 7.598 2.762 ( 1.409 -0.642 -1.465) 2.132 2.798 ( 0.014 -6.629 0.723) 6.669 2.864 ( 0.558 2.011 3.143) 3.773 2.928 ( -6.548 -4.712 -1.395) 8.187 3.037 ( 0.504 -10.803 -1.491) 10.918 3.110 ( 0.420 -2.908 3.440) 4.524 3.209 ( -1.189 -9.078 -0.588) 9.174 3.332 ( -0.839 0.889 -5.195) 5.337 3.399 ( -4.029 1.226 -1.109) 4.355 3.418 ( 1.100 -1.069 -6.457) 6.637 3.500 ( -1.351 7.187 -1.170) 7.406 3.616 ( 4.373 1.654 -6.860) 8.302 3.749 ( 3.948 -2.340 0.817) 4.662 3.949 ( 1.681 -0.337 2.518) 3.046 3.983 ( -1.164 3.471 -2.783) 4.598 4.253 ( -0.503 -3.543 0.600) 3.629 4.401 ( -2.318 -0.168 -3.326) 4.057 4.544 ( -2.840 1.510 2.009) 3.792 4.631 ( -9.818 -1.548 1.536) 10.057 4.784 ( 5.451 -3.447 3.899) 7.536 4.852 ( 3.705 -0.680 -1.457) 4.038 5.002 ( 6.289 -1.907 3.825) 7.604 5.100 ( 8.185 -1.718 -3.641) 9.122 5.188 ( -2.722 -3.607 0.245) 4.525 5.258 ( 4.607 1.315 -1.995) 5.189 5.320 ( 4.341 0.607 -3.356) 5.520 5.376 ( 3.587 -2.870 -0.826) 4.668 5.766 ( -2.045 -0.496 6.946) 7.258 6.135 ( 14.250 -3.254 1.472) 14.691 6.195 ( 4.514 1.135 0.709) 4.708 6.272 ( 9.818 -0.607 -4.599) 10.859 6.492 ( 1.952 -2.063 -6.508) 7.101 6.545 ( 2.636 1.231 -3.524) 4.570 6.912 ( 7.832 -2.197 6.457) 10.385 7.102 ( 6.497 -4.879 5.311) 9.707 7.525 ( -3.433 -1.695 3.036) 4.886 7.569 ( 3.443 -1.581 2.612) 4.602 7.623 ( 7.662 -6.240 -0.551) 9.897 7.937 ( 8.116 -1.606 1.317) 8.377 8.143 ( 4.413 4.706 -6.269) 8.995 8.278 ( 2.606 1.385 -6.230) 6.894 8.684 ( 0.075 -1.645 10.686) 10.812 9.024 ( 3.871 -8.953 3.983) 10.536 9.467 ( 1.934 -6.267 0.079) 6.559 9.611 ( 3.978 -2.929 -3.569) 6.094 9.868 ( -0.509 -5.372 12.051) 13.204 10.336 ( -1.025 -0.059 -9.395) 9.450 10.881 ( 3.212 -5.411 9.824) 11.667 11.395 ( -3.195 -4.475 -17.936) 18.760 12.173 ( 4.456 -1.379 8.281) 9.504 12.415 ( -1.150 0.296 -9.271) 9.347 12.877 ( 2.143 6.848 10.569) 12.774 13.048 ( -0.533 4.307 -0.852) 4.423 13.505 ( -3.161 -7.505 7.961) 11.388 13.831 ( -12.470 3.649 -4.026) 13.603 13.979 ( -5.186 -0.382 -6.990) 8.712 14.249 ( -11.312 -1.276 3.433) 11.890 14.827 ( 8.787 -1.878 -0.317) 8.991 15.161 ( 4.947 -2.384 -3.449) 6.484 17.707 ( -0.270 0.321 0.737) 0.848 17.846 ( 0.315 -0.444 0.436) 0.698 ======================= Grid point 144 (65/117) ======================= q-point: (-0.10 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.108 ( 13.087 9.420 2.431) 16.306 1.324 ( 12.394 17.202 7.234) 22.402 1.513 ( -2.003 4.899 -13.311) 14.324 1.865 ( 6.593 5.985 -9.626) 13.113 2.029 ( -0.297 6.516 7.465) 9.914 2.127 ( -3.827 -0.447 3.947) 5.515 2.243 ( 3.744 12.861 6.011) 14.681 2.309 ( -4.533 -3.947 2.991) 6.714 2.410 ( -1.740 -0.939 3.156) 3.724 2.456 ( -7.084 -0.393 -0.195) 7.098 2.502 ( 2.197 0.492 5.658) 6.089 2.747 ( -1.961 0.186 -2.382) 3.091 2.789 ( -4.632 -3.770 -0.491) 5.993 2.827 ( -2.815 1.549 3.465) 4.726 2.934 ( 2.405 -4.376 -1.132) 5.120 3.056 ( -9.730 -4.168 -4.117) 11.358 3.157 ( 0.544 -6.262 4.043) 7.473 3.217 ( -1.911 1.843 -3.244) 4.192 3.323 ( 0.837 -4.883 -4.422) 6.641 3.402 ( 0.430 -1.861 -4.307) 4.712 3.415 ( 0.026 -8.914 -1.317) 9.011 3.530 ( 7.563 3.244 -2.464) 8.590 3.709 ( 8.104 1.710 -8.536) 11.894 3.800 ( -2.323 -3.006 0.394) 3.819 3.902 ( -1.774 3.458 -1.958) 4.352 3.970 ( -0.984 -0.747 2.507) 2.795 4.290 ( 1.796 -1.872 -2.399) 3.533 4.353 ( -1.772 0.997 -0.268) 2.051 4.419 ( -7.360 2.781 0.859) 7.915 4.588 ( 3.104 1.178 2.991) 4.469 4.801 ( -1.851 -0.464 2.089) 2.830 4.967 ( 1.403 -2.531 -2.630) 3.910 5.039 ( -1.152 1.529 5.987) 6.286 5.174 ( 2.016 -1.459 1.884) 3.122 5.251 ( 3.995 -0.797 -3.641) 5.463 5.382 ( 9.901 -1.649 0.472) 10.049 5.429 ( 7.413 -0.326 0.968) 7.483 5.487 ( 8.207 0.135 -4.093) 9.172 5.790 ( 3.851 -0.528 6.444) 7.525 6.201 ( 1.672 1.879 0.841) 2.653 6.381 ( 3.489 0.466 -1.877) 3.989 6.484 ( 13.409 -3.860 -0.786) 13.976 6.544 ( 1.704 2.037 -6.478) 7.002 6.627 ( 12.005 -3.802 -6.932) 14.374 7.027 ( 5.405 0.492 0.095) 5.428 7.406 ( 7.194 -12.803 10.438) 18.017 7.498 ( 3.928 -1.090 -3.963) 5.686 7.619 ( 2.643 -1.157 6.560) 7.166 7.868 ( 11.880 -4.881 -0.661) 12.861 8.074 ( 5.323 3.543 -1.575) 6.585 8.185 ( 7.156 2.496 -3.111) 8.193 8.356 ( 6.475 -2.286 -5.212) 8.620 8.742 ( 1.768 -4.901 6.513) 8.341 9.190 ( 5.253 -8.518 4.439) 10.948 9.555 ( 1.075 -10.366 -0.658) 10.443 9.760 ( 7.843 -4.128 -0.431) 8.874 9.938 ( 3.951 -3.311 10.993) 12.141 10.301 ( 0.036 2.899 -4.804) 5.611 10.984 ( 1.988 -3.262 5.931) 7.055 11.336 ( -1.605 4.421 -11.943) 12.835 12.238 ( 3.088 0.033 0.877) 3.210 12.428 ( 1.126 -3.380 -6.084) 7.051 12.892 ( 1.417 -0.249 8.583) 8.703 13.019 ( 1.393 3.107 -1.596) 3.760 13.452 ( -10.629 -4.378 -1.347) 11.574 13.615 ( -6.256 2.339 1.875) 6.937 13.832 ( -12.983 2.714 -2.650) 13.525 13.965 ( -14.444 4.797 5.621) 16.225 15.011 ( 10.640 0.444 -2.854) 11.025 15.292 ( 7.777 -2.246 1.063) 8.165 17.721 ( 1.498 -0.333 -1.550) 2.182 17.838 ( -1.740 -0.222 1.805) 2.517 ======================= Grid point 149 (66/117) ======================= q-point: (-0.60 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( 1.328 -0.000 2.345) 2.695 1.640 ( 6.631 -0.000 -5.410) 8.558 1.858 ( -4.842 0.000 3.665) 6.073 1.937 ( 5.700 -0.000 -1.136) 5.812 2.160 ( 0.136 -0.000 5.617) 5.619 2.185 ( 1.143 -0.000 3.005) 3.215 2.215 ( 4.858 -0.000 -6.582) 8.181 2.227 ( 0.778 -0.000 2.836) 2.940 2.306 ( -1.585 0.000 0.497) 1.661 2.383 ( 1.076 -0.000 -1.912) 2.194 2.487 ( -3.468 0.000 -5.708) 6.679 2.671 ( -2.922 0.000 -0.609) 2.985 2.691 ( 6.044 -0.000 -0.908) 6.112 2.840 ( 6.300 -0.000 -1.414) 6.457 2.948 ( -1.815 0.000 3.089) 3.583 2.961 ( 7.894 -0.000 4.138) 8.913 2.980 ( 0.292 -0.000 -1.647) 1.673 3.164 ( 4.370 -0.000 -1.647) 4.670 3.298 ( -5.832 0.000 -3.513) 6.809 3.419 ( 1.669 -0.000 9.382) 9.529 3.591 ( -0.767 0.000 1.391) 1.589 3.633 ( 0.111 -0.000 -0.379) 0.395 3.856 ( -0.248 0.000 1.640) 1.658 3.954 ( -4.077 0.000 -3.125) 5.137 4.080 ( -4.444 0.000 4.130) 6.067 4.128 ( -0.859 0.000 -2.606) 2.744 4.135 ( 1.253 -0.000 -4.541) 4.711 4.220 ( -4.827 0.000 1.295) 4.997 4.451 ( 1.719 -0.000 1.855) 2.529 4.657 ( -2.725 0.000 -8.442) 8.870 4.749 ( 0.703 -0.000 -0.961) 1.190 4.783 ( -2.858 0.000 -0.147) 2.862 5.025 ( -4.010 0.000 3.861) 5.567 5.028 ( 2.522 -0.000 -2.874) 3.824 5.165 ( -5.590 0.000 4.640) 7.265 5.209 ( -2.788 0.000 1.633) 3.231 5.386 ( -11.960 0.000 -5.377) 13.113 5.463 ( -13.109 0.000 -1.213) 13.165 6.004 ( -10.126 0.000 12.366) 15.983 6.113 ( -0.095 0.000 -4.054) 4.055 6.215 ( -9.327 0.000 -5.526) 10.841 6.323 ( -9.294 0.000 -1.036) 9.352 6.494 ( -2.688 0.000 0.115) 2.691 6.573 ( 0.257 -0.000 -4.346) 4.354 7.129 ( -9.237 0.000 6.575) 11.338 7.223 ( -6.616 0.000 8.035) 10.408 7.323 ( -6.720 0.000 -0.755) 6.762 7.633 ( -7.297 0.000 -2.284) 7.646 7.841 ( -8.449 0.000 5.669) 10.174 8.126 ( -12.475 0.000 7.490) 14.551 8.193 ( -7.603 0.000 -17.698) 19.262 8.415 ( -1.572 0.000 -10.567) 10.683 8.722 ( -0.227 0.000 4.086) 4.092 8.770 ( -0.962 0.000 -0.025) 0.962 9.279 ( -3.785 0.000 11.337) 11.952 9.883 ( -13.013 0.000 9.509) 16.117 9.924 ( -7.460 0.000 -2.899) 8.003 10.051 ( -5.008 0.000 -5.346) 7.325 10.882 ( 0.443 -0.000 -3.965) 3.989 11.139 ( 4.182 -0.000 -5.239) 6.703 11.905 ( -0.870 0.000 1.664) 1.877 12.842 ( 0.103 -0.000 -0.334) 0.349 12.958 ( -1.189 0.000 -1.537) 1.943 13.155 ( 2.510 -0.000 10.576) 10.869 13.212 ( 1.047 -0.000 -2.588) 2.792 13.533 ( 12.512 -0.000 -2.463) 12.752 13.959 ( 8.657 -0.000 2.306) 8.959 14.228 ( 6.972 -0.000 1.241) 7.082 14.998 ( -5.091 0.000 -8.218) 9.667 15.054 ( -14.003 0.000 3.035) 14.328 17.758 ( 1.997 -0.000 -2.127) 2.918 17.797 ( -1.457 0.000 2.587) 2.969 ======================= Grid point 151 (67/117) ======================= q-point: (-0.50 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( 1.413 6.513 4.027) 7.786 1.718 ( 1.947 2.903 -4.532) 5.723 1.803 ( 0.159 0.992 4.313) 4.428 1.971 ( 1.397 6.836 3.463) 7.789 2.152 ( 0.545 -4.828 3.552) 6.018 2.199 ( -1.722 0.878 2.715) 3.333 2.234 ( 1.148 -2.233 0.025) 2.511 2.302 ( 4.195 4.044 -4.103) 7.126 2.340 ( 0.201 -4.910 -1.663) 5.188 2.422 ( 1.008 -3.725 -4.204) 5.707 2.450 ( 1.895 -4.184 -3.918) 6.037 2.633 ( -3.833 -4.662 -1.178) 6.149 2.776 ( 2.602 -1.057 0.369) 2.833 2.839 ( -0.813 2.837 -0.666) 3.026 2.930 ( -1.776 -1.753 4.394) 5.054 2.987 ( 0.597 0.202 0.979) 1.164 3.136 ( -5.850 2.067 1.609) 6.409 3.179 ( 11.418 1.774 4.663) 12.461 3.260 ( 2.166 -0.972 -4.794) 5.350 3.458 ( 3.208 0.061 4.380) 5.430 3.583 ( 0.037 4.099 -1.999) 4.561 3.652 ( 0.837 -1.834 -1.321) 2.410 3.803 ( -0.025 11.283 0.939) 11.322 3.896 ( -2.991 9.649 -1.634) 10.233 3.942 ( -2.068 1.353 1.450) 2.866 4.099 ( -0.828 1.405 -1.870) 2.481 4.163 ( -1.634 -5.428 -1.289) 5.813 4.220 ( -1.109 -7.859 -1.056) 8.006 4.495 ( 2.222 -2.059 3.313) 4.489 4.614 ( 0.036 0.424 -4.568) 4.588 4.707 ( -4.607 -1.722 -0.268) 4.925 4.732 ( -5.700 -3.025 1.443) 6.612 4.921 ( -5.824 -0.861 -2.002) 6.218 5.071 ( -6.539 2.968 3.609) 8.037 5.122 ( 5.097 -0.225 -3.935) 6.443 5.142 ( -1.915 -4.121 1.952) 4.946 5.265 ( -1.579 -0.775 -8.265) 8.450 5.295 ( -7.733 -1.247 1.023) 7.900 5.866 ( -6.885 -0.165 11.956) 13.798 6.073 ( -7.733 2.047 0.725) 8.033 6.117 ( -4.115 -1.470 -0.187) 4.374 6.142 ( -3.470 -2.358 -4.342) 6.038 6.484 ( -0.115 -0.492 -1.280) 1.376 6.546 ( -1.640 0.722 -5.240) 5.538 6.969 ( -8.710 1.903 8.006) 11.983 7.117 ( -6.596 -1.275 3.553) 7.600 7.275 ( 0.756 -0.674 -0.566) 1.161 7.508 ( -6.995 -1.885 -0.979) 7.311 7.706 ( -8.302 -1.328 6.344) 10.532 7.912 ( -7.752 1.110 -2.644) 8.265 8.151 ( 0.909 1.262 -8.529) 8.670 8.376 ( -0.944 1.128 -10.391) 10.494 8.724 ( -0.790 -0.471 5.415) 5.493 8.762 ( -0.322 -0.902 1.341) 1.648 9.260 ( -0.929 -2.235 10.788) 11.057 9.706 ( -7.193 2.550 5.614) 9.474 9.782 ( -4.421 3.528 0.670) 5.696 10.042 ( -4.165 -13.812 -7.949) 16.471 10.872 ( 0.846 3.774 -1.580) 4.178 11.208 ( 1.229 -5.587 -10.011) 11.530 11.931 ( 3.435 0.461 9.149) 9.783 12.758 ( -5.390 4.764 -8.067) 10.809 12.972 ( 1.360 -0.976 2.149) 2.724 13.189 ( 2.511 4.602 3.923) 6.548 13.264 ( 2.417 -3.589 7.347) 8.527 13.751 ( 11.847 -1.823 -5.688) 13.268 14.089 ( 5.423 0.064 4.916) 7.320 14.305 ( 2.272 1.956 1.228) 3.240 14.824 ( -12.735 -1.360 1.843) 12.939 14.940 ( -1.366 -2.617 -9.440) 9.891 17.767 ( -2.167 -0.085 2.755) 3.506 17.791 ( 1.902 -0.103 -1.959) 2.733 ======================= Grid point 152 (68/117) ======================= q-point: (-0.40 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.378 ( 0.612 12.526 6.691) 14.214 1.689 ( -0.027 3.416 -5.273) 6.283 1.730 ( 0.307 16.167 8.657) 18.341 1.994 ( 2.581 1.383 -0.313) 2.945 2.118 ( -3.146 0.146 1.517) 3.496 2.245 ( 0.691 -5.266 1.670) 5.567 2.285 ( -0.125 -2.188 -1.998) 2.966 2.306 ( 0.541 -0.241 -4.696) 4.733 2.358 ( -2.919 -10.670 0.689) 11.083 2.491 ( 1.923 -3.638 1.190) 4.284 2.556 ( 1.462 -3.848 -5.153) 6.595 2.631 ( -0.656 -9.880 -2.763) 10.280 2.789 ( 0.087 0.038 0.960) 0.965 2.819 ( -0.839 0.800 -0.013) 1.159 2.929 ( 0.052 0.351 4.286) 4.301 2.959 ( -0.143 6.490 1.918) 6.769 3.053 ( -0.176 1.330 5.969) 6.118 3.229 ( -4.413 0.411 0.088) 4.433 3.325 ( 2.956 1.813 -0.549) 3.511 3.501 ( -4.410 2.173 -2.559) 5.542 3.523 ( 4.802 4.339 -0.017) 6.472 3.652 ( -2.461 1.729 -2.159) 3.702 3.715 ( 1.105 6.912 0.813) 7.047 3.775 ( 2.449 11.927 -4.157) 12.866 3.926 ( 0.388 1.309 2.873) 3.181 4.071 ( -0.260 2.014 -2.471) 3.198 4.176 ( -1.979 -4.032 0.897) 4.580 4.303 ( 1.290 -9.502 -4.659) 10.661 4.573 ( 5.364 -0.885 2.778) 6.105 4.615 ( -4.083 -3.355 2.901) 6.029 4.633 ( -6.521 -2.184 0.496) 6.895 4.727 ( 5.712 -6.113 -1.557) 8.510 4.899 ( -0.349 0.617 -0.907) 1.151 4.965 ( 0.819 0.551 -1.893) 2.135 5.153 ( 0.444 -2.102 0.557) 2.220 5.201 ( -4.403 -3.060 0.619) 5.397 5.247 ( 4.616 -1.472 -2.599) 5.498 5.275 ( 2.475 -1.190 -7.425) 7.916 5.800 ( -3.569 -0.807 10.621) 11.234 5.936 ( -2.579 -0.136 6.209) 6.725 6.103 ( 2.268 -2.149 -0.803) 3.226 6.179 ( 3.612 0.764 -4.669) 5.952 6.485 ( -0.269 0.076 -2.780) 2.794 6.527 ( 1.811 0.825 -5.756) 6.090 6.854 ( -2.857 1.356 9.348) 9.868 7.044 ( -3.466 -1.549 2.527) 4.561 7.350 ( 6.823 -1.614 -1.085) 7.095 7.452 ( -1.788 -3.512 -1.145) 4.104 7.600 ( -6.055 -1.235 7.028) 9.359 7.847 ( 0.900 0.680 -2.647) 2.877 8.165 ( 3.425 2.221 -7.220) 8.294 8.347 ( 0.939 3.002 -9.751) 10.246 8.707 ( -0.911 1.670 7.175) 7.423 8.790 ( 0.725 -4.524 1.520) 4.827 9.300 ( 0.692 -4.273 8.913) 9.909 9.609 ( -1.400 3.160 0.285) 3.467 9.730 ( -1.644 -2.309 5.631) 6.305 10.120 ( -0.598 -14.777 -9.361) 17.502 10.846 ( 0.385 4.263 2.975) 5.213 11.248 ( -2.006 -7.951 -13.954) 16.185 12.028 ( 6.618 0.272 13.583) 15.112 12.602 ( -5.523 5.825 -11.524) 14.044 12.999 ( 1.413 1.431 4.680) 5.094 13.170 ( -0.494 3.717 -1.246) 3.951 13.344 ( 1.490 -3.561 12.329) 12.919 13.926 ( 6.089 -2.150 -10.565) 12.382 14.107 ( -4.297 2.664 5.718) 7.633 14.282 ( -3.608 -1.400 3.191) 5.016 14.695 ( -2.414 -1.744 0.263) 2.989 14.987 ( 3.882 -4.306 -8.443) 10.241 17.733 ( -1.965 -0.014 2.292) 3.020 17.821 ( 1.493 -0.158 -1.262) 1.961 ======================= Grid point 153 (69/117) ======================= q-point: (-0.30 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( 2.263 13.131 5.780) 14.525 1.612 ( 2.287 13.430 3.058) 13.962 1.672 ( 3.131 7.865 -2.128) 8.729 1.966 ( 0.234 6.248 -4.958) 7.979 2.104 ( -3.826 -6.363 5.120) 9.019 2.237 ( -7.368 -3.458 -0.529) 8.156 2.260 ( -0.992 1.358 -0.949) 1.931 2.303 ( 0.321 -2.075 -2.994) 3.656 2.441 ( 1.585 -3.189 -1.265) 3.779 2.479 ( -7.177 -5.404 -0.997) 9.039 2.602 ( 0.625 -7.533 2.737) 8.040 2.737 ( 0.574 -2.971 -1.881) 3.563 2.791 ( 2.376 2.054 1.733) 3.587 2.823 ( 2.316 -1.991 3.151) 4.388 2.888 ( -2.384 4.353 -0.215) 4.967 2.959 ( 0.709 0.604 1.279) 1.582 3.075 ( 0.817 -3.860 5.471) 6.745 3.110 ( -2.927 5.432 5.845) 8.500 3.322 ( -1.670 -1.247 -2.079) 2.944 3.382 ( -8.482 0.103 -3.817) 9.302 3.509 ( 0.334 7.191 -2.301) 7.558 3.586 ( -1.571 1.601 0.471) 2.291 3.714 ( 2.462 1.772 -2.795) 4.125 3.741 ( 5.261 9.384 -4.715) 11.746 3.965 ( 4.017 1.863 2.219) 4.953 4.051 ( 0.367 3.779 -3.927) 5.462 4.178 ( -0.873 -4.593 0.733) 4.732 4.369 ( -0.499 -4.284 -4.105) 5.954 4.551 ( -7.776 -4.834 2.930) 9.613 4.581 ( -0.392 0.840 -1.087) 1.429 4.719 ( 7.599 -3.383 3.573) 9.053 4.856 ( 0.691 1.267 -2.452) 2.845 4.938 ( 8.990 -4.952 2.609) 10.590 5.074 ( 7.455 -1.748 -1.655) 7.834 5.122 ( -4.901 -3.537 0.170) 6.046 5.251 ( 6.460 -1.855 -2.279) 7.097 5.307 ( 2.492 -0.579 0.546) 2.616 5.353 ( 5.773 -1.072 -5.934) 8.349 5.761 ( -1.550 -0.254 8.906) 9.043 6.072 ( 14.143 -3.216 3.107) 14.833 6.210 ( 4.396 -0.199 -1.258) 4.577 6.246 ( 8.506 -1.583 -2.961) 9.145 6.473 ( -0.229 0.234 -3.937) 3.950 6.566 ( 3.021 0.919 -5.452) 6.300 6.892 ( 6.812 -0.363 9.718) 11.873 7.043 ( 1.704 -2.412 3.409) 4.510 7.479 ( 2.324 -3.246 -1.636) 4.315 7.537 ( 1.059 -1.328 8.355) 8.526 7.551 ( 8.391 -2.593 -2.482) 9.126 7.912 ( 6.499 -0.945 -0.523) 6.588 8.215 ( 5.972 3.010 -7.351) 9.938 8.334 ( 2.536 4.788 -8.736) 10.280 8.693 ( 0.615 1.941 8.001) 8.256 8.874 ( 2.758 -7.861 1.615) 8.485 9.363 ( 0.581 -4.973 6.202) 7.971 9.609 ( 4.341 1.524 -2.194) 5.097 9.767 ( 1.195 -4.652 9.018) 10.217 10.242 ( 1.887 -10.599 -9.784) 14.547 10.833 ( 0.755 0.663 7.160) 7.230 11.259 ( -3.324 -9.233 -14.943) 17.877 12.166 ( 7.704 0.752 13.827) 15.846 12.459 ( -4.186 4.017 -12.621) 13.891 13.001 ( 1.473 5.282 6.019) 8.142 13.115 ( -1.751 3.110 -1.860) 4.025 13.384 ( -3.097 -5.268 10.584) 12.221 13.903 ( -9.703 4.154 -6.474) 12.382 13.973 ( -4.506 -0.026 -2.832) 5.322 14.206 ( -9.523 -3.570 5.039) 11.350 14.785 ( 9.498 -2.412 -1.344) 9.892 15.105 ( 6.215 -3.426 -4.413) 8.356 17.711 ( -0.527 0.144 0.879) 1.035 17.839 ( 0.356 -0.304 0.016) 0.468 ======================= Grid point 154 (70/117) ======================= q-point: (-0.20 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.268 ( 6.583 8.599 1.607) 10.949 1.574 ( 3.000 7.529 -4.310) 9.179 1.648 ( 5.219 12.865 0.828) 13.907 1.924 ( 0.436 2.737 -0.818) 2.890 2.079 ( -5.085 -4.416 2.141) 7.067 2.142 ( -3.362 1.031 0.345) 3.533 2.231 ( -1.050 1.551 -1.999) 2.740 2.329 ( -0.300 -1.516 -1.385) 2.075 2.386 ( -5.946 -3.306 -1.366) 6.939 2.440 ( -2.174 1.353 1.156) 2.809 2.637 ( -5.910 -2.129 4.646) 7.813 2.725 ( 0.866 2.452 0.050) 2.601 2.807 ( -1.544 -3.234 -1.341) 3.827 2.835 ( -4.617 -4.361 2.680) 6.893 2.862 ( 6.087 4.284 3.083) 8.057 2.964 ( 0.297 -1.297 0.233) 1.351 3.077 ( -1.062 1.436 5.345) 5.636 3.154 ( 0.031 -3.582 1.984) 4.095 3.260 ( -3.458 -5.858 0.354) 6.812 3.302 ( -1.257 -2.659 -1.552) 3.325 3.439 ( -1.039 5.570 -3.112) 6.464 3.595 ( 3.889 2.113 -0.363) 4.441 3.740 ( -1.190 -2.726 0.914) 3.111 3.788 ( 10.128 7.544 -9.563) 15.841 3.984 ( 0.016 4.793 -0.909) 4.878 3.996 ( -0.146 3.972 -2.686) 4.797 4.240 ( 2.387 -3.943 -1.558) 4.865 4.364 ( -1.580 -0.056 -1.280) 2.034 4.442 ( -6.690 -0.289 1.717) 6.913 4.601 ( 3.208 0.482 -0.368) 3.265 4.793 ( -0.780 -0.327 2.240) 2.394 4.913 ( 2.144 -3.163 -4.231) 5.701 5.051 ( 0.293 -0.519 5.210) 5.244 5.098 ( -0.806 -5.749 0.948) 5.882 5.235 ( 8.145 -2.108 -2.822) 8.874 5.349 ( 2.456 -1.587 4.985) 5.779 5.424 ( 11.570 0.440 -0.903) 11.613 5.499 ( 11.169 0.123 -7.551) 13.482 5.785 ( 3.373 -0.048 7.784) 8.484 6.229 ( 1.544 1.233 0.584) 2.060 6.391 ( 7.757 -0.816 2.640) 8.234 6.418 ( 9.495 -1.993 -1.977) 9.901 6.525 ( 9.777 -5.783 -11.584) 16.225 6.588 ( 2.481 1.494 -4.009) 4.946 7.035 ( 6.740 0.281 4.415) 8.062 7.208 ( 10.328 -8.555 10.405) 16.974 7.493 ( 0.300 -0.035 1.126) 1.166 7.592 ( 3.638 -2.352 1.781) 4.684 7.799 ( 13.185 -2.802 -0.352) 13.484 8.068 ( 8.648 -2.785 2.233) 9.356 8.291 ( 7.314 7.793 -7.955) 13.323 8.339 ( 4.170 0.914 -8.207) 9.251 8.713 ( 1.885 0.648 6.654) 6.946 9.031 ( 6.114 -9.439 1.870) 11.401 9.418 ( 0.765 -5.116 2.835) 5.899 9.724 ( 8.927 -0.148 -1.689) 9.086 9.864 ( 4.191 -4.873 11.420) 13.104 10.317 ( 1.211 -2.116 -7.440) 7.829 10.889 ( 1.899 -5.636 6.983) 9.172 11.281 ( -1.285 -8.636 -12.254) 15.046 12.270 ( 3.666 3.441 3.726) 6.258 12.393 ( 1.089 -0.418 -6.284) 6.391 12.966 ( -0.002 6.734 6.389) 9.283 13.072 ( -0.042 2.369 -0.803) 2.502 13.349 ( -7.497 -6.005 4.722) 10.703 13.678 ( -9.402 4.077 -1.912) 10.425 13.858 ( -9.415 0.758 -4.923) 10.652 14.021 ( -12.027 1.581 5.062) 13.144 14.996 ( 11.471 -2.123 -3.090) 12.068 15.245 ( 7.149 -2.766 0.006) 7.666 17.716 ( 0.861 -0.242 -0.839) 1.227 17.834 ( -1.278 -0.176 1.238) 1.788 ======================= Grid point 155 (71/117) ======================= q-point: (-0.10 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.359 ( 9.074 2.643 -1.621) 9.589 1.523 ( -0.152 5.531 -7.534) 9.347 1.686 ( 11.975 13.833 2.543) 18.472 1.931 ( -0.266 -2.054 3.427) 4.004 2.004 ( -6.294 -0.170 -0.081) 6.297 2.100 ( -0.704 0.987 -1.355) 1.819 2.189 ( -0.400 4.452 -2.514) 5.129 2.290 ( -1.549 0.454 -2.641) 3.095 2.363 ( -4.466 -0.410 3.281) 5.557 2.372 ( -3.894 -4.072 1.692) 5.883 2.544 ( -4.561 -0.776 1.946) 5.019 2.696 ( -6.361 -0.534 -0.754) 6.428 2.751 ( -1.496 -1.903 1.686) 2.950 2.836 ( -0.979 0.940 -2.531) 2.872 2.950 ( 2.469 -1.992 -0.574) 3.224 2.981 ( 8.873 11.023 8.681) 16.601 3.076 ( -2.197 -7.905 1.727) 8.384 3.149 ( -3.052 -4.871 0.373) 5.761 3.283 ( -0.495 -3.609 2.745) 4.562 3.372 ( 1.370 -6.706 2.548) 7.304 3.393 ( 0.589 1.827 -3.748) 4.211 3.652 ( 2.809 -0.981 -1.729) 3.441 3.732 ( -0.841 0.573 -1.738) 2.014 3.854 ( 1.248 2.077 -3.633) 4.367 3.906 ( -2.413 4.013 -1.011) 4.791 4.031 ( 10.535 6.245 -7.700) 14.466 4.288 ( -1.213 -1.969 0.278) 2.329 4.343 ( 1.323 -0.419 -1.425) 1.989 4.362 ( -1.854 1.309 -0.800) 2.406 4.669 ( 4.416 0.112 0.137) 4.419 4.760 ( -3.081 0.628 1.850) 3.648 4.885 ( -6.057 -2.779 -4.343) 7.954 5.037 ( -0.675 1.859 5.171) 5.536 5.192 ( 2.795 -6.052 1.823) 6.911 5.295 ( 0.847 2.282 0.348) 2.459 5.444 ( 2.568 -4.259 2.064) 5.385 5.607 ( 10.690 2.052 1.760) 11.027 5.704 ( 14.196 1.870 -6.936) 15.910 5.893 ( 7.237 -1.079 6.013) 9.471 6.242 ( 1.414 1.190 1.825) 2.597 6.373 ( -2.995 -0.401 -0.573) 3.076 6.509 ( -2.856 -0.734 -1.027) 3.122 6.679 ( 8.943 0.193 -10.222) 13.583 6.805 ( 11.407 -5.515 -6.550) 14.263 7.163 ( 9.045 0.899 6.562) 11.211 7.372 ( -0.998 -4.154 11.411) 12.185 7.598 ( 8.499 -5.810 -4.562) 11.261 7.670 ( 3.847 -0.326 2.378) 4.534 8.014 ( 8.006 -3.188 2.966) 9.113 8.201 ( 5.115 3.937 1.024) 6.535 8.322 ( 5.650 2.296 -4.347) 7.490 8.460 ( 8.862 -0.383 -8.721) 12.439 8.750 ( 1.313 -1.197 3.886) 4.273 9.205 ( 3.755 -7.734 -2.601) 8.982 9.520 ( 4.930 -6.868 3.911) 9.315 9.852 ( 4.814 0.254 3.114) 5.739 10.035 ( 9.127 -4.675 8.349) 13.224 10.331 ( 2.049 1.556 -2.991) 3.945 10.971 ( 0.314 -5.727 2.224) 6.152 11.335 ( 1.774 -2.948 -5.562) 6.540 12.268 ( 0.177 -0.559 -10.684) 10.700 12.461 ( 5.344 0.790 2.248) 5.851 12.904 ( -2.742 3.245 4.485) 6.177 13.068 ( 1.958 2.161 -0.746) 3.010 13.268 ( -6.156 -3.830 -0.019) 7.250 13.529 ( -6.826 0.339 4.568) 8.220 13.603 ( -14.123 4.932 -1.442) 15.029 13.859 ( -4.783 3.292 2.428) 6.293 15.177 ( 8.483 0.179 -3.065) 9.021 15.393 ( 6.504 -3.200 1.293) 7.363 17.737 ( 1.078 -0.650 -1.647) 2.073 17.803 ( -2.426 0.248 1.722) 2.985 ======================= Grid point 161 (72/117) ======================= q-point: ( 0.50 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.512 ( 1.138 -0.000 4.686) 4.822 1.708 ( -1.165 0.000 -1.008) 1.540 1.891 ( 5.471 -0.000 4.467) 7.063 2.056 ( 1.292 -0.000 2.402) 2.728 2.089 ( -3.988 0.000 7.729) 8.697 2.176 ( -3.740 0.000 -2.328) 4.405 2.212 ( -3.945 -0.000 1.959) 4.404 2.232 ( 0.040 0.000 0.110) 0.117 2.369 ( 0.223 0.000 -8.825) 8.828 2.463 ( 5.152 0.000 -6.859) 8.579 2.489 ( 3.394 0.000 -0.329) 3.410 2.553 ( -2.207 0.000 -3.168) 3.861 2.778 ( -0.958 0.000 -0.385) 1.032 2.839 ( -0.120 0.000 -1.449) 1.454 2.916 ( 0.762 -0.000 6.661) 6.704 3.029 ( 2.849 0.000 5.134) 5.871 3.060 ( -3.192 0.000 0.763) 3.282 3.209 ( -6.073 0.000 -4.683) 7.669 3.360 ( 6.515 0.000 3.885) 7.586 3.512 ( -4.232 0.000 0.239) 4.238 3.568 ( 0.902 0.000 -1.333) 1.609 3.660 ( 1.169 0.000 -2.911) 3.137 3.878 ( -2.001 0.000 1.428) 2.459 3.909 ( 1.138 -0.000 2.498) 2.745 3.941 ( 1.694 0.000 0.317) 1.724 4.082 ( -0.096 0.000 1.665) 1.668 4.114 ( -1.156 0.000 -2.581) 2.828 4.171 ( 1.097 0.000 -3.989) 4.137 4.513 ( -1.654 0.000 3.589) 3.952 4.607 ( -2.459 0.000 1.826) 3.063 4.626 ( -3.071 0.000 -1.105) 3.264 4.673 ( 7.684 0.000 -2.003) 7.941 4.906 ( 3.988 0.000 -2.237) 4.573 4.974 ( -4.552 0.000 -2.003) 4.974 5.123 ( 2.172 0.000 0.641) 2.265 5.173 ( -6.314 0.000 1.633) 6.522 5.234 ( 5.438 0.000 -2.508) 5.989 5.263 ( 2.941 0.000 -8.424) 8.923 5.792 ( -3.454 0.000 11.087) 11.613 5.937 ( -3.943 0.000 6.750) 7.818 6.080 ( 2.811 0.000 -0.346) 2.832 6.186 ( 3.860 0.000 -4.680) 6.066 6.485 ( 0.686 0.000 -2.446) 2.540 6.535 ( 1.203 0.000 -6.091) 6.209 6.868 ( -3.832 0.000 8.791) 9.590 7.027 ( -3.314 0.000 2.594) 4.209 7.337 ( 6.900 0.000 -1.409) 7.042 7.420 ( -1.786 0.000 -1.522) 2.347 7.589 ( -5.390 0.000 7.255) 9.038 7.853 ( 0.301 0.000 -3.006) 3.021 8.186 ( 3.386 0.000 -7.955) 8.645 8.376 ( 1.867 0.000 -10.964) 11.122 8.719 ( -0.336 0.000 5.663) 5.673 8.755 ( -0.247 -0.000 1.966) 1.982 9.258 ( 0.466 0.000 13.715) 13.723 9.612 ( -4.045 0.000 5.724) 7.010 9.799 ( 1.609 -0.000 -0.584) 1.711 9.914 ( -0.776 0.000 -9.754) 9.785 10.897 ( 0.188 0.000 -1.133) 1.149 11.166 ( -2.171 0.000 -10.766) 10.982 12.035 ( 6.861 0.000 14.064) 15.648 12.660 ( -6.600 0.000 -12.642) 14.261 13.002 ( 1.862 0.000 3.921) 4.341 13.205 ( -1.431 0.000 -4.739) 4.951 13.316 ( 2.197 0.000 15.473) 15.629 13.905 ( 7.009 0.000 -9.067) 11.461 14.141 ( -0.287 0.000 6.244) 6.251 14.259 ( -9.645 0.000 5.300) 11.005 14.683 ( -1.401 0.000 -1.948) 2.399 14.944 ( 4.507 0.000 -8.695) 9.793 17.733 ( -1.835 0.000 2.217) 2.878 17.819 ( 1.443 0.000 -1.264) 1.918 ======================= Grid point 163 (73/117) ======================= q-point: (-0.40 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.480 ( -0.966 7.338 4.835) 8.841 1.689 ( -1.576 0.490 -4.322) 4.627 1.913 ( 2.765 13.478 5.941) 14.987 1.987 ( -2.786 -4.173 5.565) 7.493 2.072 ( -1.845 4.734 -4.240) 6.618 2.134 ( -3.902 -7.115 1.114) 8.191 2.209 ( -1.846 -3.819 0.835) 4.323 2.256 ( -0.828 -9.421 1.061) 9.517 2.368 ( 2.695 3.287 -7.715) 8.809 2.471 ( -0.532 2.023 -1.313) 2.470 2.547 ( -0.654 -0.834 -1.297) 1.675 2.586 ( 3.101 -7.499 -1.779) 8.307 2.767 ( -0.821 -0.967 0.482) 1.357 2.849 ( 1.038 -0.215 -1.299) 1.676 2.942 ( -1.300 2.790 3.523) 4.678 2.995 ( -3.491 -0.743 1.632) 3.925 3.039 ( -0.883 3.120 3.303) 4.629 3.137 ( -1.192 -4.784 -0.620) 4.969 3.366 ( -8.728 1.706 -1.154) 8.968 3.416 ( 0.493 4.421 3.872) 5.898 3.556 ( -1.788 -0.956 0.476) 2.082 3.655 ( -0.023 2.161 -3.168) 3.835 3.794 ( -0.219 10.568 0.414) 10.578 3.929 ( 3.825 7.549 0.393) 8.472 3.991 ( 4.941 -0.141 1.821) 5.268 4.088 ( -0.901 0.071 -4.907) 4.989 4.127 ( 2.680 -0.001 1.807) 3.232 4.237 ( 1.061 -8.831 -3.272) 9.477 4.461 ( -4.135 -4.080 1.867) 6.102 4.596 ( -0.314 0.205 -3.181) 3.203 4.681 ( 7.105 -0.920 2.241) 7.506 4.862 ( 9.603 -2.620 3.494) 10.550 4.905 ( 0.747 4.101 -4.098) 5.845 5.017 ( 4.018 -4.642 -2.076) 6.481 5.077 ( -5.159 -1.306 1.709) 5.589 5.224 ( 9.801 -0.724 -1.830) 9.997 5.302 ( 3.584 -0.164 0.061) 3.588 5.333 ( 4.980 -0.780 -6.935) 8.573 5.757 ( -1.254 -0.160 9.755) 9.836 6.033 ( 13.065 -1.147 2.796) 13.410 6.184 ( 7.889 -1.410 -0.809) 8.055 6.241 ( 3.398 0.196 -1.466) 3.706 6.486 ( -0.410 0.742 -2.511) 2.650 6.576 ( 3.608 0.233 -6.740) 7.649 6.890 ( 5.643 -0.002 9.484) 11.035 7.012 ( 0.849 -0.990 2.859) 3.142 7.439 ( 3.458 -1.126 -2.565) 4.451 7.510 ( 12.122 -1.309 0.441) 12.200 7.530 ( -2.516 -0.225 6.400) 6.880 7.904 ( 5.513 -0.118 -2.077) 5.893 8.249 ( 5.475 0.979 -8.294) 9.986 8.417 ( 5.525 3.426 -10.640) 12.468 8.725 ( 0.704 0.641 5.677) 5.756 8.766 ( 0.399 -3.259 1.737) 3.715 9.305 ( 2.160 -1.623 14.805) 15.050 9.593 ( 0.380 -2.509 2.784) 3.767 9.802 ( 5.077 8.573 -1.264) 10.044 10.014 ( 3.813 -13.574 -6.828) 15.666 10.879 ( -0.462 3.107 1.645) 3.545 11.116 ( -4.852 -5.798 -11.609) 13.854 12.187 ( 9.302 1.045 16.495) 18.966 12.524 ( -5.929 2.438 -14.860) 16.184 13.037 ( 1.590 -0.123 3.715) 4.043 13.155 ( -3.111 1.124 -4.949) 5.953 13.338 ( -1.830 -0.522 13.689) 13.821 13.942 ( -2.155 0.296 -14.925) 15.083 14.012 ( -11.878 4.178 8.150) 14.999 14.129 ( -7.046 -4.600 6.465) 10.612 14.755 ( 8.470 -0.908 -2.777) 8.960 15.058 ( 7.821 -1.566 -4.858) 9.339 17.713 ( -0.657 0.023 0.922) 1.133 17.835 ( 0.385 -0.111 -0.114) 0.417 ======================= Grid point 164 (74/117) ======================= q-point: (-0.30 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.404 ( 0.140 6.503 2.163) 6.855 1.632 ( -2.841 0.661 -6.084) 6.747 1.868 ( 2.383 8.213 2.507) 8.912 1.993 ( -1.496 -2.127 5.685) 6.251 2.005 ( 0.505 6.263 -0.382) 6.295 2.089 ( -4.579 -3.632 -2.044) 6.192 2.223 ( -2.000 -5.950 1.316) 6.413 2.320 ( 0.314 -1.754 -0.025) 1.782 2.379 ( 1.830 3.719 -6.067) 7.348 2.462 ( 1.098 0.751 -1.645) 2.115 2.515 ( -4.709 -4.441 3.344) 7.286 2.686 ( -0.849 -7.482 -0.824) 7.575 2.751 ( -5.344 -1.111 -1.056) 5.559 2.765 ( -6.004 -3.342 -0.908) 6.931 2.898 ( 2.578 1.040 0.661) 2.858 2.965 ( -1.825 3.589 0.608) 4.072 3.079 ( 1.568 -3.630 5.961) 7.153 3.167 ( -5.843 -2.335 -1.431) 6.453 3.196 ( -2.298 -4.919 -1.751) 5.704 3.372 ( 2.812 12.489 7.293) 14.733 3.550 ( 0.570 4.107 0.758) 4.215 3.625 ( 0.725 3.030 -1.176) 3.330 3.738 ( 1.275 4.407 0.404) 4.605 3.928 ( 3.441 6.426 -1.134) 7.377 4.063 ( -0.405 1.190 -4.377) 4.554 4.077 ( 6.716 6.059 -1.977) 9.259 4.171 ( 2.076 -1.938 -0.895) 2.978 4.316 ( 0.223 -5.869 0.055) 5.874 4.427 ( -3.508 -1.151 1.541) 4.001 4.607 ( 2.410 0.180 -5.095) 5.639 4.796 ( 1.833 0.626 2.227) 2.952 4.869 ( 0.828 -1.619 -4.182) 4.561 4.989 ( -2.529 -4.859 1.657) 5.723 5.045 ( 2.601 -0.681 2.969) 4.006 5.162 ( 7.201 -5.595 -1.161) 9.192 5.338 ( 0.887 -0.030 6.059) 6.123 5.440 ( 13.549 1.160 -3.706) 14.095 5.487 ( 12.995 -1.203 -7.188) 14.899 5.784 ( 3.212 -0.070 8.207) 8.813 6.246 ( 1.801 0.732 0.771) 2.091 6.345 ( 16.459 -2.457 0.652) 16.654 6.404 ( 11.282 -2.947 -3.319) 12.124 6.449 ( -1.883 -0.589 -3.881) 4.354 6.615 ( 2.778 1.177 -6.254) 6.944 7.039 ( 7.488 0.306 7.110) 10.330 7.101 ( 8.104 -4.006 8.110) 12.144 7.495 ( -0.206 0.352 3.026) 3.054 7.547 ( 5.374 -2.316 -1.267) 5.987 7.760 ( 13.862 -1.822 1.328) 14.045 8.025 ( 7.427 -1.532 -0.267) 7.588 8.339 ( 6.722 0.725 -9.391) 11.572 8.460 ( 6.641 8.827 -8.090) 13.692 8.737 ( 1.251 1.554 4.505) 4.927 8.866 ( 5.001 -9.005 0.138) 10.301 9.377 ( 3.800 0.256 11.928) 12.521 9.692 ( 7.058 -5.313 2.017) 9.062 9.841 ( 6.189 4.760 1.713) 7.994 10.207 ( 5.899 -9.893 -5.227) 12.649 10.844 ( -1.222 1.031 3.428) 3.783 11.100 ( -3.298 -10.535 -10.049) 14.928 12.344 ( 6.778 4.339 9.399) 12.374 12.407 ( -1.066 1.420 -9.513) 9.678 13.056 ( -0.538 2.115 0.318) 2.206 13.086 ( -1.957 -0.612 -0.918) 2.246 13.290 ( -5.231 0.034 9.361) 10.723 13.743 ( -11.969 2.956 -0.700) 12.349 13.867 ( -7.839 0.373 -6.523) 10.205 14.028 ( -7.886 -0.431 5.754) 9.771 14.948 ( 11.471 -2.770 -3.526) 12.316 15.206 ( 7.778 -1.528 -0.774) 7.964 17.712 ( 0.432 -0.168 -0.558) 0.726 17.832 ( -0.988 -0.103 1.010) 1.417 ======================= Grid point 165 (75/117) ======================= q-point: (-0.20 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.397 ( 3.097 1.833 -0.922) 3.715 1.589 ( -0.180 1.326 -5.861) 6.012 1.835 ( -1.035 1.103 1.194) 1.927 1.976 ( 0.139 4.296 2.790) 5.124 1.987 ( -0.075 1.941 3.581) 4.074 2.065 ( 0.454 -0.660 -2.100) 2.248 2.244 ( -2.543 -6.789 2.502) 7.669 2.308 ( -0.978 1.586 -2.044) 2.766 2.331 ( -0.838 7.531 -2.882) 8.107 2.400 ( -3.935 2.977 0.823) 5.002 2.494 ( -4.397 -3.917 0.157) 5.891 2.668 ( -5.165 -5.549 -3.251) 8.249 2.706 ( -3.698 -3.546 1.030) 5.225 2.776 ( 1.801 -3.476 -1.460) 4.178 2.919 ( 0.676 -2.754 0.752) 2.933 2.933 ( -1.718 -1.027 -2.525) 3.223 3.038 ( -1.770 -3.072 1.928) 4.036 3.198 ( -0.026 -7.075 2.984) 7.679 3.253 ( -0.629 -3.219 1.365) 3.552 3.347 ( 8.591 13.439 9.455) 18.542 3.483 ( -0.296 8.617 -1.527) 8.756 3.625 ( -0.507 -0.753 0.167) 0.923 3.758 ( 4.757 3.135 -0.460) 5.716 3.907 ( -1.423 3.216 -0.087) 3.518 3.996 ( -3.055 5.270 -2.994) 6.787 4.162 ( 11.383 8.144 -7.600) 15.927 4.233 ( 0.537 -4.029 -0.225) 4.071 4.329 ( -1.804 -1.290 1.552) 2.707 4.386 ( -0.449 1.070 -0.114) 1.165 4.660 ( 3.372 -1.124 -4.294) 5.574 4.767 ( -2.676 0.389 1.428) 3.058 4.838 ( -5.730 -2.566 -4.964) 8.004 5.047 ( 1.307 -2.161 4.660) 5.300 5.094 ( 3.257 -2.623 0.553) 4.218 5.311 ( 4.183 -2.940 -2.513) 5.697 5.362 ( 0.798 -2.701 6.882) 7.436 5.639 ( 11.019 1.407 -0.593) 11.124 5.734 ( 15.284 1.588 -5.500) 16.321 5.880 ( 6.610 -0.448 5.468) 8.590 6.259 ( 0.849 0.795 2.062) 2.367 6.369 ( -4.377 -0.155 0.211) 4.385 6.488 ( -1.277 -1.349 -1.711) 2.525 6.678 ( 9.944 -1.674 -11.832) 15.546 6.718 ( 11.772 -2.821 -3.476) 12.594 7.171 ( 8.301 0.043 8.397) 11.807 7.290 ( 4.438 -4.504 12.517) 14.023 7.519 ( 3.421 -2.745 0.197) 4.391 7.668 ( 6.640 -0.501 -4.182) 7.863 7.974 ( 8.358 -1.408 2.820) 8.933 8.170 ( 6.001 -3.913 2.750) 7.674 8.412 ( 3.535 3.336 -8.283) 9.603 8.512 ( 10.286 7.473 -8.317) 15.193 8.753 ( 1.307 0.883 3.868) 4.178 9.050 ( 5.120 -9.618 -2.843) 11.261 9.473 ( 7.665 1.405 7.955) 11.136 9.878 ( 7.865 1.396 -1.876) 8.205 9.951 ( 9.084 -3.986 9.961) 14.058 10.338 ( 3.976 -1.216 -3.069) 5.168 10.846 ( -1.439 -6.458 1.576) 6.802 11.182 ( 1.724 -12.553 -5.403) 13.775 12.285 ( -2.493 2.092 -14.843) 15.195 12.511 ( 8.488 4.552 9.698) 13.668 12.975 ( -4.455 2.981 -1.194) 5.492 13.110 ( 2.251 -0.007 3.798) 4.415 13.197 ( -5.534 -0.726 2.950) 6.313 13.544 ( -9.870 0.682 3.620) 10.535 13.677 ( -10.657 3.659 -6.807) 13.164 13.906 ( -5.424 1.984 4.316) 7.210 15.156 ( 9.779 -2.404 -4.270) 10.938 15.344 ( 6.399 -1.977 1.789) 6.932 17.726 ( 0.867 -0.519 -1.483) 1.794 17.806 ( -2.063 0.151 1.641) 2.641 ======================= Grid point 166 (76/117) ======================= q-point: (-0.10 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( 3.980 -2.187 -2.066) 4.989 1.598 ( 4.528 3.867 -2.781) 6.571 1.827 ( -2.670 -4.654 2.016) 5.732 1.882 ( -5.777 3.183 -3.701) 7.563 1.997 ( 2.738 2.971 5.455) 6.788 2.102 ( 2.391 0.653 -2.127) 3.266 2.210 ( -5.163 0.621 0.965) 5.289 2.246 ( -3.352 -1.053 1.173) 3.704 2.294 ( 1.269 1.148 -1.590) 2.336 2.352 ( 2.082 4.950 0.145) 5.372 2.445 ( -4.976 -2.927 -1.993) 6.108 2.552 ( -6.259 -0.957 -0.648) 6.365 2.742 ( 1.210 -2.531 -0.266) 2.818 2.816 ( 0.673 -0.371 -4.146) 4.217 2.946 ( -1.264 -9.494 1.180) 9.651 2.986 ( 2.916 -2.415 -0.758) 3.861 3.074 ( 0.106 -4.073 2.415) 4.736 3.191 ( -1.477 4.299 2.369) 5.126 3.279 ( -0.165 -4.692 6.424) 7.956 3.388 ( 2.529 10.037 4.208) 11.173 3.445 ( 4.411 1.607 -0.948) 4.789 3.641 ( 1.380 -2.019 -0.439) 2.485 3.787 ( 0.276 3.484 -2.581) 4.345 3.849 ( -2.114 3.988 -1.128) 4.653 3.908 ( 1.230 3.924 0.414) 4.133 4.183 ( -5.537 -1.087 2.384) 6.125 4.285 ( 4.207 2.633 -8.188) 9.575 4.364 ( 3.152 -1.956 -2.209) 4.317 4.395 ( 5.742 2.834 -0.476) 6.421 4.691 ( -2.407 -0.514 2.389) 3.430 4.740 ( -6.986 -1.564 -5.029) 8.749 4.744 ( 1.639 -1.011 -4.087) 4.518 5.072 ( 1.986 2.005 3.560) 4.543 5.169 ( 0.272 -4.661 2.242) 5.179 5.326 ( -0.190 2.841 3.526) 4.532 5.447 ( 2.609 -4.624 -0.769) 5.364 5.771 ( 5.229 1.671 4.492) 7.094 5.947 ( 11.288 2.062 -5.106) 12.559 6.014 ( 7.392 -0.790 2.703) 7.910 6.270 ( 0.515 -0.262 1.243) 1.371 6.312 ( -2.289 -0.346 1.082) 2.556 6.423 ( -5.370 -0.549 -2.711) 6.040 6.775 ( 2.420 0.460 -10.025) 10.323 6.892 ( 4.554 -2.989 -4.583) 7.119 7.322 ( 4.992 -0.883 12.101) 13.120 7.347 ( 1.455 -1.271 9.474) 9.669 7.651 ( 5.292 -5.877 -2.516) 8.300 7.758 ( 4.893 1.560 -5.212) 7.318 8.079 ( 2.092 -2.270 4.232) 5.238 8.276 ( 1.802 -2.474 4.826) 5.715 8.415 ( 2.798 4.831 -6.754) 8.763 8.625 ( 7.919 3.310 -9.290) 12.648 8.771 ( 1.197 1.036 3.938) 4.244 9.173 ( 1.427 -7.173 -5.754) 9.306 9.612 ( 7.115 0.928 5.689) 9.157 9.938 ( 2.605 3.158 2.849) 4.988 10.157 ( 7.362 -1.428 5.859) 9.517 10.403 ( 5.390 0.234 2.592) 5.985 10.897 ( -1.295 -9.038 -1.804) 9.307 11.328 ( 3.289 -8.399 -1.129) 9.091 12.228 ( -1.914 -0.608 -16.380) 16.503 12.604 ( 6.716 4.544 4.725) 9.385 12.855 ( -5.995 2.624 -0.046) 6.544 13.120 ( -0.507 2.726 -0.099) 2.774 13.180 ( 0.824 -2.822 3.575) 4.628 13.358 ( -11.123 1.110 8.418) 13.994 13.507 ( -3.240 2.823 -5.968) 7.354 13.827 ( -2.272 1.592 3.130) 4.183 15.295 ( 5.365 0.238 -3.490) 6.405 15.458 ( 3.842 -2.800 1.706) 5.051 17.746 ( 1.011 -0.691 -1.482) 1.922 17.767 ( -2.151 0.451 1.559) 2.695 ======================= Grid point 173 (77/117) ======================= q-point: ( 0.60 -0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.470 ( -3.328 0.000 2.983) 4.469 1.631 ( -4.073 0.000 -5.222) 6.623 1.894 ( -3.302 0.000 2.057) 3.890 2.019 ( -1.775 0.000 -0.912) 1.996 2.030 ( -3.691 0.000 0.687) 3.754 2.149 ( 4.039 -0.000 -1.333) 4.254 2.161 ( -1.916 0.000 1.985) 2.759 2.219 ( 6.122 -0.000 5.700) 8.365 2.427 ( 3.506 -0.000 -7.215) 8.022 2.462 ( -4.027 0.000 -0.694) 4.086 2.549 ( -1.576 0.000 4.023) 4.320 2.564 ( 2.130 -0.000 -4.850) 5.297 2.734 ( -11.562 0.000 -3.122) 11.977 2.737 ( -2.755 0.000 1.150) 2.985 2.914 ( 1.075 -0.000 0.226) 1.098 3.037 ( 2.676 -0.000 6.955) 7.452 3.060 ( -2.165 0.000 -3.071) 3.758 3.071 ( -0.310 0.000 2.592) 2.610 3.162 ( -11.467 0.000 -3.722) 12.056 3.492 ( 1.724 -0.000 5.781) 6.033 3.559 ( 2.785 -0.000 1.731) 3.279 3.659 ( -0.009 0.000 -1.265) 1.265 3.860 ( 1.404 -0.000 1.905) 2.367 3.983 ( 0.797 -0.000 -2.585) 2.705 4.021 ( 1.665 -0.000 0.771) 1.835 4.166 ( 0.268 -0.000 -3.193) 3.204 4.197 ( 5.718 -0.000 -0.056) 5.718 4.208 ( 5.072 -0.000 0.739) 5.125 4.406 ( -1.605 0.000 1.143) 1.970 4.609 ( 1.881 -0.000 -7.437) 7.671 4.806 ( 6.669 -0.000 -0.404) 6.681 4.853 ( -3.541 0.000 0.412) 3.565 4.942 ( -4.876 0.000 0.168) 4.879 5.069 ( 2.545 -0.000 1.994) 3.233 5.071 ( 8.589 -0.000 -0.427) 8.600 5.338 ( 0.762 -0.000 5.972) 6.020 5.458 ( 10.820 -0.000 -8.706) 13.888 5.468 ( 17.206 -0.000 -2.588) 17.400 5.783 ( 3.199 -0.000 8.127) 8.734 6.254 ( 1.300 -0.000 1.446) 1.945 6.320 ( 19.244 -0.000 -3.490) 19.557 6.368 ( 10.284 -0.000 -1.107) 10.344 6.453 ( -3.813 0.000 -0.961) 3.932 6.625 ( 2.998 -0.000 -6.827) 7.456 7.050 ( 10.466 -0.000 10.431) 14.777 7.058 ( 4.515 -0.000 4.348) 6.268 7.502 ( -1.564 0.000 5.890) 6.094 7.523 ( 7.100 -0.000 -4.645) 8.484 7.741 ( 14.144 -0.000 2.449) 14.354 8.013 ( 6.866 -0.000 -1.714) 7.077 8.346 ( 6.223 -0.000 -9.669) 11.498 8.567 ( 10.038 -0.000 -9.559) 13.862 8.753 ( 2.552 -0.000 2.247) 3.400 8.758 ( 0.328 -0.000 1.963) 1.990 9.394 ( 6.841 -0.000 20.631) 21.736 9.622 ( 5.051 -0.000 -1.447) 5.254 9.957 ( 3.427 -0.000 -7.417) 8.170 10.046 ( 11.737 -0.000 2.053) 11.915 10.893 ( -0.112 0.000 1.990) 1.993 10.967 ( -7.096 0.000 -9.826) 12.120 12.390 ( 11.376 -0.000 17.672) 21.017 12.421 ( -5.091 0.000 -16.804) 17.558 13.053 ( -0.152 0.000 3.211) 3.215 13.085 ( -4.536 0.000 -6.452) 7.887 13.304 ( -3.012 0.000 10.469) 10.894 13.771 ( -14.140 0.000 1.281) 14.198 13.871 ( -6.831 0.000 -8.177) 10.655 14.021 ( -5.614 0.000 6.585) 8.653 14.920 ( 11.133 -0.000 -3.868) 11.786 15.193 ( 8.305 -0.000 -1.043) 8.371 17.710 ( 0.286 -0.000 -0.491) 0.568 17.831 ( -0.890 0.000 0.960) 1.309 ======================= Grid point 175 (78/117) ======================= q-point: (-0.30 0.60 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( -1.101 0.856 0.517) 1.488 1.582 ( -0.630 -1.004 -4.364) 4.522 1.831 ( -4.478 -0.334 0.344) 4.504 1.952 ( -7.128 -3.641 1.685) 8.180 1.987 ( -0.560 0.435 -0.479) 0.855 2.167 ( 0.266 -1.396 2.180) 2.603 2.190 ( 5.733 7.020 1.865) 9.253 2.334 ( 0.094 2.041 -1.577) 2.580 2.393 ( -2.554 -2.777 2.663) 4.618 2.451 ( -3.336 0.906 -3.227) 4.728 2.486 ( 2.523 5.707 -1.133) 6.342 2.553 ( -4.851 -4.997 -2.068) 7.265 2.667 ( -5.489 -1.333 0.393) 5.662 2.680 ( 2.676 -5.542 -2.040) 6.483 2.928 ( -1.009 1.463 -0.781) 1.941 2.950 ( -3.987 1.783 -1.410) 4.589 3.016 ( -1.285 0.610 -1.114) 1.807 3.078 ( -0.917 -5.133 2.168) 5.647 3.163 ( 2.668 -4.660 2.792) 6.052 3.486 ( -0.217 3.298 3.833) 5.061 3.613 ( 2.978 1.847 2.518) 4.315 3.643 ( -0.310 2.525 -0.340) 2.567 3.871 ( 4.807 6.631 0.655) 8.216 3.963 ( -1.032 4.913 0.667) 5.064 4.059 ( -1.220 0.814 -2.549) 2.941 4.150 ( 0.240 -4.982 -0.453) 5.009 4.279 ( 5.739 2.153 -0.136) 6.131 4.320 ( 3.387 2.904 2.238) 4.991 4.387 ( 0.854 -1.391 -0.856) 1.843 4.637 ( 1.814 -1.073 -8.781) 9.030 4.779 ( -4.042 0.939 0.038) 4.150 4.800 ( -5.472 -1.581 -3.877) 6.890 4.982 ( 4.777 -2.826 3.730) 6.687 5.110 ( 3.837 2.928 0.234) 4.832 5.204 ( 3.985 -6.371 -0.648) 7.542 5.356 ( 0.544 0.083 6.292) 6.316 5.653 ( 11.708 0.267 -3.256) 12.156 5.760 ( 16.444 1.016 -3.320) 16.806 5.875 ( 6.289 -0.224 4.844) 7.942 6.271 ( 0.820 0.476 2.718) 2.879 6.365 ( -5.835 -0.242 0.146) 5.842 6.470 ( -0.048 -0.533 -2.459) 2.516 6.625 ( 13.784 -2.178 -8.383) 16.279 6.711 ( 8.663 0.280 -5.416) 10.221 7.170 ( 7.596 -0.032 9.095) 11.850 7.232 ( 7.215 -1.811 12.021) 14.137 7.491 ( 0.377 -0.682 1.497) 1.687 7.658 ( 8.239 -0.429 -5.947) 10.170 7.958 ( 9.280 -0.464 4.693) 10.410 8.119 ( 4.688 -1.538 -0.586) 4.969 8.436 ( 5.341 0.431 -9.568) 10.967 8.672 ( 7.731 8.731 -4.899) 12.650 8.769 ( 1.661 1.018 1.884) 2.710 8.879 ( 5.937 -9.339 -3.220) 11.525 9.548 ( 10.781 5.546 17.622) 21.390 9.796 ( 11.806 -6.740 -1.994) 13.740 9.988 ( 4.354 4.152 -2.472) 6.504 10.286 ( 10.996 -3.578 2.131) 11.758 10.808 ( -5.025 2.739 -2.800) 6.371 10.960 ( -0.631 -11.015 -2.247) 11.259 12.321 ( -3.657 1.369 -17.422) 17.854 12.594 ( 11.200 3.581 15.420) 19.391 12.997 ( -4.709 0.276 -6.097) 7.709 13.042 ( -2.872 -3.818 4.017) 6.242 13.262 ( -0.907 3.650 5.375) 6.560 13.545 ( -12.229 -0.287 4.928) 13.188 13.727 ( -7.790 1.696 -10.505) 13.188 13.928 ( -5.678 0.521 6.322) 8.514 15.113 ( 10.404 -1.753 -4.891) 11.629 15.325 ( 6.563 -0.427 1.813) 6.822 17.719 ( 0.727 -0.206 -1.459) 1.643 17.808 ( -1.879 0.045 1.653) 2.503 ======================= Grid point 176 (79/117) ======================= q-point: (-0.20 0.60 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.429 ( 1.770 -1.433 -1.473) 2.712 1.626 ( 4.872 -0.756 -1.861) 5.270 1.768 ( -3.596 -1.319 0.265) 3.839 1.864 ( -7.582 -5.087 -0.026) 9.130 1.978 ( -2.016 -2.012 0.649) 2.921 2.116 ( -6.954 0.502 0.617) 6.999 2.227 ( 2.386 2.051 4.022) 5.107 2.301 ( -0.673 2.705 -0.734) 2.882 2.325 ( 0.355 4.391 -0.596) 4.445 2.379 ( -4.310 -1.513 -1.000) 4.676 2.471 ( 1.155 5.347 -4.427) 7.037 2.556 ( -2.683 1.146 -1.138) 3.131 2.649 ( 2.231 -6.643 0.306) 7.014 2.779 ( 2.688 -4.084 -1.322) 5.065 2.869 ( -2.080 0.146 2.605) 3.337 2.940 ( 1.902 -1.946 -2.540) 3.723 3.038 ( 2.445 -0.098 0.786) 2.570 3.131 ( 0.064 -7.323 2.538) 7.750 3.224 ( 0.157 -1.895 0.846) 2.081 3.464 ( 0.443 1.089 -0.425) 1.250 3.595 ( 0.958 7.890 3.359) 8.629 3.648 ( 2.968 2.454 0.879) 3.950 3.871 ( -4.271 5.309 1.137) 6.908 3.906 ( 1.561 2.840 -2.354) 4.006 3.997 ( 1.514 5.438 -0.698) 5.688 4.152 ( -6.475 -1.794 2.709) 7.244 4.299 ( 0.191 -1.538 1.079) 1.888 4.379 ( 5.103 3.798 -5.057) 8.126 4.445 ( 6.248 2.170 0.216) 6.617 4.661 ( -2.156 -2.280 -1.331) 3.408 4.696 ( -4.522 -2.294 -5.791) 7.697 4.744 ( -0.981 -0.086 -3.494) 3.630 5.069 ( 2.384 -1.991 4.305) 5.308 5.140 ( 1.952 1.696 -0.002) 2.586 5.337 ( 4.750 -6.700 -2.323) 8.535 5.361 ( -0.297 0.738 5.971) 6.024 5.803 ( 5.368 1.657 3.856) 6.814 5.981 ( 10.749 1.602 -3.551) 11.433 6.006 ( 7.868 -0.163 0.913) 7.922 6.265 ( -2.026 -0.132 0.515) 2.095 6.303 ( -0.783 -0.766 2.230) 2.485 6.415 ( -4.512 -0.249 -3.400) 5.655 6.772 ( 3.028 -0.950 -10.159) 10.643 6.852 ( 6.265 -1.050 -3.764) 7.384 7.301 ( 3.531 -1.150 12.431) 12.974 7.331 ( 2.930 -0.722 11.319) 11.714 7.569 ( 6.565 -3.223 -2.849) 7.849 7.775 ( 5.623 0.368 -6.384) 8.516 8.057 ( 1.819 -0.111 4.224) 4.600 8.203 ( 1.724 -4.335 2.067) 5.103 8.489 ( 3.077 2.508 -7.177) 8.202 8.703 ( 3.103 4.546 -3.205) 6.369 8.808 ( 4.987 3.433 0.395) 6.067 9.041 ( 3.944 -7.671 -4.215) 9.600 9.693 ( 10.584 7.763 9.268) 16.068 9.992 ( 3.427 2.355 -3.234) 5.268 10.116 ( 13.054 -4.651 6.248) 15.201 10.435 ( 5.792 3.798 2.414) 7.335 10.739 ( -3.836 -6.270 -1.564) 7.515 11.099 ( 2.842 -15.636 -0.484) 15.899 12.238 ( -2.501 1.332 -17.416) 17.645 12.709 ( 5.887 6.655 6.965) 11.289 12.893 ( -6.317 1.577 -2.347) 6.921 13.075 ( 0.874 -6.929 5.396) 8.826 13.219 ( 0.475 6.015 3.278) 6.867 13.367 ( -9.725 -0.439 5.964) 11.416 13.574 ( -4.964 3.927 -9.065) 11.056 13.843 ( -4.016 0.282 4.802) 6.266 15.277 ( 6.993 -1.795 -5.349) 8.985 15.423 ( 3.788 -1.009 3.268) 5.104 17.736 ( 1.058 -0.437 -1.666) 2.021 17.773 ( -2.105 0.206 1.743) 2.741 ======================= Grid point 177 (80/117) ======================= q-point: (-0.10 -0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.501 ( 4.304 -2.617 -1.601) 5.286 1.708 ( -6.981 -4.118 -0.639) 8.130 1.733 ( 6.886 2.074 1.985) 7.461 1.762 ( -8.466 -1.527 -5.490) 10.206 1.931 ( -6.107 -7.055 3.421) 9.938 2.040 ( -2.293 -3.908 0.854) 4.611 2.201 ( -2.324 0.727 -0.675) 2.527 2.270 ( 0.074 3.390 1.611) 3.754 2.327 ( -1.636 0.391 -3.261) 3.669 2.350 ( 2.662 1.415 -2.685) 4.036 2.467 ( 4.514 5.099 -0.975) 6.880 2.507 ( 0.346 3.235 2.300) 3.985 2.743 ( 2.292 -3.894 -0.037) 4.518 2.827 ( 1.100 -0.786 -0.355) 1.398 2.879 ( 0.573 -4.208 2.900) 5.142 3.023 ( 3.830 -3.468 -2.705) 5.832 3.077 ( 1.736 0.059 2.472) 3.021 3.195 ( -3.022 -0.956 2.249) 3.887 3.200 ( 0.797 -1.929 1.718) 2.703 3.465 ( 0.168 3.774 -3.476) 5.133 3.560 ( 2.550 4.524 2.815) 5.907 3.677 ( 0.572 2.816 0.387) 2.900 3.766 ( -2.511 0.297 1.539) 2.960 3.830 ( -3.496 4.290 -2.160) 5.941 4.026 ( -8.087 -0.108 3.298) 8.734 4.051 ( 6.547 3.328 -2.192) 7.664 4.279 ( -2.884 1.046 -4.647) 5.568 4.425 ( 4.062 0.202 -1.725) 4.418 4.522 ( 1.069 1.519 -1.453) 2.358 4.621 ( -3.089 -0.580 -4.514) 5.500 4.654 ( 0.911 -1.991 1.696) 2.770 4.753 ( 0.324 -1.153 -4.161) 4.330 5.112 ( 0.286 -1.144 5.615) 5.737 5.153 ( 0.907 0.489 -0.237) 1.058 5.345 ( -0.440 2.196 4.326) 4.871 5.461 ( 3.696 -4.001 -1.769) 5.727 5.801 ( -3.878 1.317 4.940) 6.417 6.051 ( -1.707 0.757 -3.976) 4.393 6.142 ( 6.339 -0.213 4.469) 7.759 6.248 ( -0.041 -0.571 -0.321) 0.657 6.298 ( -1.172 -0.374 0.742) 1.436 6.383 ( 2.545 0.978 -3.418) 4.372 6.749 ( -3.929 0.614 -9.755) 10.534 6.915 ( 0.421 -0.932 -3.339) 3.492 7.325 ( -1.151 -0.473 7.339) 7.444 7.398 ( 0.877 -2.324 12.374) 12.621 7.702 ( 4.834 -1.933 -3.652) 6.359 7.828 ( 2.240 1.048 -6.572) 7.021 8.059 ( -2.662 -2.101 4.636) 5.744 8.246 ( -1.568 -4.381 3.352) 5.735 8.478 ( -0.019 4.738 -5.245) 7.068 8.683 ( -2.436 0.819 -1.406) 2.929 8.861 ( 4.912 5.137 -0.382) 7.118 9.143 ( 2.475 -4.827 -6.748) 8.658 9.753 ( 2.878 8.720 5.425) 10.666 9.986 ( -0.743 3.425 1.452) 3.794 10.286 ( 4.112 7.330 3.835) 9.238 10.506 ( 6.233 -2.095 8.012) 10.365 10.774 ( -1.945 -11.032 -4.235) 11.976 11.290 ( 3.386 -13.472 0.952) 13.923 12.171 ( -2.694 0.746 -16.792) 17.023 12.730 ( 2.056 2.760 1.098) 3.613 12.758 ( -6.844 1.616 -1.166) 7.128 13.074 ( -5.096 2.574 3.383) 6.636 13.252 ( 0.027 4.785 -0.584) 4.821 13.256 ( 3.565 -3.370 11.037) 12.078 13.496 ( 0.148 2.083 -4.831) 5.263 13.807 ( -0.666 -0.965 3.109) 3.322 15.356 ( 1.790 0.489 -4.199) 4.591 15.476 ( 0.301 -1.848 2.557) 3.169 17.740 ( -1.403 0.260 1.026) 1.758 17.762 ( 1.581 -0.452 -0.960) 1.905 ======================= Grid point 185 (81/117) ======================= q-point: (-0.30 -0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.416 ( 0.709 -0.000 -0.857) 1.113 1.609 ( 4.602 -0.000 -1.739) 4.920 1.769 ( -2.456 0.000 -0.625) 2.535 1.792 ( -9.230 0.000 2.013) 9.446 1.964 ( -2.619 0.000 -1.492) 3.014 2.126 ( -6.862 0.000 1.919) 7.125 2.251 ( 0.195 -0.000 3.778) 3.783 2.317 ( 1.502 -0.000 -2.107) 2.588 2.322 ( -9.235 0.000 -1.130) 9.304 2.461 ( 0.987 -0.000 -2.719) 2.892 2.486 ( 1.999 -0.000 -0.595) 2.086 2.551 ( 1.768 -0.000 -2.389) 2.972 2.622 ( 2.440 -0.000 2.121) 3.233 2.714 ( 3.675 -0.000 -1.786) 4.086 2.889 ( -1.681 0.000 2.464) 2.983 2.912 ( -1.880 0.000 0.720) 2.013 3.047 ( 3.004 -0.000 -2.973) 4.227 3.056 ( 1.461 -0.000 -0.098) 1.464 3.194 ( 2.517 -0.000 2.472) 3.527 3.478 ( -1.163 0.000 -0.701) 1.358 3.655 ( 0.302 -0.000 -0.984) 1.030 3.679 ( 2.920 -0.000 3.840) 4.824 3.899 ( -1.563 0.000 2.340) 2.814 3.962 ( -4.730 0.000 -3.970) 6.176 4.065 ( -3.369 0.000 3.321) 4.731 4.126 ( 1.776 -0.000 -4.087) 4.456 4.282 ( 0.359 -0.000 8.661) 8.669 4.429 ( 6.209 -0.000 -4.557) 7.702 4.458 ( 3.089 -0.000 -0.127) 3.092 4.636 ( 0.102 -0.000 -3.554) 3.556 4.671 ( -6.699 0.000 -5.035) 8.380 4.742 ( -0.861 0.000 -3.618) 3.719 5.049 ( 3.449 -0.000 4.047) 5.318 5.180 ( -0.360 0.000 0.180) 0.403 5.246 ( 7.446 -0.000 -1.747) 7.649 5.369 ( 0.124 -0.000 5.119) 5.121 5.819 ( 6.051 -0.000 3.401) 6.941 5.999 ( 8.048 -0.000 0.895) 8.098 6.003 ( 10.365 -0.000 -3.544) 10.954 6.266 ( -4.407 0.000 -0.031) 4.407 6.293 ( 0.826 -0.000 2.946) 3.060 6.414 ( -3.967 0.000 -3.698) 5.423 6.758 ( 3.855 -0.000 -9.492) 10.245 6.847 ( 6.325 -0.000 -4.261) 7.626 7.290 ( 3.722 -0.000 12.912) 13.438 7.324 ( 2.652 -0.000 11.636) 11.935 7.541 ( 6.888 -0.000 -3.177) 7.585 7.777 ( 5.953 -0.000 -6.568) 8.865 8.063 ( 2.200 -0.000 6.213) 6.591 8.157 ( 0.989 -0.000 -0.902) 1.339 8.509 ( 3.685 -0.000 -7.849) 8.671 8.744 ( -1.009 0.000 1.991) 2.232 8.895 ( 6.204 -0.000 1.083) 6.298 8.919 ( 7.111 -0.000 -8.240) 10.884 9.811 ( 11.695 -0.000 21.322) 24.318 9.983 ( 12.775 -0.000 -12.254) 17.702 10.058 ( 4.732 -0.000 -1.106) 4.860 10.476 ( 9.409 -0.000 6.860) 11.644 10.736 ( -3.366 0.000 -4.162) 5.353 10.891 ( -1.066 0.000 1.708) 2.014 12.254 ( -2.721 0.000 -18.018) 18.223 12.785 ( 3.760 -0.000 5.006) 6.261 12.938 ( -6.180 0.000 4.382) 7.576 12.961 ( 3.612 -0.000 1.861) 4.063 13.298 ( 1.851 -0.000 1.739) 2.540 13.345 ( -11.270 0.000 7.203) 13.376 13.614 ( -4.860 0.000 -10.813) 11.855 13.843 ( -5.008 0.000 6.298) 8.046 15.257 ( 7.642 -0.000 -5.866) 9.634 15.416 ( 3.756 -0.000 3.617) 5.214 17.732 ( 1.087 -0.000 -1.753) 2.063 17.775 ( -2.106 0.000 1.825) 2.787 ======================= Grid point 186 (82/117) ======================= q-point: (-0.20 -0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.458 ( 3.191 -1.923 -0.575) 3.770 1.637 ( -9.506 -2.870 1.605) 10.058 1.689 ( -4.121 -3.645 -6.384) 8.428 1.753 ( 3.615 0.133 0.655) 3.676 1.893 ( -4.186 1.060 2.248) 4.868 1.985 ( -7.463 -2.076 0.948) 7.804 2.195 ( -4.755 -1.035 -0.940) 4.956 2.264 ( 0.043 -0.393 -0.901) 0.984 2.361 ( 3.946 0.839 2.127) 4.561 2.404 ( -2.450 2.748 -5.028) 6.232 2.537 ( 5.626 3.989 0.275) 6.903 2.613 ( 1.998 4.652 1.113) 5.184 2.661 ( 3.555 -2.420 1.369) 4.513 2.791 ( 2.699 -3.681 -0.016) 4.564 2.863 ( -0.607 1.806 5.254) 5.589 2.935 ( 1.115 -5.547 0.525) 5.683 3.092 ( 2.811 0.855 -0.457) 2.973 3.110 ( 2.716 -2.153 -0.299) 3.479 3.240 ( 2.570 0.541 -1.601) 3.075 3.464 ( -0.317 -0.670 -4.664) 4.723 3.644 ( -0.102 3.003 -0.765) 3.101 3.718 ( 1.591 0.469 3.454) 3.832 3.810 ( -7.845 3.689 4.939) 9.977 3.876 ( -4.147 0.611 -2.112) 4.694 3.998 ( -1.761 -0.984 1.134) 2.314 4.122 ( -0.107 1.814 -8.778) 8.964 4.318 ( 1.757 3.052 4.488) 5.705 4.452 ( 0.747 2.442 0.654) 2.636 4.538 ( -1.462 -0.285 -6.643) 6.808 4.581 ( 2.699 -3.397 -1.407) 4.562 4.620 ( -2.392 -0.685 -0.604) 2.560 4.744 ( 0.106 -0.121 -1.971) 1.978 5.098 ( 1.454 0.060 4.973) 5.182 5.164 ( -0.500 0.234 0.133) 0.567 5.369 ( 0.467 0.604 3.911) 3.985 5.388 ( 5.952 -3.104 -1.777) 6.944 5.827 ( -4.612 1.156 4.596) 6.613 6.062 ( -3.284 0.323 -3.616) 4.896 6.139 ( 6.169 -0.086 4.249) 7.491 6.242 ( 2.011 -0.132 -0.828) 2.179 6.287 ( -1.488 -0.544 0.964) 1.855 6.399 ( 3.007 0.588 -3.437) 4.604 6.752 ( -2.737 -0.124 -10.025) 10.392 6.905 ( 0.802 -0.162 -3.628) 3.719 7.327 ( -0.491 0.800 8.246) 8.300 7.355 ( -0.052 -2.251 10.275) 10.519 7.679 ( 6.991 -0.671 -1.652) 7.215 7.838 ( 2.098 0.206 -7.390) 7.685 8.049 ( -3.528 0.650 5.542) 6.602 8.168 ( -1.348 -3.476 0.722) 3.798 8.536 ( 0.752 1.612 -5.560) 5.837 8.699 ( -4.042 0.654 2.753) 4.933 8.950 ( 4.384 4.496 1.108) 6.377 9.062 ( 5.876 -4.135 -8.250) 10.940 9.934 ( 5.580 9.892 10.377) 15.384 10.031 ( -0.228 1.436 -2.284) 2.708 10.310 ( 14.392 -6.145 -3.894) 16.126 10.567 ( 2.096 1.765 7.853) 8.317 10.652 ( -2.584 8.057 0.586) 8.481 10.985 ( 1.163 -19.326 1.485) 19.418 12.189 ( -2.374 0.882 -17.452) 17.635 12.746 ( -4.846 -0.243 -5.425) 7.278 12.816 ( -5.651 3.262 4.071) 7.690 13.112 ( 2.602 0.446 6.234) 6.770 13.197 ( -0.871 -1.695 10.695) 10.864 13.323 ( 1.472 2.356 -0.048) 2.778 13.543 ( -0.900 2.263 -7.707) 8.083 13.785 ( -2.451 -1.163 4.759) 5.478 15.350 ( 3.198 -0.613 -6.228) 7.028 15.457 ( 0.279 -0.386 4.537) 4.562 17.743 ( -1.551 0.117 1.342) 2.055 17.756 ( 1.802 -0.224 -1.305) 2.236 ======================= Grid point 187 (83/117) ======================= q-point: (-0.10 -0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.468 ( -14.217 -6.760 0.842) 15.764 1.517 ( -12.908 -7.951 -3.312) 15.518 1.571 ( 3.555 -0.476 -4.972) 6.130 1.795 ( -5.027 0.705 -1.114) 5.197 1.845 ( 1.132 -4.371 1.360) 4.716 2.010 ( 5.581 -3.135 3.673) 7.380 2.165 ( -0.201 -0.878 0.556) 1.059 2.265 ( 0.469 -0.633 -2.579) 2.697 2.340 ( -0.773 3.897 -1.772) 4.350 2.440 ( 5.422 2.178 1.005) 5.929 2.570 ( 1.198 6.880 3.608) 7.860 2.610 ( 5.786 3.976 0.263) 7.025 2.753 ( 2.603 -3.898 1.344) 4.876 2.827 ( -3.969 -0.570 8.582) 9.473 2.866 ( 2.350 -2.748 -0.692) 3.682 3.019 ( 1.599 -7.467 -0.100) 7.637 3.121 ( 1.307 1.726 1.969) 2.926 3.158 ( 1.631 0.140 -0.595) 1.741 3.254 ( 2.230 5.111 -3.533) 6.602 3.462 ( -1.088 -1.084 -5.471) 5.683 3.601 ( -1.931 1.657 -3.043) 3.967 3.648 ( -4.348 2.675 2.937) 5.889 3.745 ( -0.772 -0.201 0.826) 1.148 3.814 ( -0.454 2.540 -2.540) 3.621 3.981 ( 0.874 4.614 -0.541) 4.727 4.100 ( -1.687 -1.143 -8.259) 8.507 4.285 ( 0.391 5.598 1.843) 5.907 4.440 ( -2.553 -1.363 -2.951) 4.133 4.468 ( -3.947 -1.948 -2.982) 5.316 4.614 ( 2.863 1.339 1.684) 3.581 4.713 ( -1.019 0.953 4.341) 4.560 4.732 ( 5.635 -4.273 -3.205) 7.765 5.099 ( -1.272 0.535 5.105) 5.288 5.171 ( 0.555 -0.983 1.235) 1.673 5.370 ( 0.905 1.902 0.992) 2.328 5.492 ( 2.566 -1.933 0.116) 3.215 5.690 ( -9.855 0.850 2.930) 10.316 5.928 ( -9.952 -0.150 -4.462) 10.908 6.154 ( -4.317 -0.357 6.242) 7.598 6.263 ( -2.700 -0.726 2.645) 3.849 6.329 ( 5.856 1.063 2.171) 6.336 6.443 ( 2.397 0.234 -5.402) 5.914 6.671 ( -4.072 1.990 -11.845) 12.682 6.876 ( -3.771 -0.591 -4.493) 5.895 7.273 ( -6.055 -0.338 5.593) 8.250 7.391 ( 0.251 -1.812 7.422) 7.644 7.747 ( 0.373 0.545 0.401) 0.772 7.833 ( -1.358 0.116 -8.664) 8.771 7.970 ( -6.125 -1.647 5.724) 8.543 8.174 ( -1.901 -4.252 2.116) 5.115 8.480 ( -3.971 4.439 -3.734) 7.030 8.601 ( -7.096 0.199 2.454) 7.511 8.969 ( 2.146 4.203 2.525) 5.353 9.170 ( 4.991 -1.293 -10.975) 12.126 9.864 ( -2.166 14.013 5.342) 15.152 9.984 ( -2.699 3.443 0.846) 4.455 10.415 ( -2.696 16.436 3.140) 16.949 10.581 ( 3.540 -4.081 13.169) 14.234 10.648 ( 0.529 -10.483 -8.813) 13.706 11.206 ( 3.609 -19.740 2.836) 20.266 12.113 ( -3.441 1.751 -15.501) 15.974 12.635 ( -7.288 -0.567 -3.172) 7.969 12.720 ( -4.409 0.279 3.884) 5.883 13.036 ( -1.891 2.124 -0.033) 2.844 13.293 ( 1.147 4.072 2.208) 4.772 13.374 ( 8.236 -0.423 7.688) 11.275 13.541 ( 3.901 1.204 -2.101) 4.592 13.801 ( 1.976 -2.741 2.197) 4.030 15.355 ( -1.935 0.620 -5.345) 5.718 15.442 ( -3.264 -0.751 4.074) 5.274 17.724 ( -0.588 -0.010 0.405) 0.715 17.796 ( 2.685 0.007 -0.418) 2.718 ======================= Grid point 196 (84/117) ======================= q-point: (-0.20 -0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.369 ( -12.904 0.000 7.891) 15.126 1.463 ( -17.117 0.000 -10.083) 19.866 1.567 ( 3.375 -0.000 -5.557) 6.501 1.784 ( -0.842 0.000 -1.949) 2.123 1.826 ( -6.712 0.000 0.704) 6.749 1.980 ( 8.207 -0.000 4.427) 9.325 2.155 ( 0.959 -0.000 2.368) 2.555 2.261 ( -0.180 0.000 -1.992) 2.001 2.375 ( -1.889 0.000 -0.697) 2.014 2.461 ( 6.699 -0.000 1.486) 6.862 2.657 ( 1.068 -0.000 2.306) 2.541 2.665 ( 5.904 -0.000 1.218) 6.028 2.715 ( 2.673 -0.000 2.232) 3.482 2.815 ( 2.958 -0.000 0.053) 2.959 2.828 ( -7.324 0.000 8.047) 10.881 2.932 ( 2.953 -0.000 -0.081) 2.954 3.138 ( 2.024 -0.000 0.290) 2.045 3.160 ( 3.327 -0.000 -2.129) 3.950 3.312 ( 5.073 -0.000 -4.241) 6.613 3.427 ( -2.414 0.000 -6.755) 7.173 3.632 ( -3.121 0.000 -6.277) 7.010 3.665 ( -6.352 0.000 4.073) 7.546 3.747 ( 0.671 -0.000 4.191) 4.244 3.842 ( 0.213 -0.000 -2.747) 2.755 4.046 ( 4.422 -0.000 1.385) 4.633 4.068 ( -3.305 0.000 -11.619) 12.080 4.380 ( 1.581 -0.000 3.927) 4.233 4.404 ( -6.443 0.000 2.009) 6.749 4.439 ( -5.324 0.000 -7.858) 9.492 4.633 ( 2.702 -0.000 0.390) 2.730 4.679 ( 7.731 -0.000 -3.081) 8.322 4.723 ( -1.765 0.000 5.955) 6.211 5.128 ( 0.759 -0.000 6.026) 6.073 5.138 ( -1.710 0.000 0.545) 1.795 5.387 ( 1.056 -0.000 -0.462) 1.153 5.469 ( 4.077 -0.000 0.774) 4.150 5.701 ( -10.172 0.000 2.935) 10.587 5.927 ( -10.003 0.000 -4.699) 11.052 6.152 ( -4.431 0.000 6.589) 7.940 6.254 ( -2.924 0.000 2.838) 4.075 6.340 ( 6.488 -0.000 2.337) 6.896 6.444 ( 1.377 -0.000 -5.627) 5.793 6.690 ( -2.384 0.000 -12.263) 12.493 6.870 ( -4.205 0.000 -4.988) 6.524 7.270 ( -6.645 0.000 5.126) 8.392 7.373 ( 1.454 -0.000 6.858) 7.011 7.750 ( 0.941 -0.000 1.261) 1.574 7.833 ( -1.638 0.000 -9.143) 9.288 7.961 ( -7.278 0.000 6.226) 9.578 8.127 ( -1.075 0.000 1.181) 1.597 8.523 ( -2.732 0.000 -4.466) 5.235 8.602 ( -7.800 0.000 4.910) 9.217 9.009 ( 0.846 -0.000 5.892) 5.952 9.157 ( 7.447 -0.000 -13.561) 15.471 10.011 ( -1.994 0.000 -0.895) 2.186 10.032 ( -0.943 0.000 5.950) 6.024 10.491 ( 11.010 -0.000 -11.859) 16.182 10.557 ( -1.813 0.000 14.241) 14.356 10.759 ( -6.589 0.000 -1.316) 6.719 10.836 ( 4.120 -0.000 9.438) 10.298 12.131 ( -2.988 0.000 -16.245) 16.517 12.625 ( -7.829 0.000 -2.293) 8.158 12.731 ( -5.609 0.000 3.305) 6.510 13.058 ( -3.659 0.000 0.119) 3.661 13.349 ( -0.192 0.000 0.622) 0.651 13.350 ( 11.605 -0.000 10.866) 15.897 13.563 ( 2.662 -0.000 -4.267) 5.030 13.771 ( 1.508 -0.000 3.080) 3.429 15.357 ( -1.419 0.000 -6.741) 6.889 15.436 ( -3.049 0.000 5.550) 6.332 17.724 ( -0.730 0.000 0.549) 0.913 17.796 ( 3.023 -0.000 -0.592) 3.081 ======================= Grid point 197 (85/117) ======================= q-point: (-0.10 -0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.136 ( -18.841 -3.058 -1.549) 19.150 1.176 ( -15.984 -9.554 6.287) 19.654 1.558 ( -4.493 -0.774 -12.633) 13.430 1.731 ( -4.788 -2.913 -11.049) 12.390 1.817 ( 4.825 -0.344 6.252) 7.905 2.099 ( -0.927 -2.253 8.049) 8.410 2.190 ( 1.382 0.224 10.046) 10.143 2.272 ( 1.175 -0.482 0.924) 1.571 2.343 ( 0.975 0.660 3.717) 3.899 2.558 ( 4.686 3.786 -1.076) 6.119 2.612 ( -5.354 4.150 6.700) 9.527 2.704 ( 1.736 2.105 -0.961) 2.893 2.764 ( 3.488 0.642 2.496) 4.336 2.776 ( 3.139 -2.827 1.389) 4.447 2.896 ( 3.906 -3.187 -1.756) 5.338 3.007 ( 3.165 -3.938 -2.873) 5.812 3.159 ( 1.359 2.233 -0.815) 2.738 3.196 ( 0.860 0.339 -1.900) 2.113 3.348 ( 3.041 5.285 -5.149) 7.981 3.433 ( 1.971 -3.672 -6.126) 7.409 3.522 ( -6.845 1.231 -13.318) 15.025 3.634 ( 1.688 1.257 0.423) 2.147 3.763 ( 1.335 2.330 1.584) 3.118 3.848 ( 0.807 1.118 -1.305) 1.898 4.026 ( 0.741 2.024 -4.858) 5.314 4.082 ( -0.736 3.635 1.303) 3.931 4.286 ( -4.974 -1.625 1.890) 5.563 4.360 ( -3.472 -1.392 -5.758) 6.866 4.419 ( 2.245 -0.196 1.491) 2.702 4.610 ( -4.296 -0.409 4.941) 6.561 4.768 ( 6.107 2.072 4.271) 7.735 4.817 ( 6.112 -2.919 -1.843) 7.019 5.096 ( -0.819 2.436 2.374) 3.498 5.160 ( 0.049 -2.740 4.575) 5.333 5.384 ( -2.001 0.402 -4.053) 4.538 5.487 ( -4.136 0.892 3.158) 5.280 5.518 ( -9.038 0.178 1.390) 9.146 5.751 ( -9.009 0.130 -4.539) 10.089 6.035 ( -9.152 -0.571 9.762) 13.394 6.180 ( -6.306 -0.712 3.864) 7.429 6.408 ( 1.061 1.663 -1.514) 2.487 6.441 ( -0.743 -1.349 -7.307) 7.468 6.629 ( -3.229 3.514 -9.196) 10.361 6.759 ( -8.137 -1.925 -8.223) 11.727 7.131 ( -9.862 -0.576 1.237) 9.956 7.380 ( -2.578 0.168 6.069) 6.596 7.707 ( -5.370 0.642 5.307) 7.577 7.781 ( -2.786 -0.936 -8.949) 9.419 7.847 ( -6.346 -1.070 4.524) 7.867 8.131 ( -0.148 -2.146 1.182) 2.455 8.412 ( -8.418 4.598 -0.256) 9.596 8.461 ( -8.694 -1.010 2.090) 8.998 9.019 ( 0.865 1.626 5.138) 5.458 9.258 ( 6.110 1.282 -14.264) 15.571 9.939 ( -3.193 12.470 3.558) 13.355 9.967 ( -2.312 2.774 0.271) 3.622 10.463 ( -9.456 18.474 1.879) 20.838 10.524 ( -5.055 -1.650 11.013) 12.230 10.682 ( 7.801 -3.428 -7.754) 11.521 11.079 ( 4.847 -25.858 7.900) 27.469 12.047 ( -4.413 1.465 -12.497) 13.333 12.491 ( -7.936 -1.617 1.259) 8.197 12.648 ( -3.975 0.527 3.505) 5.326 13.035 ( 1.184 -0.720 -4.979) 5.169 13.323 ( -0.946 2.041 3.083) 3.816 13.537 ( 7.876 1.771 3.545) 8.817 13.653 ( 9.384 -0.828 5.411) 10.864 13.845 ( 5.469 -1.977 -0.060) 5.816 15.285 ( -5.976 0.190 -6.538) 8.859 15.368 ( -5.315 0.222 6.021) 8.034 17.721 ( 0.379 -0.150 -0.797) 0.895 17.855 ( 3.863 0.567 0.515) 3.938 ======================= Grid point 207 (86/117) ======================= q-point: (-0.10 -0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.790 ( -18.227 0.000 4.862) 18.864 0.863 ( -15.983 0.000 15.174) 22.039 1.447 ( -4.825 0.000 -16.900) 17.575 1.602 ( -5.920 0.000 -15.044) 16.167 1.780 ( -28.775 0.000 26.963) 39.434 1.951 ( 7.905 -0.000 7.753) 11.072 2.281 ( 5.961 -0.000 2.794) 6.583 2.347 ( 7.241 -0.000 1.486) 7.392 2.398 ( 1.429 -0.000 6.447) 6.603 2.611 ( 3.326 -0.000 0.710) 3.401 2.631 ( 1.251 -0.000 -1.549) 1.991 2.754 ( 4.057 -0.000 -2.507) 4.769 2.828 ( 2.554 -0.000 4.396) 5.085 2.833 ( 3.242 -0.000 0.558) 3.290 2.945 ( 2.958 -0.000 -8.395) 8.901 3.024 ( 0.953 -0.000 -6.808) 6.874 3.170 ( -2.057 0.000 -12.301) 12.472 3.206 ( 2.422 -0.000 -1.475) 2.836 3.360 ( -2.054 0.000 -7.388) 7.668 3.474 ( 4.389 -0.000 -7.260) 8.484 3.482 ( 3.473 -0.000 -3.121) 4.670 3.697 ( 2.157 -0.000 -5.654) 6.051 3.798 ( 1.101 -0.000 -0.386) 1.167 3.844 ( -1.759 0.000 3.071) 3.539 4.024 ( -3.802 0.000 0.668) 3.860 4.080 ( -2.602 0.000 1.751) 3.136 4.202 ( 0.013 -0.000 2.460) 2.460 4.303 ( -1.674 0.000 -4.456) 4.760 4.508 ( 6.947 -0.000 0.395) 6.958 4.544 ( -2.685 0.000 7.944) 8.386 4.870 ( 2.175 -0.000 3.680) 4.274 4.875 ( 3.049 -0.000 -0.790) 3.149 5.110 ( -1.097 0.000 0.698) 1.300 5.153 ( 0.535 -0.000 5.843) 5.867 5.277 ( -5.162 0.000 -6.791) 8.530 5.366 ( -11.068 0.000 1.125) 11.125 5.411 ( -5.052 0.000 0.199) 5.056 5.619 ( -7.687 0.000 0.979) 7.750 5.894 ( -6.656 0.000 9.595) 11.678 6.073 ( -4.935 0.000 0.569) 4.968 6.372 ( -4.179 0.000 -12.670) 13.341 6.393 ( -5.701 0.000 -4.558) 7.300 6.534 ( -14.107 0.000 -9.242) 16.865 6.582 ( -4.499 0.000 -2.284) 5.045 6.947 ( -10.633 0.000 0.630) 10.651 7.291 ( -8.136 0.000 4.893) 9.494 7.623 ( -5.159 0.000 7.374) 9.000 7.726 ( -1.360 0.000 -6.059) 6.209 7.772 ( -1.863 0.000 2.503) 3.120 8.115 ( -1.206 0.000 -2.492) 2.768 8.260 ( -11.787 0.000 6.853) 13.635 8.318 ( -6.884 0.000 -2.105) 7.199 9.049 ( 1.181 -0.000 4.876) 5.017 9.351 ( 5.236 -0.000 -15.054) 15.939 9.957 ( -0.649 0.000 0.346) 0.735 9.966 ( -1.098 0.000 0.872) 1.402 10.424 ( -6.843 0.000 10.411) 12.459 10.428 ( -7.916 0.000 -3.393) 8.612 10.777 ( 5.551 -0.000 -10.785) 12.129 11.010 ( 4.061 -0.000 12.646) 13.282 11.974 ( -2.460 0.000 -0.634) 2.540 12.357 ( -6.653 0.000 4.203) 7.870 12.608 ( -1.564 0.000 4.421) 4.690 13.061 ( 3.222 -0.000 -8.376) 8.974 13.327 ( 1.150 -0.000 6.931) 7.026 13.646 ( 4.033 -0.000 2.741) 4.876 13.867 ( 13.873 -0.000 9.674) 16.913 13.945 ( 6.931 -0.000 -2.992) 7.549 15.144 ( -9.444 0.000 -6.152) 11.271 15.284 ( -5.044 0.000 6.407) 8.154 17.736 ( 1.730 -0.000 -2.101) 2.722 17.934 ( 4.621 -0.000 0.891) 4.706 ======================= Grid point 208 (87/117) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 62 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.011 ( 4.697 -0.000 -20.722) 21.248 1.011 ( -4.697 0.000 20.722) 21.248 1.024 ( 1.883 -0.000 -23.540) 23.616 1.024 ( -1.883 0.000 23.540) 23.616 1.971 ( -0.970 0.000 -43.645) 43.655 1.971 ( 0.970 -0.000 43.645) 43.655 2.306 ( -2.181 0.000 -4.947) 5.407 2.306 ( 2.181 -0.000 4.947) 5.407 2.555 ( -0.023 0.000 -6.022) 6.022 2.555 ( 0.023 -0.000 6.022) 6.022 2.700 ( -0.333 0.000 -4.178) 4.192 2.700 ( 0.333 -0.000 4.178) 4.192 2.809 ( 1.381 -0.000 -3.316) 3.592 2.809 ( -1.381 0.000 3.316) 3.592 2.972 ( 1.337 -0.000 -2.071) 2.466 2.972 ( -1.337 0.000 2.071) 2.466 3.233 ( -7.326 0.000 0.515) 7.344 3.233 ( 7.326 -0.000 -0.515) 7.344 3.333 ( -0.961 0.000 -1.016) 1.398 3.333 ( 0.961 -0.000 1.016) 1.398 3.605 ( -6.201 0.000 -0.922) 6.269 3.605 ( 6.201 -0.000 0.922) 6.269 3.764 ( 1.763 -0.000 -5.294) 5.580 3.764 ( -1.763 0.000 5.294) 5.580 4.063 ( -2.833 0.000 -0.382) 2.858 4.063 ( 2.833 -0.000 0.382) 2.858 4.248 ( 1.288 -0.000 -1.705) 2.137 4.248 ( -1.288 0.000 1.705) 2.137 4.756 ( -1.959 0.000 0.338) 1.988 4.756 ( 1.959 -0.000 -0.338) 1.988 4.884 ( -3.288 0.000 -6.154) 6.977 4.884 ( 3.288 -0.000 6.154) 6.977 4.972 ( 1.826 -0.000 -3.041) 3.547 4.972 ( -1.826 0.000 3.041) 3.547 5.094 ( -0.278 0.000 -5.421) 5.428 5.094 ( 0.278 -0.000 5.421) 5.428 5.386 ( 5.971 -0.000 -4.190) 7.294 5.386 ( -5.971 0.000 4.190) 7.294 5.979 ( 3.798 -0.000 -2.682) 4.649 5.979 ( -3.798 0.000 2.682) 4.649 6.077 ( -0.824 0.000 -4.863) 4.932 6.077 ( 0.824 -0.000 4.863) 4.932 6.438 ( -4.780 0.000 -0.531) 4.810 6.438 ( 4.780 -0.000 0.531) 4.810 6.997 ( -8.805 0.000 -3.451) 9.457 6.997 ( 8.805 -0.000 3.451) 9.457 7.660 ( -0.231 0.000 -4.996) 5.001 7.660 ( 0.231 -0.000 4.996) 5.001 7.851 ( 0.283 -0.000 -4.960) 4.968 7.851 ( -0.283 0.000 4.960) 4.968 8.154 ( 1.636 -0.000 -7.602) 7.776 8.154 ( -1.636 0.000 7.602) 7.776 9.205 ( 2.010 -0.000 -9.615) 9.823 9.205 ( -2.010 0.000 9.615) 9.823 9.964 ( 0.598 -0.000 -0.746) 0.956 9.964 ( -0.598 0.000 0.746) 0.956 10.247 ( 4.879 -0.000 -2.290) 5.390 10.247 ( -4.879 0.000 2.290) 5.390 10.778 ( 9.798 -0.000 -9.812) 13.866 10.778 ( -9.798 0.000 9.812) 13.866 12.312 ( 4.200 -0.000 -5.123) 6.624 12.312 ( -4.200 0.000 5.123) 6.624 12.935 ( 0.449 -0.000 -11.467) 11.476 12.935 ( -0.449 0.000 11.467) 11.476 13.871 ( 0.974 -0.000 -7.163) 7.229 13.871 ( -0.974 0.000 7.163) 7.229 14.106 ( -20.203 0.000 1.282) 20.243 14.106 ( 20.203 -0.000 -1.282) 20.243 14.981 ( -13.739 0.000 -1.506) 13.822 14.981 ( 13.739 -0.000 1.506) 13.822 17.830 ( -7.085 0.000 0.099) 7.086 17.830 ( 7.085 -0.000 -0.099) 7.086 ======================= Grid point 210 (88/117) ======================= q-point: ( 0.10 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.998 ( 0.895 -2.591 18.868) 19.066 1.050 ( 1.400 -3.372 -17.119) 17.504 1.105 ( 5.423 -5.581 17.342) 19.008 1.126 ( 7.908 -7.811 -20.742) 23.533 2.065 ( 10.581 -4.410 -25.956) 28.375 2.162 ( 9.667 -4.423 32.924) 34.598 2.229 ( -4.004 0.014 0.761) 4.075 2.337 ( 3.298 -0.913 -5.516) 6.491 2.542 ( -0.141 3.712 0.729) 3.785 2.562 ( 1.566 1.140 -1.794) 2.640 2.594 ( -8.379 2.694 -5.164) 10.204 2.660 ( -5.450 -1.151 4.443) 7.125 2.797 ( -1.770 1.052 -0.395) 2.097 2.819 ( 0.924 -0.884 1.361) 1.867 2.947 ( -1.645 -1.407 2.458) 3.276 2.979 ( -0.017 -1.719 -4.691) 4.996 3.088 ( -7.535 -1.548 1.588) 7.854 3.237 ( -2.966 1.274 0.175) 3.233 3.363 ( 1.746 0.688 -3.017) 3.553 3.432 ( -5.056 0.946 3.602) 6.280 3.492 ( 5.852 0.468 -0.703) 5.913 3.597 ( -3.847 2.507 -2.836) 5.397 3.737 ( 0.441 5.831 3.839) 6.995 3.833 ( 5.514 2.108 -1.529) 6.098 3.996 ( -3.417 2.173 1.492) 4.316 4.082 ( 0.331 2.062 0.347) 2.117 4.248 ( -0.499 -3.174 0.447) 3.244 4.277 ( 0.219 -2.600 -1.162) 2.856 4.597 ( -8.574 1.494 2.230) 8.984 4.648 ( -7.060 -1.074 2.016) 7.421 4.903 ( -1.664 1.667 1.124) 2.609 4.939 ( 2.282 -0.422 -3.677) 4.348 5.035 ( 6.634 -0.235 0.877) 6.696 5.087 ( 9.739 -0.123 3.489) 10.346 5.159 ( 1.864 -0.122 2.712) 3.293 5.185 ( 7.411 -2.299 -0.694) 7.791 5.322 ( 1.421 1.268 0.908) 2.110 5.492 ( 7.713 1.757 -2.802) 8.392 5.896 ( -2.573 0.309 5.446) 6.031 6.024 ( 4.255 -1.925 -8.860) 10.015 6.168 ( 8.644 2.098 -0.218) 8.897 6.247 ( 14.268 -1.378 0.150) 14.335 6.373 ( -2.215 -0.248 -4.910) 5.392 6.519 ( 4.102 -0.138 -0.685) 4.161 6.926 ( 0.445 -0.873 -4.286) 4.396 7.202 ( 13.612 1.007 -4.787) 14.465 7.654 ( -1.277 0.081 2.991) 3.253 7.670 ( 3.371 1.487 -5.024) 6.230 7.855 ( 0.154 -0.796 -4.466) 4.539 7.888 ( 5.382 1.895 7.134) 9.136 8.173 ( 2.831 1.065 6.450) 7.124 8.223 ( 7.814 1.923 -6.498) 10.343 9.139 ( -3.563 6.221 7.513) 10.384 9.210 ( 1.021 1.636 -8.663) 8.875 9.890 ( 0.739 12.806 -0.268) 12.830 9.925 ( 1.137 9.436 1.056) 9.563 10.208 ( 2.271 3.333 -0.721) 4.097 10.295 ( 4.940 9.808 9.132) 14.282 10.742 ( -5.744 -18.583 4.308) 19.921 10.997 ( 7.176 -12.445 2.184) 14.531 12.245 ( -3.443 1.368 -1.314) 3.930 12.378 ( 4.562 1.378 -5.892) 7.578 12.880 ( -3.330 2.594 -12.219) 12.927 12.946 ( -0.281 -2.243 4.180) 4.752 13.658 ( -18.279 1.063 -7.060) 19.623 13.814 ( -5.308 1.787 -3.234) 6.467 13.903 ( -4.924 -2.377 7.366) 9.173 14.232 ( -8.560 -0.012 -4.989) 9.908 14.869 ( 3.391 -1.494 7.079) 7.990 15.194 ( 10.187 0.701 2.610) 10.539 17.731 ( -3.529 -0.126 2.384) 4.261 17.912 ( 2.026 1.513 2.871) 3.826 ======================= Grid point 211 (89/117) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.094 ( 5.104 -4.589 -10.989) 12.957 1.155 ( 7.221 -5.962 8.648) 12.746 1.322 ( 9.727 -8.879 15.707) 20.498 1.368 ( 11.044 -12.756 -15.925) 23.201 2.072 ( -7.765 0.081 -4.874) 9.168 2.187 ( -0.523 -1.452 3.235) 3.584 2.356 ( -0.869 3.142 0.171) 3.264 2.392 ( -5.535 3.332 -2.321) 6.865 2.463 ( -1.380 2.132 2.731) 3.729 2.529 ( -0.243 1.668 2.731) 3.209 2.612 ( 9.184 -5.408 -7.069) 12.789 2.671 ( 6.113 -3.483 7.867) 10.554 2.770 ( 1.910 -2.247 -0.350) 2.969 2.843 ( 0.850 0.090 -0.554) 1.019 2.894 ( -3.774 0.087 3.366) 5.057 2.967 ( -5.629 -2.967 -5.618) 8.488 3.043 ( -1.128 -1.908 1.054) 2.454 3.165 ( 0.264 1.807 -2.528) 3.118 3.309 ( -3.966 3.587 -0.208) 5.351 3.368 ( -0.734 0.487 2.077) 2.256 3.478 ( -4.293 3.850 -4.197) 7.133 3.609 ( 3.972 0.059 -0.684) 4.031 3.700 ( 1.599 6.188 3.888) 7.481 3.839 ( -2.414 2.973 -0.088) 3.831 3.936 ( -0.360 3.551 3.331) 4.882 4.046 ( -1.516 3.113 0.815) 3.558 4.273 ( 0.564 -1.830 -1.266) 2.295 4.302 ( 0.700 -2.475 1.293) 2.878 4.476 ( -5.598 0.320 2.360) 6.083 4.606 ( 0.791 -0.658 1.249) 1.618 4.856 ( -3.045 0.310 2.023) 3.669 4.939 ( -1.853 1.153 -4.509) 5.009 5.113 ( -2.592 -1.531 2.728) 4.063 5.200 ( 6.003 -0.354 0.405) 6.027 5.204 ( 6.264 -0.574 0.637) 6.323 5.366 ( 10.792 -0.844 0.504) 10.836 5.400 ( 8.217 2.616 -1.702) 8.790 5.574 ( 3.181 2.682 2.040) 4.634 5.950 ( 7.365 -0.367 9.497) 12.024 6.135 ( 6.456 -2.301 -8.373) 10.820 6.296 ( 8.180 1.285 -1.342) 8.389 6.351 ( -0.382 -0.094 -5.768) 5.781 6.514 ( 12.680 1.184 -3.415) 13.185 6.578 ( 4.628 -0.597 -0.288) 4.676 7.006 ( 7.030 -2.675 -0.459) 7.536 7.377 ( 8.447 2.011 -6.616) 10.917 7.639 ( -0.648 0.214 4.855) 4.903 7.739 ( 6.709 3.274 -5.449) 9.242 7.884 ( 2.638 -3.623 -5.059) 6.759 8.004 ( 8.037 0.802 7.367) 10.932 8.227 ( 4.602 2.651 2.817) 6.012 8.349 ( 9.855 4.149 -3.892) 11.379 9.014 ( -3.579 8.400 7.717) 11.955 9.199 ( 0.439 1.747 -7.611) 7.821 9.795 ( 4.173 17.886 -3.750) 18.745 9.893 ( 2.990 5.523 2.198) 6.654 10.244 ( 5.230 4.020 -1.478) 6.760 10.308 ( 4.097 5.785 15.748) 17.270 10.838 ( -1.834 -14.965 -4.272) 15.671 11.197 ( 3.178 -10.800 8.970) 14.394 12.160 ( -3.407 3.191 -10.541) 11.529 12.430 ( 4.125 2.272 -1.766) 5.029 12.809 ( -2.125 -2.477 -13.999) 14.374 12.969 ( 0.021 -2.422 3.696) 4.419 13.419 ( -8.109 1.217 -2.885) 8.692 13.672 ( -7.594 3.144 -2.055) 8.472 13.851 ( -5.219 -2.383 7.228) 9.228 13.985 ( -16.317 -2.973 1.279) 16.635 15.021 ( 9.299 -0.469 5.202) 10.665 15.333 ( 7.644 1.766 -0.866) 7.893 17.710 ( -0.015 -0.327 0.665) 0.741 17.891 ( -2.348 1.471 1.971) 3.400 ======================= Grid point 212 (90/117) ======================= q-point: ( 0.30 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.255 ( 8.885 -6.253 -5.604) 12.225 1.353 ( 8.779 -3.360 5.789) 11.039 1.593 ( 9.495 -9.045 10.076) 16.538 1.660 ( 9.923 -13.455 -10.925) 19.971 1.951 ( -5.331 -1.883 -4.239) 7.066 2.151 ( -4.046 0.594 3.078) 5.118 2.227 ( -5.572 3.079 -1.148) 6.468 2.272 ( -4.903 3.159 1.084) 5.932 2.389 ( -5.481 1.535 -2.510) 6.221 2.457 ( -2.210 4.179 0.773) 4.790 2.626 ( -5.875 2.531 1.989) 6.699 2.711 ( -4.334 2.531 -3.668) 6.216 2.815 ( -3.095 0.014 1.987) 3.678 2.856 ( -1.797 0.445 3.707) 4.143 2.969 ( 3.405 -2.110 -3.550) 5.352 3.006 ( 6.791 -8.852 8.490) 14.020 3.081 ( 2.581 -3.177 0.584) 4.135 3.220 ( 4.154 3.452 -3.577) 6.478 3.261 ( 5.213 -1.843 -5.578) 7.854 3.327 ( -1.525 3.708 -2.310) 4.627 3.420 ( 1.293 -0.427 0.069) 1.363 3.632 ( 0.075 2.329 -0.832) 2.474 3.706 ( 3.326 1.073 0.999) 3.635 3.752 ( -2.110 4.512 0.166) 4.984 3.919 ( -0.317 0.626 3.626) 3.693 3.992 ( -0.978 3.092 1.392) 3.529 4.285 ( -0.127 2.016 -0.610) 2.110 4.342 ( 1.301 -3.210 1.852) 3.928 4.413 ( -0.973 1.525 3.126) 3.612 4.644 ( 1.971 -0.527 -1.357) 2.450 4.795 ( -4.649 -1.362 2.164) 5.306 4.852 ( -4.777 3.082 -4.809) 7.446 5.110 ( -0.638 -2.360 3.622) 4.370 5.221 ( 0.446 0.201 -2.507) 2.555 5.317 ( 3.430 1.990 2.214) 4.542 5.521 ( 2.075 1.602 -1.018) 2.812 5.560 ( 13.470 -0.287 -4.407) 14.176 5.640 ( 9.438 -1.032 5.400) 10.923 6.093 ( 7.156 2.052 9.033) 11.705 6.238 ( 3.652 -2.015 -0.632) 4.218 6.335 ( -1.150 -0.191 -2.797) 3.030 6.437 ( 9.243 0.107 -7.247) 11.746 6.526 ( -3.528 1.488 -0.808) 3.913 6.756 ( 9.827 1.191 -4.218) 10.760 7.201 ( 11.699 -3.355 0.299) 12.174 7.457 ( 3.183 0.253 -3.784) 4.952 7.637 ( 0.854 1.730 6.155) 6.451 7.792 ( 3.146 3.276 -3.588) 5.789 8.000 ( 5.318 -5.603 -4.145) 8.767 8.149 ( 7.047 -1.896 5.340) 9.042 8.289 ( 6.079 3.970 -1.731) 7.464 8.464 ( 8.346 5.528 -0.313) 10.016 8.903 ( -2.858 5.527 6.790) 9.210 9.178 ( -0.057 2.053 -6.554) 6.868 9.726 ( 5.311 15.077 -2.292) 16.149 9.918 ( 3.749 3.096 0.249) 4.868 10.274 ( 3.797 7.022 -0.395) 7.993 10.401 ( 6.683 -1.946 15.057) 16.588 10.906 ( -0.994 -6.692 -7.856) 10.368 11.319 ( 0.911 -7.510 7.915) 10.949 12.064 ( -2.504 3.396 -12.300) 13.003 12.493 ( 4.947 0.370 1.537) 5.193 12.812 ( -1.194 -5.062 -7.871) 9.434 12.996 ( 1.846 0.077 -0.231) 1.862 13.312 ( -3.436 2.213 -0.073) 4.087 13.517 ( -6.430 3.019 -1.534) 7.267 13.706 ( -12.607 -1.120 5.079) 13.638 13.855 ( -4.292 -4.422 3.548) 7.111 15.170 ( 6.985 -0.065 3.476) 7.802 15.431 ( 5.949 1.894 -2.140) 6.599 17.721 ( 0.838 0.056 -0.546) 1.002 17.833 ( -3.192 0.364 1.258) 3.451 ======================= Grid point 213 (91/117) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.472 ( 9.736 -3.024 1.250) 10.271 1.498 ( 5.847 -2.129 1.717) 6.455 1.724 ( -1.994 -4.859 -0.732) 5.303 1.880 ( 3.687 -1.725 -5.604) 6.927 1.950 ( 0.340 -6.948 0.576) 6.981 2.105 ( 0.756 -3.598 1.703) 4.052 2.145 ( -0.928 1.289 1.623) 2.270 2.203 ( -2.471 -0.561 -1.988) 3.221 2.279 ( -3.133 1.053 -0.447) 3.335 2.382 ( -3.363 2.740 1.466) 4.580 2.504 ( -5.166 4.011 0.490) 6.559 2.590 ( -4.094 3.278 -2.381) 5.760 2.782 ( -1.789 0.894 0.903) 2.194 2.810 ( -1.412 1.764 2.719) 3.536 2.992 ( 0.769 0.511 -1.857) 2.074 3.057 ( -3.820 -1.409 -0.443) 4.095 3.093 ( -1.368 0.462 0.564) 1.550 3.247 ( 0.745 -1.236 -1.323) 1.958 3.310 ( 0.784 -1.731 -0.063) 1.901 3.400 ( 3.265 2.953 -3.238) 5.465 3.507 ( 5.639 -2.857 6.648) 9.174 3.606 ( -0.100 -1.481 0.124) 1.489 3.709 ( 2.716 5.223 -0.410) 5.902 3.789 ( 1.120 -0.429 -2.785) 3.032 3.910 ( 1.819 -0.560 2.516) 3.155 4.028 ( 6.018 -2.711 -1.888) 6.865 4.242 ( -1.692 3.466 -2.607) 4.656 4.386 ( -0.935 2.324 3.052) 3.948 4.411 ( 3.172 -2.747 4.360) 6.051 4.658 ( -0.938 0.685 -4.175) 4.333 4.732 ( -4.022 3.797 -2.900) 6.245 4.738 ( -4.041 -2.419 2.891) 5.526 5.122 ( -0.294 -0.952 4.051) 4.172 5.229 ( 0.997 -0.650 -4.633) 4.783 5.327 ( 0.516 2.563 2.098) 3.352 5.501 ( -1.515 0.201 1.044) 1.851 5.787 ( 11.268 -1.096 -5.871) 12.753 5.841 ( 10.016 -0.990 4.162) 10.892 6.162 ( 2.773 1.779 6.695) 7.461 6.293 ( 1.620 0.652 0.004) 1.746 6.310 ( -1.855 -1.162 0.863) 2.353 6.410 ( -7.537 1.350 -1.551) 7.812 6.578 ( 6.957 -0.449 -6.102) 9.265 6.856 ( 3.767 1.060 -1.912) 4.355 7.408 ( 7.382 -1.553 -3.623) 8.369 7.497 ( 2.397 -2.255 2.763) 4.297 7.647 ( 1.492 2.800 2.085) 3.797 7.788 ( -0.197 2.214 -0.186) 2.231 8.118 ( 2.754 -5.138 -2.417) 6.310 8.272 ( 4.498 -1.370 3.843) 6.073 8.364 ( 5.524 0.998 -6.377) 8.496 8.522 ( 3.683 5.910 4.431) 8.255 8.837 ( -1.438 1.947 3.393) 4.168 9.151 ( -0.296 1.795 -4.113) 4.497 9.704 ( 3.949 8.236 -0.842) 9.172 9.957 ( 2.738 1.244 0.028) 3.007 10.263 ( 1.634 5.372 -0.140) 5.616 10.567 ( 6.719 -4.319 12.226) 14.604 10.899 ( -2.079 -0.068 -8.962) 9.200 11.383 ( 0.032 -4.144 4.002) 5.761 11.999 ( -1.051 1.971 -7.052) 7.398 12.594 ( 5.523 -1.624 1.895) 6.061 12.806 ( -3.256 -2.438 -2.004) 4.534 13.041 ( 4.526 1.317 -4.040) 6.208 13.237 ( -3.635 1.787 0.870) 4.143 13.414 ( -2.975 1.428 -0.912) 3.423 13.533 ( -8.241 -0.655 3.776) 9.088 13.843 ( -1.545 -2.650 2.057) 3.693 15.265 ( 3.662 -0.015 1.768) 4.066 15.497 ( 3.412 1.176 -1.482) 3.901 17.734 ( 1.131 0.534 -0.959) 1.576 17.784 ( -2.610 -0.501 1.094) 2.874 ======================= Grid point 214 (92/117) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.529 ( -0.000 0.000 0.000) 0.000 1.681 ( 0.000 -0.000 0.000) 0.000 1.683 ( -0.000 0.000 -0.000) 0.000 1.800 ( -0.000 0.000 -0.000) 0.000 2.075 ( -0.000 0.000 0.000) 0.000 2.091 ( 0.000 0.000 0.000) 0.000 2.138 ( -0.000 -0.000 0.000) 0.000 2.212 ( -0.000 0.000 0.000) 0.000 2.321 ( -0.000 0.000 -0.000) 0.000 2.326 ( -0.000 -0.000 0.000) 0.000 2.388 ( -0.000 0.000 0.000) 0.000 2.533 ( -0.000 0.000 -0.000) 0.000 2.759 ( -0.000 -0.000 0.000) 0.000 2.790 ( -0.000 0.000 0.000) 0.000 2.992 ( 0.000 -0.000 -0.000) 0.000 3.021 ( -0.000 0.000 0.000) 0.000 3.074 ( -0.000 0.000 0.000) 0.000 3.282 ( -0.000 0.000 0.000) 0.000 3.316 ( -0.000 0.000 0.000) 0.000 3.370 ( -0.000 -0.000 -0.000) 0.000 3.580 ( -0.000 0.000 0.000) 0.000 3.631 ( -0.000 0.000 0.000) 0.000 3.733 ( -0.000 -0.000 0.000) 0.000 3.754 ( 0.000 0.000 0.000) 0.000 3.968 ( -0.000 0.000 0.000) 0.000 4.137 ( -0.000 0.000 -0.000) 0.000 4.183 ( -0.000 0.000 0.000) 0.000 4.355 ( -0.000 0.000 0.000) 0.000 4.504 ( -0.000 0.000 0.000) 0.000 4.572 ( -0.000 0.000 0.000) 0.000 4.701 ( -0.000 0.000 0.000) 0.000 4.709 ( -0.000 0.000 0.000) 0.000 5.125 ( -0.000 0.000 0.000) 0.000 5.245 ( -0.000 0.000 0.000) 0.000 5.314 ( -0.000 -0.000 -0.000) 0.000 5.487 ( -0.000 0.000 -0.000) 0.000 5.903 ( -0.000 0.000 -0.000) 0.000 5.944 ( -0.000 0.000 0.000) 0.000 6.213 ( 0.000 0.000 0.000) 0.000 6.259 ( -0.000 0.000 -0.000) 0.000 6.289 ( -0.000 0.000 0.000) 0.000 6.334 ( -0.000 -0.000 0.000) 0.000 6.642 ( -0.000 0.000 0.000) 0.000 6.879 ( -0.000 0.000 -0.000) 0.000 7.450 ( -0.000 0.000 0.000) 0.000 7.584 ( 0.000 -0.000 0.000) 0.000 7.626 ( -0.000 0.000 -0.000) 0.000 7.770 ( -0.000 0.000 0.000) 0.000 8.166 ( -0.000 0.000 0.000) 0.000 8.319 ( -0.000 -0.000 -0.000) 0.000 8.421 ( -0.000 0.000 0.000) 0.000 8.513 ( -0.000 0.000 0.000) 0.000 8.821 ( -0.000 0.000 0.000) 0.000 9.137 ( -0.000 0.000 0.000) 0.000 9.703 ( -0.000 0.000 0.000) 0.000 9.978 ( -0.000 -0.000 0.000) 0.000 10.250 ( -0.000 0.000 0.000) 0.000 10.675 ( 0.000 -0.000 0.000) 0.000 10.854 ( -0.000 0.000 -0.000) 0.000 11.403 ( -0.000 0.000 0.000) 0.000 11.978 ( -0.000 0.000 0.000) 0.000 12.677 ( 0.000 0.000 0.000) 0.000 12.761 ( -0.000 0.000 0.000) 0.000 13.093 ( -0.000 0.000 0.000) 0.000 13.179 ( -0.000 0.000 0.000) 0.000 13.384 ( -0.000 0.000 0.000) 0.000 13.463 ( -0.000 0.000 -0.000) 0.000 13.843 ( -0.000 0.000 0.000) 0.000 15.298 ( -0.000 0.000 0.000) 0.000 15.521 ( -0.000 0.000 0.000) 0.000 17.747 ( 0.000 0.000 -0.000) 0.000 17.759 ( -0.000 -0.000 0.000) 0.000 ======================= Grid point 221 (93/117) ======================= q-point: ( 0.10 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.045 ( 3.386 -0.000 -13.120) 13.550 1.104 ( 9.711 -0.000 13.524) 16.649 1.237 ( 11.566 -0.000 -18.123) 21.499 1.244 ( 10.675 -0.000 14.086) 17.674 2.076 ( -8.903 0.000 -4.666) 10.051 2.170 ( 2.105 -0.000 0.728) 2.227 2.386 ( -1.780 0.000 5.945) 6.206 2.444 ( 5.114 -0.000 -17.580) 18.308 2.476 ( 7.206 -0.000 23.820) 24.886 2.513 ( -6.974 0.000 -0.778) 7.017 2.585 ( -0.979 0.000 3.536) 3.669 2.638 ( 10.334 -0.000 -10.535) 14.758 2.753 ( -2.574 0.000 -2.426) 3.537 2.833 ( 0.926 -0.000 4.672) 4.763 2.905 ( -4.072 0.000 1.060) 4.208 2.942 ( -4.077 0.000 -6.365) 7.559 3.014 ( 1.079 -0.000 0.893) 1.400 3.188 ( -2.044 0.000 -0.576) 2.124 3.347 ( -3.691 0.000 5.191) 6.369 3.364 ( -1.400 0.000 -3.914) 4.157 3.516 ( -5.498 0.000 -4.879) 7.350 3.610 ( 4.389 -0.000 1.243) 4.561 3.764 ( -0.093 0.000 3.500) 3.501 3.868 ( -2.216 0.000 0.628) 2.304 3.980 ( -1.104 0.000 3.921) 4.073 4.071 ( -2.034 0.000 3.041) 3.659 4.261 ( 2.528 -0.000 -0.014) 2.528 4.268 ( 1.604 -0.000 -3.311) 3.679 4.480 ( -5.247 0.000 2.672) 5.888 4.599 ( 0.262 -0.000 1.791) 1.810 4.858 ( -4.208 0.000 0.367) 4.224 4.945 ( -0.420 0.000 -2.539) 2.573 5.102 ( -4.234 0.000 3.789) 5.682 5.193 ( 10.175 -0.000 -1.277) 10.255 5.197 ( 2.798 -0.000 1.641) 3.244 5.354 ( 12.145 -0.000 1.140) 12.198 5.429 ( 7.409 -0.000 -1.444) 7.549 5.601 ( 1.648 -0.000 1.723) 2.384 5.946 ( 8.431 -0.000 9.475) 12.683 6.111 ( 6.862 -0.000 -9.065) 11.369 6.316 ( 7.413 -0.000 0.099) 7.413 6.346 ( -0.336 0.000 -5.078) 5.089 6.527 ( 17.171 -0.000 -5.828) 18.133 6.566 ( 1.203 -0.000 0.039) 1.204 6.982 ( 6.680 -0.000 -1.215) 6.789 7.396 ( 7.904 -0.000 -5.952) 9.895 7.637 ( -0.205 0.000 3.337) 3.344 7.771 ( 6.232 -0.000 -7.392) 9.669 7.855 ( 2.987 -0.000 -5.616) 6.361 8.002 ( 5.151 -0.000 7.258) 8.900 8.257 ( 5.368 -0.000 5.327) 7.563 8.386 ( 9.904 -0.000 -4.667) 10.948 9.112 ( -4.352 0.000 8.006) 9.112 9.205 ( -0.366 0.000 -10.493) 10.499 9.952 ( -0.195 0.000 1.091) 1.108 9.956 ( 0.985 -0.000 0.883) 1.322 10.344 ( 8.714 -0.000 4.675) 9.889 10.518 ( -6.599 0.000 14.682) 16.097 10.520 ( 9.103 -0.000 -0.034) 9.103 11.035 ( 3.467 -0.000 1.367) 3.727 12.194 ( -2.837 0.000 -10.133) 10.523 12.458 ( 4.373 -0.000 -5.206) 6.799 12.792 ( -5.096 0.000 -15.022) 15.863 12.939 ( 1.632 -0.000 2.992) 3.408 13.438 ( -6.717 0.000 -4.188) 7.915 13.704 ( -7.887 0.000 -2.583) 8.299 13.825 ( -4.223 0.000 8.526) 9.515 13.955 ( -17.780 0.000 2.726) 17.988 15.015 ( 9.618 -0.000 5.928) 11.298 15.348 ( 7.485 -0.000 -0.432) 7.498 17.707 ( 0.144 -0.000 0.542) 0.561 17.905 ( -3.151 0.000 2.844) 4.244 ======================= Grid point 222 (94/117) ======================= q-point: ( 0.20 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.161 ( 9.143 -3.412 -4.662) 10.815 1.314 ( 11.567 -1.143 5.884) 13.028 1.454 ( 10.837 -6.695 -11.211) 16.969 1.480 ( 12.496 -4.078 9.005) 15.934 1.928 ( -6.900 -0.706 -4.731) 8.395 2.158 ( -3.283 0.175 1.541) 3.631 2.269 ( -5.749 1.483 -0.874) 6.001 2.322 ( -8.236 1.679 0.034) 8.406 2.427 ( -5.463 2.332 -3.739) 7.019 2.528 ( -4.036 2.704 2.827) 5.621 2.649 ( -0.398 0.128 10.905) 10.913 2.715 ( -0.425 -1.687 1.386) 2.225 2.818 ( -5.126 1.999 -0.257) 5.508 2.849 ( -1.877 -0.774 1.050) 2.285 2.904 ( 11.827 -2.947 -13.091) 17.887 2.917 ( 4.554 -3.001 3.434) 6.444 3.071 ( 4.479 0.740 4.040) 6.077 3.206 ( 4.359 -1.471 -7.444) 8.751 3.291 ( -1.494 2.316 0.704) 2.844 3.346 ( -1.356 -1.219 0.678) 1.945 3.424 ( -2.163 0.991 -3.986) 4.642 3.656 ( 3.235 0.464 -2.981) 4.423 3.762 ( 0.530 3.182 2.813) 4.280 3.809 ( -2.955 1.537 2.358) 4.081 3.935 ( -2.695 0.777 3.974) 4.864 4.040 ( -1.508 1.541 4.550) 5.035 4.289 ( -0.445 -1.458 1.812) 2.368 4.325 ( 4.852 1.395 -1.624) 5.304 4.443 ( 1.188 1.162 -0.534) 1.745 4.622 ( 0.959 -1.254 1.327) 2.062 4.770 ( -6.290 -1.046 1.176) 6.484 4.894 ( -4.070 1.423 -5.352) 6.872 5.074 ( -0.239 -1.279 4.922) 5.091 5.215 ( -0.317 -0.360 -0.288) 0.560 5.339 ( 5.332 0.469 0.200) 5.356 5.530 ( 1.460 -0.049 -1.124) 1.843 5.577 ( 11.707 1.269 -3.853) 12.389 5.622 ( 7.956 -0.829 6.552) 10.340 6.126 ( 9.037 1.375 10.522) 13.938 6.203 ( 3.569 -1.567 -2.373) 4.563 6.334 ( -0.864 0.017 -3.804) 3.901 6.443 ( 8.316 0.420 -4.552) 9.489 6.544 ( -3.629 0.531 -0.998) 3.801 6.764 ( 10.002 -0.020 -6.758) 12.071 7.155 ( 12.332 -1.530 0.331) 12.431 7.460 ( 0.996 0.083 -2.326) 2.531 7.655 ( 1.745 0.453 4.163) 4.537 7.825 ( 1.898 0.305 -5.846) 6.153 7.961 ( 7.717 0.752 -5.914) 9.752 8.088 ( 3.321 -3.349 4.325) 6.399 8.350 ( 5.469 1.938 4.169) 7.144 8.534 ( 8.412 2.063 -2.585) 9.039 9.012 ( -4.779 5.226 7.001) 9.958 9.189 ( -0.749 -0.639 -8.854) 8.908 9.949 ( 1.751 5.866 0.917) 6.190 9.963 ( 2.202 3.639 1.111) 4.396 10.388 ( -1.605 1.249 11.843) 12.016 10.471 ( 8.614 12.683 3.143) 15.650 10.725 ( 4.597 -10.793 -3.174) 12.153 11.111 ( -1.625 -12.384 3.508) 12.973 12.121 ( -2.844 2.284 -14.494) 14.946 12.515 ( 3.739 1.122 -0.994) 4.028 12.749 ( 0.322 -1.929 -7.246) 7.506 12.998 ( 4.805 0.156 -1.523) 5.043 13.360 ( -2.270 2.227 -0.381) 3.202 13.557 ( -7.969 1.111 1.995) 8.290 13.691 ( -12.815 -0.233 2.748) 13.109 13.788 ( -2.480 -2.606 4.849) 6.038 15.163 ( 6.489 -0.423 4.678) 8.011 15.454 ( 5.358 0.635 -2.354) 5.886 17.721 ( 1.177 -0.011 -0.859) 1.458 17.839 ( -4.120 0.221 1.814) 4.507 ======================= Grid point 223 (95/117) ======================= q-point: ( 0.30 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.382 ( 11.547 -4.914 2.274) 12.753 1.482 ( 4.449 -1.140 2.179) 5.083 1.637 ( 4.227 -5.464 -4.537) 8.265 1.741 ( 11.227 -7.208 0.816) 13.366 1.902 ( 2.071 -2.307 -4.427) 5.405 2.055 ( -6.834 -1.130 0.439) 6.941 2.188 ( -1.369 2.339 1.753) 3.228 2.198 ( -5.421 0.121 -1.114) 5.536 2.316 ( -3.039 2.373 0.831) 3.945 2.432 ( -4.627 2.469 2.193) 5.685 2.573 ( -3.931 3.983 1.543) 5.805 2.666 ( -3.483 5.180 -3.067) 6.955 2.755 ( -3.038 -3.739 1.428) 5.025 2.828 ( -1.973 0.573 2.241) 3.040 2.983 ( -0.427 -2.039 1.881) 2.807 2.996 ( -0.567 -3.026 -4.459) 5.419 3.117 ( -0.027 1.947 3.066) 3.632 3.244 ( -0.865 0.468 -6.472) 6.546 3.275 ( -1.030 -1.907 -2.028) 2.969 3.382 ( 3.646 -3.928 -1.211) 5.495 3.476 ( 6.171 -0.416 3.888) 7.306 3.682 ( 1.165 7.254 2.849) 7.880 3.774 ( 2.760 1.490 -2.818) 4.216 3.804 ( 5.844 1.468 -3.693) 7.067 3.907 ( 0.192 0.048 3.792) 3.797 4.008 ( 0.134 0.082 2.452) 2.457 4.301 ( 1.205 1.975 1.235) 2.623 4.379 ( 2.989 0.608 1.856) 3.571 4.450 ( 1.103 3.784 -0.372) 3.959 4.647 ( 0.171 -2.085 -2.258) 3.078 4.682 ( -6.096 -3.051 1.990) 7.102 4.794 ( -4.371 2.856 -3.652) 6.371 5.099 ( 0.727 -1.389 4.997) 5.237 5.206 ( -1.130 -1.240 -1.955) 2.576 5.373 ( 0.641 2.217 0.951) 2.496 5.483 ( -4.081 -1.951 1.147) 4.666 5.783 ( 11.972 0.477 -5.423) 13.152 5.828 ( 10.987 -0.629 4.431) 11.863 6.194 ( 1.097 1.775 4.473) 4.935 6.275 ( 0.932 -1.827 5.681) 6.040 6.313 ( 0.374 0.678 -2.570) 2.684 6.429 ( -8.506 0.749 -1.539) 8.676 6.575 ( 7.041 0.059 -5.443) 8.900 6.862 ( 2.642 -0.109 -2.943) 3.956 7.378 ( 10.009 -1.598 -2.705) 10.490 7.462 ( -0.025 -1.514 0.137) 1.521 7.686 ( 1.959 1.563 3.201) 4.065 7.815 ( -1.996 0.722 -3.493) 4.087 8.054 ( 4.048 -0.639 -1.417) 4.336 8.198 ( 3.960 -5.757 -0.518) 7.006 8.409 ( 2.936 2.176 2.386) 4.364 8.622 ( 4.907 4.376 0.150) 6.577 8.894 ( -4.083 4.623 5.636) 8.355 9.166 ( -1.731 -0.549 -6.868) 7.103 9.885 ( 0.047 12.083 1.655) 12.196 9.971 ( 0.384 0.498 2.730) 2.802 10.421 ( 0.305 -2.922 6.564) 7.192 10.473 ( 4.895 8.662 1.901) 10.129 10.844 ( 1.363 -5.078 -7.988) 9.563 11.197 ( -3.157 -15.574 3.846) 16.349 12.040 ( -2.366 2.440 -9.141) 9.753 12.582 ( 4.448 -0.493 1.469) 4.711 12.784 ( 2.332 0.079 -2.748) 3.605 13.084 ( 6.542 2.694 -4.017) 8.136 13.295 ( -2.400 4.051 1.319) 4.890 13.434 ( -5.442 0.522 5.626) 7.845 13.514 ( -8.317 -1.020 -1.641) 8.538 13.800 ( 0.769 -2.062 2.149) 3.076 15.252 ( 2.553 -1.131 3.604) 4.560 15.514 ( 2.550 0.668 -2.489) 3.625 17.741 ( 1.418 0.279 -1.225) 1.894 17.777 ( -3.152 -0.321 1.341) 3.440 ======================= Grid point 224 (96/117) ======================= q-point: ( 0.40 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( -3.011 -2.992 -1.312) 4.443 1.617 ( 9.730 -4.886 4.484) 11.776 1.730 ( 2.239 2.129 0.260) 3.100 1.798 ( -7.261 -0.096 -2.815) 7.788 1.983 ( 8.800 -6.532 -1.782) 11.103 2.075 ( -0.570 -2.476 -2.062) 3.272 2.181 ( 2.133 0.515 0.806) 2.338 2.198 ( 4.324 -1.032 5.024) 6.709 2.285 ( 1.166 1.150 -0.204) 1.650 2.343 ( -2.777 1.411 1.488) 3.452 2.463 ( -4.398 5.001 -0.572) 6.684 2.563 ( -2.742 3.814 -2.558) 5.348 2.740 ( -2.612 -4.253 0.064) 4.992 2.784 ( -1.763 1.314 1.806) 2.845 2.969 ( -2.482 -1.294 -3.707) 4.645 2.990 ( -1.593 -3.183 0.285) 3.571 3.084 ( -1.246 0.464 1.519) 2.018 3.239 ( -0.558 -1.484 -4.736) 4.994 3.282 ( 0.581 -3.665 0.585) 3.756 3.429 ( 0.021 1.157 -0.807) 1.411 3.551 ( 1.037 -1.028 1.643) 2.198 3.681 ( 4.652 6.149 3.419) 8.435 3.763 ( -2.852 2.740 -2.088) 4.472 3.814 ( 3.405 4.672 0.941) 5.857 3.967 ( 1.805 -0.163 4.626) 4.968 4.102 ( 6.592 -2.305 -6.079) 9.259 4.244 ( -3.004 5.410 1.948) 6.488 4.407 ( -0.737 5.133 -3.643) 6.337 4.475 ( 5.723 -2.322 3.484) 7.090 4.584 ( -5.785 0.161 -0.068) 5.788 4.658 ( -2.627 -2.813 2.118) 4.393 4.730 ( 0.537 0.773 -3.070) 3.211 5.122 ( 0.354 -0.363 2.815) 2.860 5.204 ( -1.131 -3.154 -2.546) 4.208 5.338 ( -2.341 1.335 3.541) 4.449 5.459 ( -1.283 -2.765 -0.677) 3.122 5.916 ( 3.097 1.420 -3.198) 4.673 5.952 ( 1.350 0.868 2.750) 3.184 6.209 ( 0.280 -0.409 0.770) 0.916 6.262 ( -4.737 0.289 -2.630) 5.426 6.273 ( -1.253 -1.490 2.073) 2.843 6.341 ( 1.134 0.541 0.511) 1.357 6.645 ( 0.930 0.335 0.089) 0.992 6.868 ( -1.950 -1.074 0.051) 2.227 7.446 ( 0.703 -0.335 -1.366) 1.572 7.543 ( 3.253 -2.955 0.478) 4.421 7.665 ( -3.213 2.791 -3.658) 5.612 7.763 ( -2.598 -0.837 0.375) 2.755 8.117 ( 1.318 -2.902 -0.502) 3.227 8.294 ( 1.342 -4.208 0.901) 4.508 8.418 ( -0.231 0.803 -1.165) 1.434 8.603 ( -1.505 7.696 3.097) 8.432 8.823 ( -1.835 0.610 2.523) 3.179 9.130 ( -2.532 -1.517 -4.003) 4.974 9.758 ( -5.183 6.539 3.366) 8.998 9.968 ( -1.290 -0.370 2.983) 3.271 10.356 ( -0.679 10.430 -1.554) 10.567 10.567 ( 0.072 -10.558 3.098) 11.003 10.848 ( -1.915 -1.124 -8.637) 8.917 11.278 ( -2.750 -13.206 1.757) 13.604 11.986 ( -1.423 0.999 -0.943) 1.978 12.667 ( 3.385 -1.194 1.613) 3.935 12.803 ( 2.698 4.317 -1.443) 5.291 13.135 ( 1.376 4.189 -1.145) 4.555 13.226 ( 0.136 4.501 1.181) 4.655 13.377 ( -2.485 -1.630 6.910) 7.522 13.445 ( 0.524 -1.021 -6.520) 6.620 13.844 ( 2.802 -0.014 -0.081) 2.803 15.278 ( -1.389 -1.952 2.381) 3.377 15.522 ( -1.016 0.071 -1.568) 1.870 17.738 ( -1.757 -0.623 0.950) 2.092 17.765 ( 1.696 0.462 -1.034) 2.039 ======================= Grid point 225 (97/117) ======================= q-point: (-0.50 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.460 ( -3.693 -1.848 -2.210) 4.684 1.574 ( -8.729 3.756 -0.332) 9.509 1.781 ( 4.717 -0.739 3.480) 5.909 1.849 ( 5.084 -0.609 2.460) 5.681 2.071 ( 0.425 1.957 -2.220) 2.990 2.102 ( -1.892 0.453 -1.863) 2.694 2.199 ( 2.864 4.351 1.089) 5.322 2.212 ( 1.188 0.859 2.891) 3.242 2.302 ( -1.735 2.964 1.221) 3.645 2.339 ( 1.915 -2.411 -1.255) 3.325 2.441 ( 6.097 -2.289 -1.154) 6.614 2.544 ( 2.426 -1.755 0.493) 3.034 2.749 ( -0.925 -4.434 -0.743) 4.590 2.773 ( 1.677 -0.184 -0.098) 1.690 2.955 ( -2.124 -3.588 -0.321) 4.182 3.004 ( 0.408 -5.070 -1.695) 5.362 3.087 ( 1.158 -0.918 0.911) 1.736 3.239 ( -1.369 -3.484 -2.052) 4.269 3.338 ( 1.147 -1.185 2.057) 2.637 3.391 ( -0.214 5.017 1.385) 5.209 3.556 ( -1.655 0.282 -4.558) 4.857 3.657 ( -3.302 2.966 -4.982) 6.672 3.696 ( 0.252 6.698 5.024) 8.376 3.828 ( 0.893 3.683 1.036) 3.929 3.934 ( -1.868 2.312 -1.821) 3.486 4.104 ( -8.788 5.838 6.318) 12.297 4.195 ( 2.684 -1.912 2.059) 3.886 4.377 ( 1.938 1.373 -6.901) 7.298 4.456 ( -3.195 1.990 -3.339) 5.032 4.628 ( -0.325 -2.585 5.219) 5.833 4.662 ( 4.757 -3.848 2.663) 6.673 4.762 ( 3.060 0.272 -3.123) 4.381 5.129 ( 0.626 -0.016 -1.715) 1.826 5.199 ( -3.057 -3.630 1.089) 4.869 5.305 ( -1.278 -0.472 2.188) 2.578 5.472 ( -0.308 -2.902 -1.107) 3.121 5.819 ( -10.553 2.393 5.280) 12.040 5.864 ( -9.611 1.554 -3.153) 10.233 6.133 ( -4.092 -1.543 -7.349) 8.552 6.279 ( 0.336 -0.623 -0.098) 0.715 6.326 ( 2.588 0.274 0.101) 2.604 6.385 ( 5.341 -1.414 1.631) 5.761 6.592 ( -6.377 1.111 6.084) 8.884 6.823 ( -5.424 -2.583 1.345) 6.156 7.431 ( -4.678 1.181 3.293) 5.842 7.532 ( -4.080 1.410 -4.524) 6.253 7.595 ( -2.232 -2.806 -3.618) 5.093 7.743 ( -2.124 -2.824 -0.367) 3.552 8.136 ( -2.294 -2.998 -0.294) 3.786 8.293 ( -3.495 1.416 3.753) 5.320 8.386 ( -3.851 0.200 0.564) 3.897 8.470 ( -6.689 3.276 -2.003) 7.713 8.810 ( -0.453 -1.326 0.131) 1.408 9.110 ( -1.979 -3.501 -0.317) 4.034 9.616 ( -8.478 -0.948 4.006) 9.425 9.932 ( -4.003 -1.077 2.700) 4.947 10.260 ( -2.281 4.052 -1.253) 4.815 10.571 ( -7.721 -4.652 -10.910) 14.153 10.853 ( 1.301 -3.962 2.972) 5.121 11.329 ( -3.201 -9.526 -2.019) 10.250 11.975 ( 0.192 -0.565 6.120) 6.149 12.654 ( -2.996 4.847 -1.850) 5.991 12.852 ( 6.398 2.239 0.331) 6.786 13.067 ( -3.021 4.743 5.177) 7.643 13.232 ( 2.339 0.352 -2.019) 3.110 13.390 ( 1.468 -1.457 5.090) 5.494 13.534 ( 9.251 -0.064 -6.537) 11.328 13.890 ( 3.927 2.553 -2.092) 5.131 15.244 ( -4.884 -2.342 0.803) 5.475 15.477 ( -4.590 -1.090 -0.102) 4.719 17.723 ( -0.849 -0.660 0.701) 1.283 17.793 ( 2.141 0.480 -0.893) 2.369 ======================= Grid point 226 (98/117) ======================= q-point: (-0.40 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.349 ( -7.396 4.250 0.463) 8.543 1.430 ( -4.282 4.899 -0.410) 6.520 1.757 ( -5.311 8.188 -3.512) 10.372 1.854 ( -5.140 7.552 6.284) 11.087 2.000 ( 2.639 3.636 0.484) 4.519 2.152 ( 4.346 -0.512 -3.766) 5.774 2.162 ( 2.085 -1.717 0.895) 2.846 2.240 ( 2.415 -0.421 1.510) 2.880 2.371 ( 5.609 -0.638 1.534) 5.849 2.398 ( 1.640 -3.149 -0.657) 3.611 2.577 ( 7.157 -2.634 -1.372) 7.749 2.652 ( 5.718 -3.610 3.663) 7.690 2.786 ( 2.044 -2.630 -0.994) 3.476 2.840 ( 4.802 -1.240 -2.701) 5.647 2.946 ( -2.275 -3.602 -0.457) 4.285 3.090 ( 0.890 -8.172 -0.479) 8.234 3.136 ( 3.123 -1.213 1.205) 3.560 3.218 ( -3.329 6.179 -6.047) 9.264 3.279 ( -9.139 6.188 7.410) 13.293 3.325 ( -1.184 2.969 1.984) 3.762 3.418 ( -6.290 1.609 -8.937) 11.046 3.615 ( -2.545 -0.525 1.698) 3.105 3.681 ( 3.158 -0.455 2.482) 4.042 3.739 ( -6.083 3.922 3.179) 7.905 3.924 ( -0.597 1.340 -2.643) 3.023 3.964 ( -0.225 0.413 0.793) 0.922 4.250 ( 1.410 -1.986 0.804) 2.565 4.383 ( -0.785 1.214 -3.945) 4.202 4.413 ( 1.848 1.539 -3.459) 4.213 4.629 ( -1.926 -2.279 2.916) 4.172 4.795 ( 5.466 -3.041 4.751) 7.855 4.809 ( 2.705 -0.002 -3.080) 4.099 5.138 ( 0.538 0.512 -2.727) 2.826 5.186 ( -1.800 -3.859 2.134) 4.763 5.287 ( -2.380 -1.102 -0.791) 2.740 5.478 ( -3.321 -3.076 0.637) 4.572 5.582 ( -14.121 1.781 5.094) 15.117 5.655 ( -11.330 0.683 -4.068) 12.058 6.061 ( -5.538 -1.499 -8.724) 10.442 6.264 ( -2.380 0.782 0.304) 2.524 6.344 ( 0.479 0.832 2.068) 2.280 6.440 ( -8.744 0.193 9.648) 13.022 6.497 ( 2.742 -1.431 -0.220) 3.101 6.719 ( -9.971 -2.980 1.696) 10.544 7.259 ( -10.579 3.006 -0.703) 11.020 7.453 ( -6.206 -0.142 4.777) 7.833 7.588 ( -0.935 -3.705 -8.581) 9.393 7.728 ( -3.229 -3.774 0.663) 5.011 8.086 ( -7.049 -3.558 -1.935) 8.130 8.152 ( -8.262 7.362 3.682) 11.663 8.277 ( -5.254 1.862 4.913) 7.431 8.359 ( -8.564 -5.888 -4.816) 11.455 8.831 ( 0.886 -2.964 -3.582) 4.734 9.118 ( -1.880 -5.118 2.912) 6.181 9.510 ( -8.110 -7.527 5.236) 12.241 9.864 ( -5.674 -2.618 1.386) 6.401 10.211 ( -2.177 -1.319 -0.209) 2.554 10.420 ( -9.274 -0.767 -15.555) 18.126 10.928 ( 1.998 -3.334 7.876) 8.783 11.329 ( -4.056 -5.865 -6.479) 9.635 12.017 ( 2.382 -1.815 10.653) 11.066 12.532 ( -4.747 5.011 -3.807) 7.883 12.927 ( 4.638 7.103 4.410) 9.561 12.997 ( -1.160 0.892 2.652) 3.029 13.290 ( 4.456 -0.838 -1.211) 4.693 13.465 ( 4.899 -2.571 3.439) 6.515 13.721 ( 12.724 0.634 -4.961) 13.671 13.934 ( 5.576 4.446 -3.454) 7.924 15.155 ( -7.675 -1.980 -1.327) 8.036 15.391 ( -7.158 -2.581 1.425) 7.741 17.718 ( -0.331 -0.235 0.135) 0.428 17.828 ( 2.122 -0.173 -0.645) 2.225 ======================= Grid point 227 (99/117) ======================= q-point: (-0.30 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.191 ( -4.984 6.463 2.974) 8.686 1.293 ( -4.419 8.808 -0.289) 9.858 1.524 ( -7.413 13.101 -11.820) 19.139 1.616 ( -10.212 13.792 11.299) 20.547 2.081 ( 6.694 0.952 3.215) 7.487 2.204 ( 3.239 0.171 -4.676) 5.691 2.294 ( 5.055 -3.516 3.420) 7.043 2.325 ( 5.397 -4.260 -1.963) 7.151 2.441 ( 1.607 -0.645 -0.555) 1.819 2.471 ( 4.640 -4.028 -0.239) 6.149 2.669 ( -2.455 2.114 6.653) 7.400 2.763 ( 4.981 -1.676 1.571) 5.485 2.802 ( -7.186 3.817 1.833) 8.341 2.885 ( -2.618 6.838 -14.653) 16.380 2.923 ( -2.927 2.729 -4.404) 5.951 3.018 ( 2.784 -3.117 -2.967) 5.126 3.060 ( -0.259 7.893 10.289) 12.970 3.150 ( -0.491 -1.124 4.757) 4.912 3.237 ( 3.254 -4.256 -2.864) 6.075 3.335 ( 1.227 -1.804 1.230) 2.504 3.396 ( 0.903 -5.611 0.263) 5.689 3.587 ( -2.551 -3.505 -0.687) 4.389 3.619 ( -6.050 -0.332 -1.285) 6.194 3.775 ( 3.027 -3.848 2.066) 5.314 3.901 ( -0.351 0.182 -1.448) 1.501 3.996 ( 1.316 -1.587 -0.401) 2.101 4.282 ( 1.437 -0.852 -1.665) 2.358 4.346 ( -0.983 1.758 -0.931) 2.219 4.475 ( 5.571 0.325 -1.186) 5.705 4.613 ( -0.427 -0.191 -0.766) 0.897 4.845 ( 1.339 -1.013 -2.515) 3.024 4.899 ( 2.306 -3.081 4.453) 5.885 5.142 ( 0.908 0.503 1.745) 2.031 5.191 ( -1.571 -1.468 -3.289) 3.929 5.208 ( -8.611 -0.227 -1.517) 8.746 5.343 ( -9.317 -1.829 2.700) 9.871 5.388 ( -10.317 0.046 1.907) 10.491 5.521 ( -6.014 -3.093 -2.531) 7.221 5.957 ( -5.098 0.496 -9.433) 10.734 6.176 ( -6.225 2.142 6.500) 9.252 6.281 ( -8.902 -0.682 6.197) 10.868 6.352 ( -0.536 0.310 4.259) 4.303 6.488 ( -9.726 -1.822 0.263) 9.899 6.574 ( -4.805 -0.942 -0.542) 4.926 7.067 ( -7.461 3.812 -0.797) 8.416 7.333 ( -9.837 -2.835 5.919) 11.826 7.596 ( -2.122 -4.904 -3.497) 6.386 7.697 ( -2.614 -1.043 -0.771) 2.917 7.929 ( -12.689 -4.977 -5.569) 14.724 7.988 ( -4.518 5.652 4.637) 8.595 8.203 ( -3.104 0.405 0.519) 3.173 8.252 ( -9.516 -6.382 0.726) 11.481 8.885 ( 1.762 -5.607 -7.148) 9.254 9.130 ( -3.359 -6.469 4.959) 8.816 9.496 ( -4.345 -12.212 8.177) 15.326 9.796 ( -6.067 -5.033 -1.973) 8.126 10.197 ( -1.837 -2.672 1.055) 3.410 10.272 ( -6.078 -0.419 -14.622) 15.841 10.982 ( 2.249 1.507 9.156) 9.548 11.281 ( -4.471 -1.646 -10.419) 11.456 12.106 ( 4.117 -2.618 10.863) 11.908 12.418 ( -4.251 1.767 -3.335) 5.685 12.895 ( 0.687 7.246 10.762) 12.992 13.005 ( 0.991 1.673 -4.067) 4.508 13.411 ( 9.723 -0.003 2.008) 9.929 13.606 ( 7.328 -4.031 1.423) 8.484 13.892 ( 7.139 2.115 -5.964) 9.540 14.042 ( 12.828 3.264 -0.418) 13.243 15.019 ( -8.999 -1.030 -3.668) 9.773 15.285 ( -8.375 -3.561 1.723) 9.263 17.717 ( 0.396 0.343 -0.930) 1.068 17.864 ( 1.021 -1.397 -0.530) 1.810 ======================= Grid point 228 (100/117) ======================= q-point: (-0.20 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.084 ( 0.096 6.953 -9.124) 11.471 1.154 ( -3.011 8.077 10.892) 13.890 1.289 ( -3.893 13.840 -16.386) 21.799 1.335 ( -8.591 14.364 16.097) 23.221 2.180 ( 2.640 4.718 5.705) 7.860 2.219 ( 1.740 2.017 3.875) 4.702 2.295 ( -3.753 6.180 -16.216) 17.755 2.391 ( -7.084 5.989 6.964) 11.599 2.481 ( -0.734 -1.718 3.739) 4.180 2.531 ( 7.665 -3.404 7.308) 11.124 2.558 ( -4.972 2.302 -9.053) 10.582 2.645 ( 4.186 -2.477 -4.322) 6.507 2.792 ( 1.219 0.669 0.873) 1.642 2.829 ( -1.753 0.439 0.295) 1.831 2.962 ( 3.579 -0.841 -0.452) 3.704 3.007 ( -0.456 1.035 -1.086) 1.568 3.143 ( 3.899 3.593 -0.412) 5.318 3.203 ( 5.077 -1.957 2.323) 5.916 3.352 ( -0.535 -0.226 0.716) 0.922 3.373 ( 7.456 -6.480 -1.209) 9.952 3.474 ( -3.377 -2.508 0.663) 4.258 3.528 ( -1.475 -4.149 1.355) 4.607 3.599 ( -0.949 -7.399 -2.531) 7.878 3.788 ( -5.376 -2.462 1.021) 6.000 3.939 ( 3.363 -2.985 -0.339) 4.509 4.023 ( -0.773 -3.386 -0.215) 3.480 4.315 ( 1.840 1.659 -0.786) 2.599 4.323 ( 0.505 2.526 -0.070) 2.577 4.567 ( 5.911 -1.596 0.859) 6.183 4.671 ( 8.250 1.374 -3.363) 9.014 4.871 ( 0.194 -2.046 -0.292) 2.076 4.912 ( -4.290 -3.120 0.389) 5.319 5.038 ( -8.340 -0.416 1.631) 8.508 5.093 ( -9.208 0.282 -0.566) 9.229 5.177 ( 0.266 1.559 -4.317) 4.598 5.232 ( -6.295 2.380 1.837) 6.977 5.281 ( -0.165 -3.123 -0.762) 3.219 5.440 ( -6.683 -3.758 1.450) 7.803 5.900 ( 1.126 0.983 -6.572) 6.740 6.061 ( -5.328 1.744 8.072) 9.827 6.143 ( -7.623 -0.369 2.643) 8.076 6.254 ( -12.499 -0.950 1.452) 12.619 6.383 ( 1.623 0.961 2.060) 2.793 6.519 ( -4.064 -0.205 0.384) 4.088 6.957 ( -1.466 2.536 1.688) 3.381 7.170 ( -12.226 -2.413 3.254) 12.879 7.600 ( -1.929 -5.162 3.960) 6.786 7.671 ( -0.563 0.871 -4.167) 4.294 7.808 ( -5.793 -6.825 -7.051) 11.395 7.889 ( -3.596 2.356 4.489) 6.216 8.150 ( -3.108 -1.467 -6.743) 7.568 8.167 ( -5.574 -3.412 7.523) 9.965 8.986 ( 3.573 -9.130 -8.615) 13.051 9.129 ( -4.464 -7.702 6.559) 11.058 9.588 ( -0.226 -14.906 10.444) 18.201 9.743 ( -5.994 -8.403 -7.090) 12.522 10.188 ( -1.414 -0.485 5.824) 6.013 10.203 ( -1.708 -2.556 -13.824) 14.162 11.000 ( 3.663 7.829 9.000) 12.478 11.178 ( -4.945 4.599 -11.598) 13.420 12.210 ( 4.207 -2.189 5.100) 6.964 12.348 ( -3.725 -1.145 -0.239) 3.904 12.880 ( 2.106 3.339 11.245) 11.918 12.977 ( -1.455 1.964 -6.049) 6.524 13.635 ( 14.382 -1.350 6.612) 15.887 13.764 ( 6.171 -3.745 -2.618) 7.679 13.957 ( 6.213 3.504 -5.451) 8.977 14.231 ( 5.755 -0.121 5.201) 7.758 14.896 ( -2.349 0.733 -5.192) 5.746 15.164 ( -9.652 -2.911 -0.279) 10.085 17.736 ( 2.866 0.338 -2.332) 3.710 17.873 ( -2.218 -2.321 -0.460) 3.243 ======================= Grid point 229 (101/117) ======================= q-point: (-0.10 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.058 ( 3.919 5.312 -20.418) 21.458 1.058 ( -3.919 5.312 20.418) 21.458 1.137 ( 2.207 11.573 -21.948) 24.910 1.137 ( -2.207 11.573 21.948) 24.910 2.083 ( -1.228 11.917 -35.233) 37.214 2.083 ( 1.228 11.917 35.233) 37.214 2.304 ( -3.009 -0.071 -3.084) 4.309 2.304 ( 3.009 -0.071 3.084) 4.309 2.507 ( -0.546 -3.506 -1.925) 4.037 2.507 ( 0.546 -3.506 1.925) 4.037 2.696 ( -2.692 -1.937 -5.747) 6.635 2.696 ( 2.692 -1.937 5.747) 6.635 2.802 ( 0.611 -0.289 -3.315) 3.383 2.802 ( -0.611 -0.289 3.315) 3.383 2.989 ( 0.995 1.348 -2.955) 3.397 2.989 ( -0.995 1.348 2.955) 3.397 3.229 ( -2.587 -0.519 -2.012) 3.318 3.229 ( 2.587 -0.519 2.012) 3.318 3.348 ( -3.447 1.754 -0.898) 3.971 3.348 ( 3.447 1.754 0.898) 3.971 3.564 ( -3.979 -5.748 -2.065) 7.289 3.564 ( 3.979 -5.748 2.065) 7.289 3.697 ( -0.089 -4.710 -2.924) 5.545 3.697 ( 0.089 -4.710 2.924) 5.545 4.026 ( -2.183 -3.843 -0.325) 4.432 4.026 ( 2.183 -3.843 0.325) 4.432 4.300 ( -0.508 4.111 -1.314) 4.345 4.300 ( 0.508 4.111 1.314) 4.345 4.742 ( -7.659 -1.796 -0.883) 7.917 4.742 ( 7.659 -1.796 0.883) 7.917 4.867 ( -2.399 -1.147 -4.347) 5.096 4.867 ( 2.399 -1.147 4.347) 5.096 4.964 ( 2.508 -1.021 -2.767) 3.872 4.964 ( -2.508 -1.021 2.767) 3.872 5.137 ( 1.041 3.946 -4.530) 6.097 5.137 ( -1.041 3.946 4.530) 6.097 5.366 ( 3.165 -2.310 -3.196) 5.056 5.366 ( -3.165 -2.310 3.196) 5.056 5.966 ( 5.515 -0.665 -3.117) 6.369 5.966 ( -5.515 -0.665 3.117) 6.369 6.096 ( -3.408 1.362 -3.391) 4.997 6.096 ( 3.408 1.362 3.391) 4.997 6.440 ( -4.655 0.113 -0.858) 4.735 6.440 ( 4.655 0.113 0.858) 4.735 6.998 ( -5.451 0.119 -5.101) 7.466 6.998 ( 5.451 0.119 5.101) 7.466 7.643 ( -1.728 -2.218 -5.617) 6.281 7.643 ( 1.728 -2.218 5.617) 6.281 7.831 ( 2.529 -1.994 -4.711) 5.706 7.831 ( -2.529 -1.994 4.711) 5.706 8.135 ( 1.146 -1.702 -7.767) 8.033 8.135 ( -1.146 -1.702 7.767) 8.033 9.131 ( 3.215 -8.061 -9.444) 12.826 9.131 ( -3.215 -8.061 9.444) 12.826 9.758 ( -2.533 -15.805 -7.890) 17.846 9.758 ( 2.533 -15.805 7.890) 17.846 10.194 ( -0.774 -1.744 -7.998) 8.222 10.194 ( 0.774 -1.744 7.998) 8.222 10.996 ( -5.031 13.438 -8.207) 16.530 10.996 ( 5.031 13.438 8.207) 16.530 12.296 ( 1.020 -1.515 -5.724) 6.008 12.296 ( -1.020 -1.515 5.724) 6.008 12.924 ( -1.746 -0.163 -9.980) 10.133 12.924 ( 1.746 -0.163 9.980) 10.133 13.833 ( -1.975 -3.488 -9.248) 10.079 13.833 ( 1.975 -3.488 9.248) 10.079 14.126 ( -15.596 1.566 3.012) 15.961 14.126 ( 15.596 1.566 -3.012) 15.961 14.988 ( -7.305 0.204 -4.660) 8.667 14.988 ( 7.305 0.204 4.660) 8.667 17.816 ( -5.015 -1.225 0.577) 5.195 17.816 ( 5.015 -1.225 -0.577) 5.195 ======================= Grid point 233 (102/117) ======================= q-point: ( 0.20 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.333 ( 11.857 -0.000 3.490) 12.360 1.469 ( 3.427 -0.000 2.765) 4.403 1.568 ( 8.324 -0.000 -11.097) 13.872 1.688 ( 11.976 -0.000 5.420) 13.146 1.876 ( 3.465 -0.000 -3.851) 5.181 2.048 ( -9.632 0.000 -1.086) 9.693 2.198 ( -6.470 0.000 -2.510) 6.940 2.213 ( -1.553 0.000 2.606) 3.033 2.340 ( -3.050 0.000 1.947) 3.619 2.455 ( -5.429 0.000 2.600) 6.020 2.650 ( -2.747 0.000 3.592) 4.522 2.652 ( -3.772 0.000 1.096) 3.928 2.781 ( -2.266 0.000 -3.246) 3.958 2.804 ( -2.167 0.000 2.154) 3.055 2.940 ( 0.446 -0.000 -1.392) 1.462 2.980 ( -0.059 0.000 -2.151) 2.152 3.137 ( -1.245 0.000 1.316) 1.812 3.248 ( -0.490 0.000 -11.255) 11.266 3.269 ( -0.400 0.000 -0.335) 0.522 3.328 ( 1.687 -0.000 2.789) 3.259 3.477 ( 6.321 -0.000 4.321) 7.657 3.772 ( -1.014 0.000 4.556) 4.668 3.780 ( 7.717 -0.000 -7.411) 10.699 3.807 ( 5.707 -0.000 -2.850) 6.379 3.907 ( -0.273 0.000 4.454) 4.462 4.013 ( -2.820 0.000 3.795) 4.728 4.305 ( 3.526 -0.000 4.014) 5.342 4.417 ( 3.540 -0.000 1.681) 3.919 4.479 ( 0.885 -0.000 -4.274) 4.365 4.621 ( 0.237 -0.000 -0.022) 0.238 4.648 ( -6.417 0.000 0.579) 6.443 4.821 ( -4.667 0.000 -4.074) 6.195 5.085 ( 1.182 -0.000 5.576) 5.700 5.194 ( -1.697 0.000 -0.496) 1.768 5.396 ( 1.652 -0.000 -0.603) 1.759 5.457 ( -6.375 0.000 1.831) 6.632 5.791 ( 12.024 -0.000 -5.408) 13.185 5.820 ( 11.573 -0.000 4.860) 12.552 6.216 ( -0.078 0.000 -0.537) 0.542 6.252 ( 1.340 -0.000 11.074) 11.155 6.319 ( 0.941 -0.000 -2.840) 2.992 6.436 ( -8.801 0.000 -1.712) 8.966 6.576 ( 6.920 -0.000 -4.989) 8.531 6.860 ( 2.301 -0.000 -3.500) 4.188 7.362 ( 11.065 -0.000 -2.147) 11.271 7.448 ( -1.004 0.000 -0.912) 1.357 7.700 ( 2.295 -0.000 4.197) 4.783 7.819 ( -2.417 0.000 -4.904) 5.468 8.096 ( 6.987 -0.000 -7.193) 10.028 8.100 ( 0.885 -0.000 4.213) 4.305 8.427 ( 1.825 -0.000 4.621) 4.968 8.660 ( 5.357 -0.000 -0.880) 5.429 8.954 ( -5.124 0.000 5.686) 7.654 9.149 ( -2.829 0.000 -7.028) 7.576 9.975 ( -0.888 0.000 4.148) 4.242 10.058 ( 4.006 -0.000 0.668) 4.061 10.280 ( -7.685 0.000 6.748) 10.227 10.719 ( 9.371 -0.000 2.836) 9.791 10.764 ( 3.608 -0.000 -4.583) 5.833 10.964 ( -7.129 0.000 -0.580) 7.153 12.066 ( -3.003 0.000 -10.527) 10.947 12.573 ( 3.111 -0.000 1.599) 3.498 12.792 ( 5.270 -0.000 -3.032) 6.080 13.111 ( 7.587 -0.000 -4.039) 8.596 13.339 ( -1.835 0.000 1.869) 2.619 13.435 ( -7.398 0.000 9.248) 11.843 13.507 ( -7.897 0.000 -4.820) 9.252 13.780 ( 1.889 -0.000 2.083) 2.812 15.239 ( 2.099 -0.000 4.102) 4.608 15.520 ( 2.239 -0.000 -2.663) 3.480 17.744 ( 1.571 -0.000 -1.341) 2.065 17.774 ( -3.434 0.000 1.459) 3.731 ======================= Grid point 234 (103/117) ======================= q-point: ( 0.30 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.453 ( -2.841 -1.235 -1.081) 3.281 1.538 ( 8.844 -3.015 5.923) 11.063 1.722 ( 7.853 -2.027 -4.103) 9.089 1.798 ( -6.803 -0.168 -3.203) 7.521 1.926 ( 5.997 0.570 0.212) 6.027 2.015 ( 6.201 -3.473 -2.143) 7.423 2.139 ( 0.743 -1.433 3.114) 3.507 2.223 ( 2.898 0.985 1.767) 3.534 2.329 ( 1.283 2.193 1.984) 3.223 2.362 ( -4.575 0.505 2.410) 5.196 2.545 ( -4.082 4.585 -0.096) 6.140 2.621 ( -4.625 -2.509 -0.536) 5.289 2.695 ( -2.842 4.439 -1.053) 5.375 2.789 ( -2.537 -2.611 0.225) 3.648 2.934 ( -1.729 -1.021 -0.354) 2.039 2.959 ( -1.732 -1.066 -1.986) 2.843 3.078 ( -3.587 -0.570 -0.501) 3.667 3.183 ( -4.973 -3.356 -4.100) 7.266 3.276 ( 1.863 1.648 -5.191) 5.756 3.400 ( 3.379 -2.182 1.822) 4.415 3.558 ( 1.864 0.693 5.276) 5.639 3.789 ( 4.128 4.036 3.414) 6.708 3.803 ( -0.856 1.350 -3.706) 4.036 3.883 ( 1.037 2.751 1.867) 3.482 3.957 ( 3.447 -1.000 5.974) 6.970 4.072 ( 9.224 -1.012 -8.412) 12.525 4.350 ( -1.417 5.636 2.588) 6.361 4.441 ( 4.295 -0.727 3.702) 5.716 4.475 ( -0.796 -0.537 -1.164) 1.509 4.568 ( -3.583 0.058 -2.438) 4.334 4.630 ( -1.627 -0.511 -0.477) 1.771 4.736 ( -2.803 0.007 -2.019) 3.454 5.116 ( 1.336 -0.190 4.479) 4.678 5.163 ( -2.321 -1.245 -1.162) 2.879 5.342 ( -6.342 -0.602 2.425) 6.816 5.416 ( -0.299 -1.378 -0.350) 1.453 5.941 ( 5.063 0.999 -5.784) 7.752 5.967 ( 2.745 0.601 5.062) 5.790 6.203 ( -2.053 -0.224 -0.596) 2.150 6.248 ( -0.073 -0.987 4.843) 4.943 6.267 ( -7.152 0.192 -3.526) 7.976 6.348 ( 1.050 0.183 0.763) 1.311 6.650 ( 1.527 0.167 -0.279) 1.562 6.850 ( -3.242 -0.680 0.331) 3.329 7.444 ( 1.129 0.182 -1.207) 1.663 7.499 ( 3.819 -1.719 -1.939) 4.615 7.709 ( -3.767 2.133 -2.584) 5.041 7.741 ( -3.871 -1.583 -0.816) 4.261 8.106 ( 1.091 1.365 1.930) 2.603 8.207 ( 2.866 -4.471 -4.186) 6.762 8.428 ( -1.706 0.247 3.545) 3.942 8.711 ( 1.654 3.159 0.912) 3.681 8.860 ( -4.296 3.237 3.630) 6.489 9.077 ( -6.410 -3.526 -3.351) 8.047 9.890 ( -9.004 4.227 9.950) 14.070 10.021 ( 0.509 9.850 -1.290) 9.947 10.287 ( -2.735 -15.764 -0.717) 16.015 10.638 ( -3.254 16.128 0.333) 16.457 10.825 ( -0.610 -0.737 -9.643) 9.690 10.989 ( -1.799 -18.092 1.664) 18.257 12.008 ( -2.151 1.019 -2.062) 3.149 12.642 ( 4.056 -1.134 3.089) 5.223 12.882 ( 6.335 3.403 -2.622) 7.654 13.205 ( 2.788 2.669 -2.896) 4.825 13.296 ( -3.255 2.430 3.307) 5.238 13.325 ( -4.308 -2.720 6.020) 7.886 13.447 ( 2.192 0.547 -5.016) 5.501 13.842 ( 4.729 -0.132 -0.505) 4.758 15.246 ( -2.286 -1.225 3.220) 4.134 15.523 ( -1.644 0.010 -1.921) 2.529 17.730 ( -1.942 -0.271 1.081) 2.239 17.771 ( 1.837 0.172 -1.217) 2.210 ======================= Grid point 235 (104/117) ======================= q-point: (-0.60 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.432 ( -0.632 -0.992 -2.048) 2.361 1.594 ( -7.750 -1.777 1.593) 8.109 1.738 ( 5.478 -1.112 1.580) 5.809 1.857 ( 6.109 -0.530 0.860) 6.191 2.032 ( 2.050 -3.838 -3.254) 5.433 2.117 ( 5.768 1.250 -0.129) 5.903 2.218 ( 0.484 0.268 3.929) 3.968 2.281 ( 0.727 -3.056 4.108) 5.171 2.295 ( 4.285 3.056 1.306) 5.422 2.357 ( 0.222 4.047 -2.650) 4.843 2.459 ( 1.407 3.294 -1.023) 3.725 2.537 ( -3.282 0.692 -0.302) 3.368 2.659 ( -0.816 -4.065 -0.077) 4.147 2.769 ( -1.206 -1.545 -0.439) 2.009 2.910 ( -2.005 -1.311 -0.133) 2.399 2.939 ( -1.071 -1.106 -2.600) 3.021 3.053 ( -1.071 -2.632 -0.383) 2.867 3.157 ( -2.436 -5.987 -0.819) 6.515 3.299 ( 1.222 -1.323 -4.540) 4.884 3.465 ( 3.406 1.624 -0.485) 3.805 3.554 ( -0.858 1.653 4.882) 5.225 3.730 ( -3.035 2.465 -3.329) 5.135 3.828 ( 3.345 6.632 2.679) 7.896 3.893 ( 1.665 3.069 0.109) 3.494 3.991 ( 0.216 3.863 0.218) 3.875 4.170 ( 1.973 -1.044 -1.202) 2.535 4.231 ( -6.239 8.334 6.349) 12.194 4.429 ( -1.154 4.065 -7.806) 8.877 4.472 ( -1.445 -0.630 -1.344) 2.072 4.567 ( -5.108 -3.957 3.510) 7.353 4.610 ( 7.137 -1.861 2.787) 7.884 4.754 ( 2.614 -0.850 -2.389) 3.641 5.125 ( -1.313 -1.158 0.151) 1.758 5.140 ( -1.928 -1.557 0.041) 2.478 5.274 ( -3.533 -3.294 2.662) 5.515 5.420 ( -1.053 -2.308 0.257) 2.549 5.864 ( -10.670 2.480 2.449) 11.225 5.890 ( -9.958 1.231 -0.342) 10.040 6.107 ( -4.569 -1.324 -6.961) 8.431 6.275 ( 2.444 0.183 -1.362) 2.804 6.319 ( 4.286 -0.739 1.890) 4.742 6.364 ( 2.027 -1.018 1.463) 2.699 6.613 ( -5.394 1.152 4.817) 7.323 6.774 ( -7.164 -2.606 1.954) 7.870 7.452 ( -2.296 1.216 2.143) 3.368 7.526 ( -2.366 -1.999 0.014) 3.098 7.569 ( -6.006 0.043 -11.647) 13.105 7.697 ( -4.479 -2.053 1.563) 5.169 8.101 ( -1.948 -0.236 0.842) 2.136 8.253 ( -1.921 -4.432 -1.790) 5.151 8.383 ( -3.499 0.044 0.462) 3.529 8.615 ( -6.684 10.190 2.687) 12.479 8.794 ( -1.736 -0.305 1.781) 2.506 9.008 ( -6.555 -7.877 0.041) 10.248 9.673 ( -10.247 5.894 7.098) 13.788 9.944 ( -3.258 3.492 1.058) 4.892 10.314 ( -7.614 -5.917 -7.204) 12.037 10.463 ( -6.099 0.835 0.665) 6.191 10.799 ( -0.952 -1.948 -6.613) 6.959 11.103 ( -2.061 -14.177 -1.237) 14.379 11.980 ( -0.121 0.886 5.853) 5.921 12.719 ( 3.051 1.344 1.784) 3.781 12.913 ( 2.759 6.063 -2.733) 7.200 13.180 ( 0.960 4.048 0.563) 4.198 13.212 ( -3.800 -0.797 0.484) 3.913 13.358 ( 1.864 -2.193 6.956) 7.528 13.548 ( 10.325 1.468 -6.334) 12.202 13.928 ( 5.862 1.619 -2.550) 6.595 15.195 ( -5.835 -2.749 2.025) 6.761 15.461 ( -5.597 -0.635 -0.580) 5.663 17.713 ( -0.644 -0.478 0.557) 0.977 17.800 ( 1.858 0.283 -0.819) 2.050 ======================= Grid point 236 (105/117) ======================= q-point: (-0.50 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( -1.894 3.143 -2.751) 4.586 1.494 ( -2.552 1.766 3.042) 4.346 1.829 ( 2.187 0.616 1.489) 2.716 1.948 ( 3.741 2.102 3.247) 5.381 2.053 ( -3.584 1.668 -2.452) 4.651 2.106 ( 2.095 0.872 -4.059) 4.651 2.234 ( 1.171 2.546 3.322) 4.347 2.253 ( -2.003 3.552 3.144) 5.149 2.325 ( 0.177 -4.059 -2.333) 4.685 2.377 ( 5.054 1.997 0.937) 5.515 2.529 ( 6.297 -3.613 -2.171) 7.578 2.589 ( 5.240 -3.519 3.738) 7.336 2.733 ( 4.407 -3.495 -0.680) 5.666 2.792 ( 1.173 -4.362 -2.110) 4.985 2.897 ( -0.216 -0.545 0.584) 0.828 2.951 ( -0.263 -5.169 -1.477) 5.383 3.078 ( 0.902 -3.700 -1.824) 4.222 3.191 ( 0.180 -5.022 1.814) 5.343 3.311 ( -2.335 -2.905 -2.245) 4.351 3.446 ( -0.636 7.858 0.541) 7.902 3.550 ( -0.465 3.767 0.497) 3.828 3.634 ( -3.526 7.480 -7.701) 11.300 3.726 ( -4.173 4.549 1.934) 6.469 3.868 ( -2.681 9.667 4.064) 10.824 3.963 ( -1.183 2.986 -0.142) 3.214 4.011 ( -4.178 5.373 4.655) 8.246 4.210 ( 0.773 -2.783 0.454) 2.924 4.411 ( 0.091 2.164 -5.886) 6.272 4.434 ( -0.288 0.497 -3.021) 3.075 4.566 ( -1.283 -4.804 3.599) 6.138 4.746 ( 5.612 -2.385 3.875) 7.226 4.801 ( 2.051 -0.695 -1.975) 2.931 5.098 ( -4.013 -4.626 0.609) 6.155 5.140 ( 0.978 -0.799 -2.859) 3.125 5.258 ( -2.913 -2.828 1.677) 4.393 5.416 ( -3.053 -3.602 1.498) 4.954 5.616 ( -14.988 2.054 3.694) 15.572 5.666 ( -13.511 0.597 -1.844) 13.649 6.040 ( -4.186 -1.010 -8.525) 9.551 6.274 ( -1.835 0.688 0.742) 2.096 6.354 ( -0.876 -0.089 2.099) 2.276 6.426 ( -1.831 -1.666 6.679) 7.122 6.496 ( -3.396 1.218 1.609) 3.950 6.658 ( -9.610 -3.648 0.903) 10.318 7.302 ( -10.101 1.819 -1.749) 10.411 7.443 ( -9.006 -1.452 1.925) 9.323 7.530 ( -1.629 -1.749 -5.752) 6.229 7.658 ( -2.635 -4.221 -1.461) 5.186 8.026 ( -7.943 -1.312 -0.979) 8.110 8.220 ( -6.030 -4.553 0.695) 7.588 8.310 ( -4.408 0.819 -2.863) 5.319 8.358 ( -11.594 9.754 5.223) 16.026 8.791 ( -0.119 -1.726 -0.176) 1.739 8.988 ( -5.191 -9.256 2.364) 10.872 9.484 ( -6.924 3.555 4.705) 9.095 9.843 ( -6.339 0.795 2.080) 6.718 10.190 ( -7.232 -2.423 -4.384) 8.797 10.359 ( -9.384 -5.509 -9.134) 14.207 10.843 ( 2.216 -4.847 2.818) 6.029 11.163 ( -3.406 -11.180 -5.044) 12.730 12.003 ( 2.310 0.214 10.892) 11.137 12.657 ( -3.912 8.528 -5.009) 10.636 12.949 ( 3.754 -1.683 0.085) 4.115 13.118 ( -0.137 8.958 6.242) 10.919 13.258 ( 5.134 -2.796 -3.204) 6.667 13.431 ( 4.147 -1.574 5.906) 7.386 13.734 ( 12.713 0.940 -4.858) 13.642 14.005 ( 6.377 3.527 -4.088) 8.356 15.103 ( -8.167 -3.593 0.275) 8.927 15.348 ( -8.657 -2.045 1.099) 8.963 17.713 ( 0.134 -0.322 -0.186) 0.395 17.827 ( 1.380 -0.014 -0.260) 1.405 ======================= Grid point 237 (106/117) ======================= q-point: (-0.40 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.317 ( -2.099 7.666 0.311) 7.954 1.439 ( -1.484 7.230 1.556) 7.543 1.750 ( -4.276 11.522 -3.171) 12.693 1.828 ( -6.817 10.444 3.723) 13.016 2.088 ( 4.641 -0.975 0.053) 4.743 2.189 ( 3.284 -1.961 2.832) 4.759 2.220 ( 5.745 -3.075 -4.390) 7.857 2.289 ( 2.408 -0.087 1.292) 2.734 2.388 ( 3.150 -5.421 -0.982) 6.346 2.427 ( 1.476 -1.036 0.802) 1.974 2.691 ( 4.526 -5.689 1.134) 7.358 2.708 ( 6.894 1.660 1.123) 7.180 2.830 ( 2.285 -1.442 3.494) 4.417 2.844 ( -1.784 -8.446 -3.658) 9.375 2.936 ( 4.825 0.606 -1.445) 5.073 2.982 ( -3.655 -5.103 -3.215) 7.052 3.145 ( 2.436 -2.605 0.640) 3.623 3.210 ( -3.681 3.245 7.998) 9.384 3.257 ( -0.744 2.911 -2.717) 4.051 3.320 ( -6.725 6.627 -9.622) 13.480 3.373 ( 1.353 8.449 -0.248) 8.560 3.585 ( -1.915 2.805 1.744) 3.818 3.643 ( -8.210 4.621 2.161) 9.666 3.718 ( 1.230 -2.300 2.329) 3.497 3.939 ( 0.697 3.366 1.170) 3.631 3.999 ( 1.191 1.650 -0.920) 2.234 4.247 ( 0.947 -3.077 -2.525) 4.091 4.361 ( -2.404 0.247 -1.236) 2.714 4.483 ( 4.527 0.326 -0.007) 4.539 4.589 ( 0.554 -2.770 -0.577) 2.883 4.821 ( 0.314 -1.568 0.435) 1.657 4.846 ( 1.463 -2.695 1.324) 3.340 5.097 ( -0.561 -4.633 1.580) 4.927 5.154 ( -3.228 -2.781 -1.893) 4.662 5.204 ( -4.620 -0.658 -3.163) 5.638 5.329 ( -10.941 -0.549 4.533) 11.855 5.377 ( -10.206 -0.817 3.916) 10.962 5.473 ( -8.292 -2.236 -2.888) 9.061 5.966 ( -3.210 0.408 -9.293) 9.841 6.204 ( -6.128 0.943 4.747) 7.809 6.261 ( -8.845 -1.501 10.114) 13.520 6.360 ( -5.316 -0.025 1.635) 5.562 6.460 ( -5.271 -0.769 -2.750) 5.995 6.552 ( -3.363 -1.319 -0.153) 3.616 7.126 ( -7.475 2.650 -1.955) 8.168 7.282 ( -11.312 -2.881 1.381) 11.754 7.504 ( -3.939 -4.682 1.347) 6.265 7.664 ( -0.592 -3.376 -4.604) 5.740 7.849 ( -13.101 -1.994 -3.894) 13.812 8.095 ( -11.840 0.760 1.890) 12.014 8.156 ( -4.417 0.635 5.514) 7.093 8.228 ( -3.450 1.704 -2.195) 4.430 8.813 ( 0.539 -2.862 -3.451) 4.516 8.983 ( -5.510 -9.184 4.363) 11.565 9.399 ( -1.519 0.106 5.162) 5.382 9.730 ( -7.231 -1.975 -0.058) 7.495 10.128 ( -3.997 -5.700 -3.345) 7.724 10.239 ( -7.538 -4.017 -8.966) 12.384 10.938 ( 2.698 -4.796 7.916) 9.641 11.178 ( -3.911 -8.310 -8.608) 12.588 12.075 ( 4.272 -0.677 12.407) 13.139 12.495 ( -5.410 6.580 -7.331) 11.239 13.008 ( 0.965 0.972 2.301) 2.678 13.057 ( 1.523 7.310 1.826) 7.687 13.404 ( 9.943 -0.819 2.478) 10.280 13.545 ( 6.490 -2.645 1.999) 7.288 13.925 ( 9.765 1.609 -5.042) 11.107 14.097 ( 9.045 2.931 -2.085) 9.734 14.982 ( -8.925 -3.089 -2.375) 9.738 15.215 ( -9.914 -4.128 2.646) 11.060 17.721 ( 0.815 0.130 -1.184) 1.443 17.845 ( 0.160 -0.765 0.371) 0.865 ======================= Grid point 238 (107/117) ======================= q-point: (-0.30 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.232 ( 1.395 9.528 -2.656) 9.989 1.318 ( -2.979 10.132 4.091) 11.326 1.550 ( -3.371 15.195 -8.003) 17.502 1.594 ( -7.324 14.625 8.402) 18.388 2.187 ( 5.359 -1.253 2.468) 6.032 2.251 ( 2.302 -0.553 -3.717) 4.407 2.329 ( 2.038 -0.785 0.125) 2.188 2.395 ( 5.543 -6.182 -0.171) 8.305 2.452 ( 2.441 -0.793 0.970) 2.744 2.532 ( 5.988 -5.775 -1.742) 8.500 2.668 ( -5.187 13.255 12.300) 18.812 2.711 ( -5.957 6.752 -7.085) 11.457 2.813 ( -3.756 1.213 -4.013) 5.628 2.847 ( -1.428 1.373 0.562) 2.059 2.915 ( 2.129 -3.956 -0.391) 4.510 3.000 ( 0.906 -2.120 -3.102) 3.865 3.169 ( 0.998 1.713 5.289) 5.648 3.202 ( 4.942 -0.200 -0.320) 4.956 3.222 ( 1.035 -5.415 -4.477) 7.102 3.348 ( 0.394 -6.609 1.396) 6.766 3.384 ( 3.648 1.431 -0.240) 3.926 3.510 ( -4.917 1.733 -1.645) 5.467 3.548 ( 1.336 0.967 1.520) 2.243 3.745 ( -2.906 -2.558 0.947) 3.985 3.927 ( 1.294 1.676 1.757) 2.751 3.992 ( -1.135 -0.008 -1.655) 2.007 4.300 ( 2.546 -2.649 -4.098) 5.505 4.340 ( -0.494 -0.797 2.354) 2.534 4.545 ( 3.712 -0.748 2.210) 4.384 4.680 ( 8.136 -1.127 -3.052) 8.763 4.814 ( -5.491 -4.092 2.267) 7.213 4.866 ( 0.372 -1.699 -2.959) 3.432 5.011 ( -11.025 -2.741 1.972) 11.531 5.086 ( -9.606 -1.051 0.074) 9.663 5.184 ( 3.058 -2.057 -1.649) 4.037 5.227 ( -1.306 -1.522 0.753) 2.142 5.258 ( -4.630 0.034 1.430) 4.846 5.378 ( -6.180 -3.039 0.105) 6.887 5.924 ( 0.943 1.477 -7.855) 8.048 6.083 ( -6.866 0.826 7.421) 10.143 6.141 ( -6.565 -0.419 4.758) 8.119 6.222 ( -10.269 -2.116 0.627) 10.503 6.406 ( 0.564 1.556 -0.517) 1.734 6.511 ( -3.575 -0.621 0.373) 3.647 7.006 ( -2.941 2.775 -0.294) 4.054 7.124 ( -9.733 -2.585 0.283) 10.075 7.500 ( -1.650 -5.699 4.890) 7.689 7.656 ( -10.498 -6.724 -5.201) 13.508 7.700 ( 2.629 -0.218 -5.808) 6.379 7.915 ( -9.285 -0.413 3.605) 9.969 8.107 ( -1.646 -0.578 3.469) 3.883 8.161 ( -2.754 1.150 -1.971) 3.577 8.860 ( 1.895 -5.121 -6.969) 8.853 8.972 ( -5.472 -8.784 6.594) 12.271 9.435 ( 2.809 -3.592 7.721) 8.967 9.633 ( -6.939 -4.247 -4.804) 9.449 10.132 ( -1.171 -5.482 -4.269) 7.046 10.169 ( -3.562 -3.317 -2.639) 5.537 11.028 ( 2.754 -2.874 10.687) 11.404 11.160 ( -3.815 -5.051 -11.279) 12.934 12.177 ( 4.886 -1.208 10.160) 11.338 12.359 ( -4.679 2.575 -6.916) 8.738 12.980 ( 0.919 6.553 7.018) 9.646 13.029 ( -0.374 3.812 -4.679) 6.046 13.606 ( 10.591 -1.914 8.711) 13.846 13.690 ( 6.096 -4.305 -5.038) 9.004 14.023 ( 7.156 3.898 -6.865) 10.655 14.230 ( 4.159 0.148 4.540) 6.158 14.882 ( -2.917 -2.330 -4.863) 6.131 15.091 ( -9.785 -5.185 2.627) 11.381 17.742 ( 2.304 0.319 -2.257) 3.241 17.840 ( -2.050 -1.389 1.083) 2.703 ======================= Grid point 239 (108/117) ======================= q-point: (-0.20 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 107 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.188 ( 2.737 9.144 -17.006) 19.501 1.188 ( -2.737 9.144 17.006) 19.501 1.383 ( 1.633 15.403 -17.288) 23.212 1.383 ( -1.633 15.403 17.288) 23.212 2.260 ( -0.244 1.253 -3.425) 3.655 2.260 ( 0.244 1.253 3.425) 3.655 2.360 ( 4.798 7.091 -10.885) 13.849 2.360 ( -4.798 7.091 10.885) 13.849 2.501 ( -2.208 7.254 -14.315) 16.199 2.501 ( 2.208 7.254 14.315) 16.199 2.620 ( -3.640 -5.850 -5.097) 8.570 2.620 ( 3.640 -5.850 5.097) 8.570 2.807 ( -1.143 0.224 -2.168) 2.461 2.807 ( 1.143 0.224 2.168) 2.461 2.995 ( -1.646 -1.042 -4.793) 5.174 2.995 ( 1.646 -1.042 4.793) 5.174 3.210 ( -1.102 -1.835 -5.448) 5.854 3.210 ( 1.102 -1.835 5.448) 5.854 3.372 ( -2.520 -4.040 -1.291) 4.933 3.372 ( 2.520 -4.040 1.291) 4.933 3.421 ( -3.009 -3.430 -2.222) 5.075 3.421 ( 3.009 -3.430 2.222) 5.075 3.654 ( -6.998 -0.703 -1.126) 7.123 3.654 ( 6.998 -0.703 1.126) 7.123 3.966 ( -2.411 -2.044 -1.389) 3.453 3.966 ( 2.411 -2.044 1.389) 3.453 4.341 ( 0.688 0.118 -3.437) 3.507 4.341 ( -0.688 0.118 3.437) 3.507 4.693 ( -10.264 -3.419 -1.282) 10.894 4.693 ( 10.264 -3.419 1.282) 10.894 4.850 ( -4.053 -1.227 -1.000) 4.352 4.850 ( 4.053 -1.227 1.000) 4.352 4.942 ( 2.322 -1.391 -2.551) 3.719 4.942 ( -2.322 -1.391 2.551) 3.719 5.197 ( 1.189 2.257 -2.915) 3.874 5.197 ( -1.189 2.257 2.915) 3.874 5.311 ( -1.686 -3.531 -1.379) 4.149 5.311 ( 1.686 -3.531 1.379) 4.149 5.968 ( 5.955 0.828 -5.026) 7.836 5.968 ( -5.955 0.828 5.026) 7.836 6.108 ( -2.962 -0.112 -3.058) 4.258 6.108 ( 2.962 -0.112 3.058) 4.258 6.442 ( -4.070 0.210 -0.884) 4.171 6.442 ( 4.070 0.210 0.884) 4.171 7.003 ( -1.344 0.512 -6.954) 7.101 7.003 ( 1.344 0.512 6.954) 7.101 7.575 ( -3.988 -5.435 -6.241) 9.186 7.575 ( 3.988 -5.435 6.241) 9.186 7.793 ( 6.271 -2.110 -4.251) 7.864 7.793 ( -6.271 -2.110 4.251) 7.864 8.114 ( -0.039 -0.253 -7.302) 7.306 8.114 ( 0.039 -0.253 7.302) 7.306 8.968 ( 4.360 -8.804 -8.810) 13.196 8.968 ( -4.360 -8.804 8.810) 13.196 9.563 ( -5.254 -6.688 -9.712) 12.910 9.563 ( 5.254 -6.688 9.712) 12.910 10.163 ( 0.789 -2.842 -11.086) 11.472 10.163 ( -0.789 -2.842 11.086) 11.472 11.108 ( -2.569 -0.076 -15.847) 16.054 11.108 ( 2.569 -0.076 15.847) 16.054 12.272 ( -2.766 -0.820 -7.895) 8.405 12.272 ( 2.766 -0.820 7.895) 8.405 12.963 ( -1.982 4.500 -7.510) 8.977 12.963 ( 1.982 4.500 7.510) 8.977 13.765 ( -2.090 -4.151 -11.550) 12.450 13.765 ( 2.090 -4.151 11.550) 12.450 14.154 ( 11.439 1.775 -5.691) 12.899 14.154 ( -11.439 1.775 5.691) 12.899 14.966 ( -0.531 -2.959 -7.604) 8.177 14.966 ( 0.531 -2.959 7.604) 8.177 17.797 ( 2.673 -0.823 -1.961) 3.416 17.797 ( -2.673 -0.823 1.961) 3.416 ======================= Grid point 245 (109/117) ======================= q-point: ( 0.30 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.425 ( 0.646 -0.000 -2.051) 2.151 1.563 ( -5.079 0.000 2.912) 5.854 1.738 ( 3.290 -0.000 0.677) 3.359 1.839 ( 7.029 -0.000 -1.496) 7.187 1.993 ( 2.221 -0.000 -3.393) 4.056 2.142 ( 7.714 -0.000 -0.834) 7.759 2.209 ( 5.917 -0.000 8.414) 10.286 2.253 ( -4.020 0.000 1.656) 4.348 2.315 ( 2.970 -0.000 -0.292) 2.984 2.405 ( 4.119 -0.000 2.336) 4.735 2.509 ( -3.597 0.000 -2.606) 4.441 2.524 ( -1.561 0.000 0.060) 1.562 2.675 ( -5.485 0.000 2.026) 5.847 2.699 ( -1.916 0.000 -4.272) 4.682 2.927 ( -0.545 0.000 0.020) 0.545 2.930 ( 0.480 -0.000 -0.765) 0.903 3.020 ( -2.349 0.000 -0.425) 2.387 3.083 ( -3.236 0.000 -3.021) 4.427 3.290 ( 0.080 -0.000 -6.729) 6.729 3.474 ( 5.150 -0.000 1.907) 5.492 3.579 ( 0.075 -0.000 4.342) 4.343 3.747 ( -4.721 0.000 -1.644) 4.999 3.886 ( 4.033 -0.000 3.370) 5.256 3.922 ( 2.321 -0.000 -0.814) 2.459 4.036 ( 3.721 -0.000 3.849) 5.354 4.158 ( -0.027 0.000 -4.973) 4.973 4.347 ( -1.621 0.000 0.763) 1.791 4.428 ( -0.675 0.000 6.810) 6.843 4.491 ( -1.030 0.000 -9.170) 9.228 4.515 ( -10.148 0.000 2.200) 10.384 4.597 ( 6.457 -0.000 1.431) 6.613 4.744 ( 2.885 -0.000 -1.979) 3.499 5.103 ( -3.890 0.000 -0.903) 3.993 5.143 ( 0.888 -0.000 3.794) 3.896 5.227 ( -5.199 0.000 -0.217) 5.204 5.400 ( -1.361 0.000 1.717) 2.191 5.891 ( -11.120 0.000 -3.941) 11.798 5.901 ( -10.230 0.000 6.007) 11.863 6.093 ( -4.452 0.000 -6.519) 7.894 6.279 ( 4.280 -0.000 -2.313) 4.865 6.311 ( 4.420 -0.000 2.367) 5.014 6.353 ( 0.264 -0.000 1.960) 1.978 6.625 ( -4.587 0.000 3.443) 5.735 6.748 ( -8.193 0.000 3.012) 8.729 7.469 ( -0.989 0.000 3.129) 3.282 7.499 ( -2.478 0.000 -2.010) 3.191 7.572 ( -6.737 0.000 -12.987) 14.630 7.678 ( -5.713 0.000 2.944) 6.426 8.112 ( -1.632 0.000 3.995) 4.315 8.198 ( -1.615 0.000 -6.890) 7.076 8.383 ( -3.528 0.000 2.148) 4.130 8.737 ( -1.240 0.000 1.915) 2.281 8.817 ( -3.032 0.000 1.704) 3.478 8.880 ( -12.509 0.000 2.237) 12.707 9.737 ( -11.016 0.000 12.078) 16.347 10.090 ( -4.811 0.000 -4.065) 6.299 10.097 ( -3.885 0.000 -6.663) 7.713 10.544 ( -14.017 0.000 2.691) 14.273 10.783 ( -1.581 0.000 -9.083) 9.220 10.937 ( 3.417 -0.000 -2.289) 4.113 11.991 ( -0.271 0.000 5.688) 5.694 12.722 ( 5.225 -0.000 3.909) 6.526 13.018 ( 6.769 -0.000 -3.884) 7.804 13.114 ( -9.286 0.000 -6.587) 11.385 13.301 ( 1.755 -0.000 11.946) 12.074 13.303 ( 0.530 -0.000 1.645) 1.728 13.565 ( 10.136 -0.000 -5.825) 11.691 13.943 ( 6.724 -0.000 -2.835) 7.298 15.167 ( -6.224 0.000 2.152) 6.586 15.455 ( -5.979 0.000 -0.449) 5.996 17.708 ( -0.571 0.000 0.518) 0.771 17.803 ( 1.768 -0.000 -0.812) 1.945 ======================= Grid point 246 (110/117) ======================= q-point: (-0.60 0.30 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.455 ( 3.028 1.407 -3.081) 4.544 1.498 ( -1.796 -0.504 3.597) 4.051 1.823 ( 5.369 -0.357 0.571) 5.411 1.952 ( 4.936 -0.732 1.546) 5.224 2.029 ( 1.207 -1.437 -3.779) 4.219 2.159 ( -2.370 1.468 -0.385) 2.814 2.249 ( 2.883 0.596 3.274) 4.403 2.283 ( -0.376 -0.790 2.725) 2.862 2.323 ( -1.662 4.072 0.738) 4.459 2.426 ( 1.279 -4.587 0.777) 4.825 2.476 ( -1.603 4.986 0.146) 5.239 2.565 ( 5.980 1.440 -0.737) 6.195 2.660 ( 3.949 -6.022 -0.479) 7.218 2.705 ( 1.035 -3.539 -2.890) 4.685 2.919 ( 1.900 2.857 1.533) 3.757 2.934 ( 0.044 1.335 -1.004) 1.671 3.016 ( 0.520 -3.304 -0.545) 3.388 3.089 ( 0.959 -5.010 -0.454) 5.121 3.272 ( -2.193 -1.164 -6.483) 6.943 3.549 ( 2.974 2.606 -1.207) 4.134 3.571 ( 0.238 1.872 5.900) 6.195 3.677 ( -3.218 -1.159 -1.860) 3.893 3.881 ( -3.382 7.980 -0.439) 8.678 3.951 ( 1.769 -0.049 0.778) 1.933 4.040 ( -0.013 5.418 -0.673) 5.460 4.140 ( -1.412 -4.381 -0.278) 4.611 4.199 ( -8.414 13.156 5.518) 16.562 4.402 ( -6.295 -6.952 -1.890) 9.567 4.445 ( 0.649 0.879 0.932) 1.436 4.484 ( 1.722 -1.755 -4.022) 4.714 4.716 ( 5.754 -0.887 3.164) 6.626 4.792 ( 2.261 -0.281 -0.391) 2.312 5.033 ( -4.524 -2.176 -1.072) 5.133 5.136 ( -0.846 0.666 -0.022) 1.077 5.191 ( -2.331 -3.834 -0.873) 4.571 5.370 ( -3.392 -1.394 3.907) 5.358 5.645 ( -14.748 0.931 -1.647) 14.868 5.676 ( -15.407 0.408 3.450) 15.794 6.026 ( -3.413 -0.502 -8.358) 9.042 6.294 ( -2.458 1.579 1.135) 3.134 6.335 ( -1.704 -1.737 2.369) 3.396 6.401 ( 0.373 -0.875 4.689) 4.784 6.523 ( -4.980 1.334 0.967) 5.246 6.604 ( -8.639 -2.052 2.500) 9.224 7.323 ( -10.653 0.621 -2.836) 11.042 7.411 ( -8.467 -1.352 -2.763) 9.009 7.536 ( -4.197 1.785 0.083) 4.562 7.588 ( -1.551 -3.452 -2.975) 4.815 8.041 ( -6.382 2.486 0.723) 6.887 8.126 ( -8.052 -4.798 -5.154) 10.697 8.321 ( -3.596 0.298 -0.501) 3.643 8.535 ( -13.943 8.529 7.806) 18.113 8.771 ( -0.582 -0.513 1.290) 1.505 8.823 ( -3.889 -8.207 1.611) 9.224 9.570 ( -7.129 3.993 8.997) 12.154 9.907 ( -6.528 6.751 -4.020) 10.215 10.072 ( -8.886 -10.268 -10.421) 17.117 10.296 ( -13.668 -1.119 2.638) 13.966 10.785 ( 1.984 -1.622 -2.800) 3.796 11.001 ( 0.798 -5.579 -5.150) 7.635 12.014 ( 2.270 0.629 11.351) 11.593 12.786 ( 0.115 4.201 -1.860) 4.596 12.943 ( -2.503 1.995 -3.205) 4.530 13.133 ( 1.319 -5.095 -4.661) 7.030 13.305 ( 5.535 6.570 5.428) 10.162 13.394 ( 4.297 -3.114 8.538) 10.053 13.750 ( 12.070 0.580 -5.108) 13.120 14.052 ( 6.903 1.482 -4.820) 8.549 15.048 ( -8.503 -1.971 0.549) 8.746 15.323 ( -9.630 -0.748 1.536) 9.780 17.708 ( 0.404 -0.154 -0.348) 0.555 17.827 ( 1.024 0.012 -0.103) 1.029 ======================= Grid point 247 (111/117) ======================= q-point: (-0.50 0.30 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.448 ( 1.214 6.624 0.598) 6.761 1.528 ( 3.211 2.602 0.745) 4.199 1.890 ( 2.030 4.106 1.741) 4.900 1.965 ( -3.130 3.200 3.199) 5.502 2.067 ( 4.382 -0.929 -4.709) 6.499 2.141 ( 1.413 1.110 -4.819) 5.144 2.239 ( -1.141 0.794 2.619) 2.965 2.279 ( -1.682 -0.464 0.610) 1.848 2.308 ( 4.530 -2.220 1.466) 5.254 2.415 ( -1.394 -0.142 1.833) 2.307 2.538 ( 2.466 -9.308 1.011) 9.682 2.700 ( 4.179 -4.036 -0.825) 5.868 2.721 ( 2.979 -4.249 -0.391) 5.204 2.797 ( 2.369 -0.990 -1.481) 2.964 2.922 ( 0.055 0.659 -1.074) 1.261 2.973 ( 5.335 1.674 -0.223) 5.596 3.097 ( 6.164 -2.922 2.296) 7.197 3.164 ( 1.876 -4.316 0.875) 4.787 3.217 ( -4.747 -2.295 -4.344) 6.832 3.494 ( -1.573 7.465 -2.397) 7.996 3.571 ( -2.176 3.645 2.998) 5.197 3.632 ( -2.373 2.774 -5.372) 6.495 3.716 ( -1.487 7.862 1.585) 8.157 3.860 ( -8.563 16.389 3.727) 18.863 3.981 ( 1.264 0.244 2.596) 2.898 4.048 ( -0.233 3.975 0.749) 4.052 4.178 ( 0.130 -4.525 -1.806) 4.874 4.345 ( -5.187 -3.387 -2.011) 6.513 4.482 ( 4.293 -0.408 -1.270) 4.495 4.525 ( 0.326 -3.377 -0.054) 3.393 4.788 ( -0.188 -2.051 2.705) 3.399 4.817 ( 0.450 -0.477 0.537) 0.847 5.018 ( 0.579 -3.718 -0.988) 3.891 5.101 ( -6.299 -2.822 0.000) 6.902 5.173 ( -2.130 -2.437 -4.171) 5.279 5.299 ( -8.037 -2.291 5.877) 10.216 5.382 ( -14.308 1.074 4.291) 14.976 5.445 ( -9.523 -1.008 -2.459) 9.886 5.969 ( -2.099 -0.017 -9.363) 9.595 6.211 ( -6.521 0.125 4.451) 7.896 6.235 ( -9.721 -1.323 8.874) 13.229 6.337 ( -8.303 -1.995 0.898) 8.586 6.471 ( -1.217 1.572 -3.261) 3.819 6.532 ( -2.201 -1.001 1.425) 2.807 7.156 ( -7.434 0.844 -2.971) 8.050 7.239 ( -11.387 -1.697 -3.689) 12.089 7.444 ( -5.416 -2.263 5.264) 7.885 7.602 ( -1.770 -2.763 -3.224) 4.600 7.854 ( -11.022 1.796 -6.275) 12.810 8.010 ( -10.290 -5.334 -0.227) 11.593 8.254 ( -3.492 1.137 -2.365) 4.368 8.269 ( -8.620 6.701 9.968) 14.785 8.777 ( 0.155 -1.272 -0.237) 1.303 8.835 ( -2.966 -7.037 2.101) 7.920 9.455 ( -2.102 5.069 5.245) 7.591 9.741 ( -7.402 3.292 -1.291) 8.203 9.994 ( -6.923 -8.794 -9.321) 14.566 10.130 ( -10.342 -7.580 -0.214) 12.825 10.860 ( 3.589 -3.284 3.977) 6.283 11.044 ( -0.861 -5.782 -7.794) 9.743 12.080 ( 4.567 0.913 14.173) 14.919 12.627 ( -7.446 7.451 -10.772) 15.066 12.990 ( 3.566 -1.755 2.975) 4.965 13.145 ( -0.894 0.856 -2.593) 2.873 13.410 ( 10.040 2.562 5.051) 11.527 13.512 ( 5.981 -1.542 5.319) 8.151 13.948 ( 11.661 0.957 -4.249) 12.448 14.144 ( 6.673 2.227 -4.997) 8.629 14.920 ( -8.779 -3.376 -1.871) 9.591 15.153 ( -11.697 -2.580 3.739) 12.548 17.722 ( 1.122 -0.019 -1.351) 1.757 17.835 ( -0.262 -0.305 0.766) 0.865 ======================= Grid point 248 (112/117) ======================= q-point: (-0.40 0.30 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.406 ( 2.592 9.849 0.865) 10.221 1.492 ( -1.238 9.069 0.451) 9.164 1.805 ( -2.006 13.085 0.794) 13.261 1.836 ( -3.706 12.300 -0.393) 12.853 2.137 ( 4.177 -3.690 0.978) 5.659 2.227 ( 1.146 -2.049 1.314) 2.690 2.283 ( 5.816 -5.499 -3.426) 8.707 2.296 ( 1.668 -3.537 -0.667) 3.967 2.416 ( 1.841 -5.576 0.355) 5.883 2.437 ( 3.916 -1.197 1.547) 4.377 2.650 ( -0.420 -11.923 0.480) 11.940 2.720 ( -3.987 -7.746 -1.497) 8.840 2.811 ( -0.953 -0.841 0.973) 1.601 2.859 ( 5.552 -0.399 1.246) 5.704 2.895 ( -2.802 2.551 -1.730) 4.165 2.988 ( -1.130 2.182 -1.325) 2.792 3.162 ( -0.190 -2.596 0.010) 2.603 3.206 ( 0.980 -2.069 -1.745) 2.878 3.271 ( 5.191 1.986 5.768) 8.010 3.346 ( -1.630 12.001 -6.942) 13.959 3.488 ( 1.729 10.108 -1.266) 10.332 3.558 ( -2.678 2.993 2.177) 4.568 3.639 ( -0.849 10.650 1.024) 10.732 3.704 ( -0.793 -1.356 1.621) 2.257 3.977 ( -0.362 3.058 3.137) 4.396 4.012 ( -1.473 1.815 -2.605) 3.500 4.231 ( 2.105 -4.943 -4.204) 6.822 4.305 ( -2.451 -3.294 2.231) 4.673 4.541 ( 2.473 0.078 2.423) 3.463 4.618 ( 6.423 -5.401 -3.035) 8.924 4.752 ( -6.117 -3.040 0.458) 6.847 4.837 ( 1.300 -1.982 -0.009) 2.371 4.945 ( -12.290 -3.870 1.355) 12.956 5.064 ( -8.106 -1.435 -1.029) 8.296 5.132 ( 2.159 -2.480 -0.033) 3.289 5.202 ( -1.362 -1.835 0.536) 2.347 5.242 ( -4.668 -1.966 2.727) 5.753 5.334 ( -6.146 -1.824 -0.093) 6.411 5.946 ( 1.236 0.908 -8.733) 8.867 6.089 ( -7.360 -0.182 7.347) 10.401 6.120 ( -5.693 -1.800 2.669) 6.540 6.195 ( -8.949 -0.878 1.316) 9.088 6.436 ( -0.237 1.748 -1.505) 2.319 6.500 ( -2.938 -0.625 1.071) 3.189 7.045 ( -3.973 1.504 -0.929) 4.349 7.085 ( -7.281 -1.726 -3.113) 8.105 7.411 ( -2.096 -4.217 5.632) 7.342 7.540 ( -8.530 -5.199 -1.793) 10.149 7.719 ( -0.797 1.276 -8.317) 8.452 7.874 ( -9.553 -3.166 3.053) 10.517 8.144 ( -1.853 3.589 6.564) 7.707 8.187 ( -2.730 1.592 -3.181) 4.484 8.797 ( 0.675 -2.303 -2.923) 3.782 8.844 ( -2.816 -5.624 3.727) 7.311 9.428 ( 2.245 2.343 4.361) 5.436 9.599 ( -6.725 0.620 -2.270) 7.125 9.995 ( -1.850 -9.825 -6.940) 12.170 10.063 ( -6.049 -8.663 1.153) 10.629 10.958 ( 3.048 -3.957 8.383) 9.758 11.059 ( -1.936 -5.224 -9.765) 11.242 12.177 ( 5.883 1.174 14.016) 15.246 12.432 ( -6.970 5.211 -11.809) 14.669 13.047 ( 2.066 1.085 3.608) 4.297 13.105 ( -0.834 3.553 -3.006) 4.728 13.579 ( 8.456 -0.807 9.066) 12.424 13.630 ( 5.282 -2.244 -2.985) 6.469 14.092 ( 8.284 3.805 -6.550) 11.225 14.236 ( 4.125 0.502 1.643) 4.469 14.824 ( -4.208 -3.832 -5.436) 7.871 14.994 ( -10.929 -5.293 5.374) 13.279 17.746 ( 2.047 0.137 -2.219) 3.022 17.823 ( -1.828 -0.627 1.641) 2.536 ======================= Grid point 249 (113/117) ======================= q-point: (-0.30 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.365 ( 1.186 10.584 -12.777) 16.634 1.365 ( -1.186 10.584 12.777) 16.634 1.659 ( 0.911 15.594 -12.653) 20.102 1.659 ( -0.911 15.594 12.653) 20.102 2.236 ( -2.116 -2.780 -0.243) 3.502 2.236 ( 2.116 -2.780 0.243) 3.502 2.364 ( -2.037 -3.249 0.213) 3.841 2.364 ( 2.037 -3.249 -0.213) 3.841 2.507 ( -0.763 -5.483 -5.379) 7.719 2.507 ( 0.763 -5.483 5.379) 7.719 2.723 ( -0.192 1.130 -3.005) 3.216 2.723 ( 0.192 1.130 3.005) 3.216 2.783 ( -1.283 2.491 -6.559) 7.132 2.783 ( 1.283 2.491 6.559) 7.132 2.946 ( -3.460 -2.970 -0.806) 4.630 2.946 ( 3.460 -2.970 0.806) 4.630 3.201 ( -0.441 1.547 -8.209) 8.365 3.201 ( 0.441 1.547 8.209) 8.365 3.272 ( 0.700 0.186 -3.211) 3.291 3.272 ( -0.700 0.186 3.211) 3.291 3.474 ( -2.435 5.054 0.277) 5.617 3.474 ( 2.435 5.054 -0.277) 5.617 3.656 ( -4.645 0.833 -1.920) 5.094 3.656 ( 4.645 0.833 1.920) 5.094 3.963 ( -1.495 1.350 -3.100) 3.696 3.963 ( 1.495 1.350 3.100) 3.696 4.309 ( 1.859 -3.513 -4.505) 6.007 4.309 ( -1.859 -3.513 4.505) 6.007 4.639 ( -7.972 -2.362 -1.694) 8.486 4.639 ( 7.972 -2.362 1.694) 8.486 4.802 ( -5.880 -4.874 0.905) 7.690 4.802 ( 5.880 -4.874 -0.905) 7.690 4.918 ( -2.217 -1.023 -1.590) 2.914 4.918 ( 2.217 -1.023 1.590) 2.914 5.209 ( 1.126 -0.757 -2.224) 2.605 5.209 ( -1.126 -0.757 2.224) 2.605 5.253 ( -5.328 -3.017 -0.039) 6.123 5.253 ( 5.328 -3.017 0.039) 6.123 5.986 ( 5.165 0.913 -6.009) 7.976 5.986 ( -5.165 0.913 6.009) 7.976 6.096 ( -1.145 -0.970 -3.114) 3.457 6.096 ( 1.145 -0.970 3.114) 3.457 6.448 ( -2.248 0.434 -0.279) 2.306 6.448 ( 2.248 0.434 0.279) 2.306 7.012 ( 0.122 0.405 -7.004) 7.016 7.012 ( -0.122 0.405 7.004) 7.016 7.471 ( -3.570 -5.730 -5.437) 8.668 7.471 ( 3.570 -5.730 5.437) 8.668 7.762 ( 4.899 -1.340 -5.506) 7.490 7.762 ( -4.899 -1.340 5.506) 7.490 8.130 ( -0.853 1.793 -6.468) 6.766 8.130 ( 0.853 1.793 6.468) 6.766 8.848 ( 2.562 -4.918 -5.769) 8.003 8.848 ( -2.562 -4.918 5.769) 8.003 9.495 ( -4.192 -1.309 -7.045) 8.301 9.495 ( 4.192 -1.309 7.045) 8.301 10.072 ( 1.266 -7.780 -13.004) 15.206 10.072 ( -1.266 -7.780 13.004) 15.206 11.052 ( -1.496 -4.593 -15.371) 16.112 11.052 ( 1.496 -4.593 15.371) 16.112 12.280 ( -5.513 1.802 -11.655) 13.018 12.280 ( 5.513 1.802 11.655) 13.018 13.051 ( -0.975 4.436 -4.657) 6.505 13.051 ( 0.975 4.436 4.657) 6.505 13.695 ( -0.609 -3.396 -14.469) 14.875 13.695 ( 0.609 -3.396 14.469) 14.875 14.193 ( 7.012 2.683 -6.771) 10.110 14.193 ( -7.012 2.683 6.771) 10.110 14.889 ( 3.174 -5.422 -8.803) 10.815 14.889 ( -3.174 -5.422 8.803) 10.815 17.788 ( 2.641 -0.348 -2.402) 3.587 17.788 ( -2.641 -0.348 2.402) 3.587 ======================= Grid point 257 (114/117) ======================= q-point: (-0.60 0.40 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.518 ( 2.963 -0.000 5.451) 6.204 1.542 ( 5.794 -0.000 -4.252) 7.187 1.924 ( 6.641 -0.000 -0.591) 6.667 1.959 ( -2.939 0.000 5.792) 6.495 2.064 ( 3.018 -0.000 -5.889) 6.617 2.179 ( 4.367 -0.000 -3.736) 5.747 2.233 ( -2.531 0.000 -1.873) 3.148 2.268 ( -1.721 0.000 2.780) 3.270 2.320 ( -4.217 0.000 1.557) 4.495 2.399 ( 1.568 -0.000 2.278) 2.766 2.465 ( -2.436 0.000 4.902) 5.474 2.626 ( -1.181 0.000 -3.547) 3.739 2.697 ( 8.640 -0.000 1.098) 8.709 2.792 ( 3.909 -0.000 -3.321) 5.129 2.937 ( 0.462 -0.000 -2.031) 2.082 3.008 ( 0.591 -0.000 2.531) 2.599 3.045 ( 10.193 -0.000 3.579) 10.803 3.123 ( 5.262 -0.000 -0.759) 5.317 3.196 ( -5.060 0.000 -6.809) 8.483 3.579 ( -0.984 0.000 0.416) 1.068 3.587 ( -0.805 0.000 3.200) 3.300 3.610 ( -2.594 0.000 -2.442) 3.563 3.906 ( -2.434 0.000 -2.120) 3.228 3.916 ( 0.302 -0.000 3.893) 3.905 4.053 ( -1.505 0.000 -2.875) 3.245 4.107 ( -1.436 0.000 1.272) 1.918 4.169 ( -6.373 0.000 3.441) 7.243 4.225 ( -4.231 0.000 -0.735) 4.295 4.483 ( 0.363 -0.000 -6.999) 7.009 4.492 ( 2.741 -0.000 3.321) 4.306 4.767 ( -0.955 0.000 2.348) 2.535 4.816 ( 0.289 -0.000 3.000) 3.014 4.982 ( 1.460 -0.000 -2.494) 2.890 5.072 ( -7.545 0.000 0.537) 7.564 5.146 ( -0.955 0.000 -5.442) 5.525 5.275 ( -7.340 0.000 6.778) 9.991 5.394 ( -16.796 0.000 4.008) 17.267 5.435 ( -8.873 0.000 -2.004) 9.096 5.968 ( -1.685 0.000 -9.513) 9.662 6.217 ( -9.381 0.000 4.744) 10.512 6.217 ( -7.808 0.000 7.342) 10.718 6.316 ( -7.780 0.000 1.258) 7.881 6.491 ( -0.596 0.000 -3.747) 3.794 6.520 ( -1.990 0.000 2.908) 3.524 7.162 ( -7.463 0.000 -3.576) 8.275 7.225 ( -11.042 0.000 -5.396) 12.290 7.423 ( -6.361 0.000 6.232) 8.905 7.578 ( -1.767 0.000 -2.318) 2.915 7.884 ( -12.464 0.000 -11.902) 17.234 7.950 ( -7.689 0.000 4.635) 8.977 8.263 ( -3.166 0.000 -2.556) 4.069 8.338 ( -11.885 0.000 12.040) 16.918 8.765 ( -0.251 0.000 -0.144) 0.289 8.767 ( 0.084 -0.000 0.870) 0.874 9.518 ( -2.425 0.000 10.474) 10.751 9.808 ( -7.728 0.000 -17.662) 19.279 9.879 ( -6.075 0.000 -0.684) 6.113 10.038 ( -13.824 0.000 3.551) 14.273 10.831 ( 3.935 -0.000 1.929) 4.382 10.992 ( 0.862 -0.000 -7.522) 7.572 12.091 ( 4.733 -0.000 14.847) 15.583 12.706 ( -9.211 0.000 -12.910) 15.859 12.971 ( 4.317 -0.000 4.256) 6.062 13.132 ( 0.592 -0.000 -4.522) 4.560 13.469 ( 8.268 -0.000 -5.300) 9.821 13.476 ( 6.211 -0.000 18.499) 19.514 13.956 ( 12.240 -0.000 -3.858) 12.833 14.166 ( 6.048 -0.000 -6.578) 8.935 14.886 ( -8.780 0.000 -1.757) 8.954 15.130 ( -12.457 0.000 4.288) 13.174 17.721 ( 1.234 -0.000 -1.409) 1.873 17.833 ( -0.390 0.000 0.871) 0.955 ======================= Grid point 259 (115/117) ======================= q-point: (-0.50 0.40 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.553 ( 3.143 5.704 4.379) 7.848 1.610 ( 2.117 3.478 -3.854) 5.606 1.938 ( 1.630 1.381 7.826) 8.113 2.009 ( 2.122 6.202 -1.112) 6.648 2.127 ( 4.434 -0.543 -8.301) 9.427 2.168 ( 0.897 2.039 -2.827) 3.599 2.231 ( 0.801 -2.236 0.085) 2.377 2.251 ( -1.762 0.711 2.710) 3.309 2.307 ( -0.095 -7.084 -2.679) 7.575 2.421 ( 3.032 -3.435 1.749) 4.904 2.462 ( -3.598 -4.347 5.591) 7.944 2.598 ( -4.273 -4.330 -1.851) 6.359 2.806 ( 0.044 0.078 -1.443) 1.446 2.813 ( 1.771 -1.884 1.362) 2.922 2.969 ( 4.490 3.308 -0.888) 5.647 3.016 ( 0.236 0.685 2.186) 2.303 3.109 ( -3.459 -2.605 -3.890) 5.821 3.163 ( 1.256 -1.667 -3.506) 4.081 3.289 ( 11.406 0.347 5.284) 12.576 3.516 ( -2.556 6.066 -4.150) 7.782 3.566 ( 0.088 0.948 4.762) 4.856 3.604 ( -0.325 -2.054 -2.977) 3.631 3.808 ( 1.077 12.755 -0.974) 12.838 3.906 ( -4.651 15.898 2.694) 16.782 3.987 ( 1.064 -3.540 3.443) 5.051 4.040 ( -2.403 0.467 -2.978) 3.855 4.151 ( 0.195 -2.806 0.050) 2.813 4.207 ( -3.817 -7.891 -0.778) 8.800 4.516 ( 3.280 -3.296 -3.454) 5.792 4.549 ( 3.669 -0.813 1.370) 4.000 4.708 ( -5.502 -1.630 0.062) 5.739 4.801 ( -4.618 -1.425 5.203) 7.102 4.906 ( -8.505 -0.748 -0.577) 8.557 5.035 ( -2.523 -1.429 -4.200) 5.104 5.110 ( -0.671 -0.299 -1.188) 1.397 5.176 ( -3.216 -0.461 2.273) 3.965 5.197 ( -4.922 -2.495 3.289) 6.424 5.316 ( -6.510 -0.418 0.651) 6.556 5.956 ( 1.625 0.266 -9.497) 9.639 6.083 ( -7.311 -0.217 7.476) 10.459 6.092 ( -4.983 -1.026 -0.022) 5.087 6.187 ( -7.969 -0.225 3.518) 8.714 6.464 ( -1.139 1.299 -1.333) 2.183 6.488 ( -2.449 -0.718 1.533) 2.977 7.060 ( -4.329 0.265 -0.330) 4.350 7.066 ( -6.111 -0.513 -6.421) 8.879 7.359 ( -2.462 -1.562 5.715) 6.416 7.480 ( -8.731 -1.630 -0.083) 8.882 7.737 ( -2.112 0.665 -10.868) 11.091 7.831 ( -7.266 -1.400 4.903) 8.877 8.199 ( -4.145 1.978 8.002) 9.227 8.208 ( -2.617 0.622 -3.055) 4.070 8.772 ( 0.142 -0.721 -0.118) 0.744 8.775 ( -0.181 -2.053 0.455) 2.111 9.499 ( 1.352 4.401 8.343) 9.529 9.654 ( -6.036 4.637 -8.900) 11.711 9.825 ( -2.939 -7.242 -6.928) 10.444 9.893 ( -7.896 -8.859 4.598) 12.727 10.909 ( 3.561 -1.405 5.974) 7.095 10.997 ( -0.548 -1.747 -8.618) 8.810 12.202 ( 6.725 1.094 16.241) 17.613 12.514 ( -9.052 3.072 -15.207) 17.962 13.048 ( 3.347 -0.362 5.000) 6.028 13.127 ( -0.868 -0.307 -4.897) 4.982 13.584 ( 6.554 1.155 5.845) 8.857 13.605 ( 5.082 -1.033 2.553) 5.780 14.145 ( 9.949 1.837 -2.170) 10.347 14.245 ( 4.139 0.386 -5.134) 6.606 14.765 ( -4.987 -2.170 -5.349) 7.628 14.924 ( -12.471 -2.222 7.127) 14.535 17.747 ( 1.972 0.022 -2.213) 2.964 17.816 ( -1.725 -0.181 1.806) 2.504 ======================= Grid point 260 (116/117) ======================= q-point: (-0.40 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 107 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.540 ( -0.346 8.557 -8.643) 12.168 1.540 ( 0.346 8.557 8.643) 12.168 1.912 ( -0.517 12.230 -8.156) 14.710 1.912 ( 0.517 12.230 8.156) 14.710 2.176 ( -0.981 -2.750 -4.799) 5.617 2.176 ( 0.981 -2.750 4.799) 5.617 2.285 ( -0.130 -4.985 -0.564) 5.018 2.285 ( 0.130 -4.985 0.564) 5.018 2.420 ( 4.575 -6.111 -5.272) 9.277 2.420 ( -4.575 -6.111 5.272) 9.277 2.560 ( -2.348 -8.797 -3.162) 9.639 2.560 ( 2.348 -8.797 3.162) 9.639 2.818 ( -1.401 -1.168 -0.652) 1.937 2.818 ( 1.401 -1.168 0.652) 1.937 2.979 ( -1.662 4.322 -0.250) 4.637 2.979 ( 1.662 4.322 0.250) 4.637 3.160 ( -1.572 -3.781 -4.746) 6.268 3.160 ( 1.572 -3.781 4.746) 6.268 3.402 ( -2.965 6.824 -5.775) 9.418 3.402 ( 2.965 6.824 5.775) 9.418 3.576 ( -1.819 3.946 -4.099) 5.973 3.576 ( 1.819 3.946 4.099) 5.973 3.728 ( 1.396 10.612 -1.343) 10.787 3.728 ( -1.396 10.612 1.343) 10.787 3.996 ( -0.552 1.704 -4.143) 4.514 3.996 ( 0.552 1.704 4.143) 4.514 4.223 ( 1.952 -6.219 -3.275) 7.294 4.223 ( -1.952 -6.219 3.275) 7.294 4.615 ( -6.196 -0.587 -1.258) 6.350 4.615 ( 6.196 -0.587 1.258) 6.350 4.687 ( -0.841 -6.903 -1.109) 7.041 4.687 ( 0.841 -6.903 1.109) 7.041 4.910 ( -4.363 -0.027 -2.539) 5.048 4.910 ( 4.363 -0.027 2.539) 5.048 5.178 ( 0.303 -2.417 -2.420) 3.433 5.178 ( -0.303 -2.417 2.420) 3.433 5.210 ( -6.346 -1.535 0.771) 6.574 5.210 ( 6.346 -1.535 -0.771) 6.574 5.997 ( 4.102 0.328 -7.253) 8.339 5.997 ( -4.102 0.328 7.253) 8.339 6.081 ( 2.704 -0.627 -4.557) 5.336 6.081 ( -2.704 -0.627 4.557) 5.336 6.455 ( 1.510 0.355 -0.813) 1.752 6.455 ( -1.510 0.355 0.813) 1.752 7.016 ( 0.441 -0.006 -5.721) 5.738 7.016 ( -0.441 -0.006 5.721) 5.738 7.389 ( -3.069 -3.292 -4.146) 6.119 7.389 ( 3.069 -3.292 4.146) 6.119 7.746 ( 3.699 -0.476 -6.992) 7.925 7.746 ( -3.699 -0.476 6.992) 7.925 8.164 ( -0.494 1.738 -6.513) 6.759 8.164 ( 0.494 1.738 6.513) 6.759 8.788 ( 0.648 -2.142 -1.800) 2.871 8.788 ( -0.648 -2.142 1.800) 2.871 9.517 ( -2.205 3.718 -9.540) 10.473 9.517 ( 2.205 3.718 9.540) 10.473 9.900 ( 1.787 -10.778 -10.747) 15.325 9.900 ( -1.787 -10.778 10.747) 15.325 10.984 ( -1.574 -2.719 -10.901) 11.344 10.984 ( 1.574 -2.719 10.901) 11.344 12.327 ( -7.554 2.911 -15.263) 17.277 12.327 ( 7.554 2.911 15.263) 17.277 13.096 ( -1.800 0.767 -4.885) 5.262 13.096 ( 1.800 0.767 4.885) 5.262 13.656 ( 0.550 -1.009 -16.022) 16.063 13.656 ( -0.550 -1.009 16.022) 16.063 14.242 ( 1.985 2.643 -6.165) 6.996 14.242 ( -1.985 2.643 6.165) 6.996 14.794 ( 5.279 -4.753 -9.096) 11.541 14.794 ( -5.279 -4.753 9.096) 11.541 17.783 ( 2.362 -0.144 -2.398) 3.369 17.783 ( -2.362 -0.144 2.398) 3.369 ======================= Grid point 271 (117/117) ======================= q-point: ( 0.50 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.98e-04 5.98e-04 5.98e-04 5.98e-04 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 6.24e-05 Number of triplets: 61 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.626 ( -1.438 0.000 -5.955) 6.126 1.626 ( 1.438 0.000 5.955) 6.126 2.020 ( -4.148 0.000 -6.581) 7.779 2.020 ( 4.148 0.000 6.581) 7.779 2.200 ( 0.212 0.000 -5.243) 5.248 2.200 ( -0.212 0.000 5.243) 5.248 2.230 ( 0.151 -0.000 -1.027) 1.038 2.230 ( -0.151 0.000 1.027) 1.038 2.295 ( 8.054 0.000 -8.414) 11.647 2.295 ( -8.054 0.000 8.414) 11.647 2.500 ( -4.439 0.000 -1.719) 4.760 2.500 ( 4.439 0.000 1.719) 4.760 2.804 ( 0.585 0.000 -2.095) 2.175 2.804 ( -0.585 0.000 2.095) 2.175 3.031 ( -2.110 -0.000 -4.091) 4.603 3.031 ( 2.110 0.000 4.091) 4.603 3.111 ( -5.418 0.000 -3.975) 6.720 3.111 ( 5.418 0.000 3.975) 6.720 3.456 ( -6.849 0.000 -4.824) 8.377 3.456 ( 6.849 0.000 4.824) 8.377 3.597 ( -0.143 0.000 -3.088) 3.091 3.597 ( 0.143 0.000 3.088) 3.091 3.923 ( 2.914 -0.000 -2.216) 3.661 3.923 ( -2.914 -0.000 2.216) 3.661 3.990 ( -1.525 0.000 -5.946) 6.138 3.990 ( 1.525 0.000 5.946) 6.138 4.129 ( 0.244 0.000 -2.605) 2.616 4.129 ( -0.244 0.000 2.605) 2.616 4.596 ( 2.583 0.000 -3.575) 4.410 4.596 ( -2.583 0.000 3.575) 4.410 4.629 ( -3.483 0.000 0.628) 3.539 4.629 ( 3.483 0.000 -0.628) 3.539 4.911 ( -5.390 0.000 -3.124) 6.230 4.911 ( 5.390 0.000 3.124) 6.230 5.152 ( 0.342 0.000 -2.669) 2.691 5.152 ( -0.342 0.000 2.669) 2.691 5.197 ( -6.847 0.000 1.217) 6.954 5.197 ( 6.847 0.000 -1.217) 6.954 5.999 ( 3.773 0.000 -8.361) 9.173 5.999 ( -3.773 0.000 8.361) 9.173 6.076 ( 4.202 0.000 -6.270) 7.547 6.076 ( -4.202 0.000 6.270) 7.547 6.459 ( 0.365 0.000 -0.827) 0.904 6.459 ( -0.365 0.000 0.827) 0.904 7.015 ( 0.728 0.000 -4.672) 4.728 7.015 ( -0.728 0.000 4.672) 4.728 7.360 ( -3.265 0.000 -3.483) 4.774 7.360 ( 3.265 0.000 3.483) 4.774 7.743 ( 3.171 0.000 -7.508) 8.150 7.743 ( -3.171 0.000 7.508) 8.150 8.181 ( -0.106 0.000 -6.727) 6.728 8.181 ( 0.106 0.000 6.727) 6.728 8.769 ( 0.151 0.000 -0.429) 0.455 8.769 ( -0.151 0.000 0.429) 0.455 9.583 ( -3.967 0.000 -15.103) 15.615 9.583 ( 3.967 0.000 15.103) 15.615 9.767 ( 1.209 -0.000 -1.684) 2.073 9.767 ( -1.209 0.000 1.684) 2.073 10.960 ( -2.082 0.000 -7.813) 8.086 10.960 ( 2.082 0.000 7.813) 8.086 12.357 ( -8.437 0.000 -16.811) 18.810 12.357 ( 8.437 0.000 16.811) 18.810 13.098 ( -1.931 0.000 -5.488) 5.818 13.098 ( 1.931 0.000 5.488) 5.818 13.650 ( 0.946 0.000 -16.011) 16.039 13.650 ( -0.946 0.000 16.011) 16.039 14.269 ( -1.922 0.000 -4.876) 5.241 14.269 ( 1.922 0.000 4.876) 5.241 14.747 ( 5.975 0.000 -8.855) 10.682 14.747 ( -5.975 0.000 8.855) 10.682 17.782 ( 2.284 0.000 -2.375) 3.295 17.782 ( -2.284 0.000 2.375) 3.295 =================== 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 3/28800 10.0 802.984 1106.530 741.034 -0.000 -24.119 0.000 3/28800 20.0 111.928 154.386 140.402 -0.000 -10.345 0.000 3/28800 30.0 39.535 54.465 51.229 -0.000 -3.734 0.000 3/28800 40.0 20.773 28.177 26.605 -0.000 -1.896 0.000 3/28800 50.0 13.335 17.803 16.799 -0.000 -1.188 0.000 3/28800 60.0 9.619 12.645 11.928 -0.000 -0.842 0.000 3/28800 70.0 7.469 9.673 9.134 -0.000 -0.644 0.000 3/28800 80.0 6.093 7.783 7.363 -0.000 -0.519 0.000 3/28800 90.0 5.145 6.491 6.157 -0.000 -0.432 0.000 3/28800 100.0 4.457 5.559 5.289 -0.000 -0.370 0.000 3/28800 110.0 3.935 4.860 4.637 -0.000 -0.322 0.000 3/28800 120.0 3.525 4.317 4.132 -0.000 -0.285 0.000 3/28800 130.0 3.196 3.885 3.728 -0.000 -0.255 0.000 3/28800 140.0 2.926 3.532 3.399 -0.000 -0.231 0.000 3/28800 150.0 2.699 3.239 3.125 -0.000 -0.211 0.000 3/28800 160.0 2.507 2.993 2.894 -0.000 -0.194 0.000 3/28800 170.0 2.341 2.782 2.696 -0.000 -0.180 0.000 3/28800 180.0 2.197 2.599 2.524 -0.000 -0.167 0.000 3/28800 190.0 2.070 2.440 2.374 -0.000 -0.156 0.000 3/28800 200.0 1.958 2.300 2.241 -0.000 -0.147 0.000 3/28800 210.0 1.857 2.175 2.123 -0.000 -0.138 0.000 3/28800 220.0 1.767 2.064 2.018 -0.000 -0.131 0.000 3/28800 230.0 1.685 1.964 1.922 -0.000 -0.124 0.000 3/28800 240.0 1.611 1.873 1.836 -0.000 -0.118 0.000 3/28800 250.0 1.544 1.791 1.757 -0.000 -0.112 0.000 3/28800 260.0 1.481 1.715 1.685 -0.000 -0.107 0.000 3/28800 270.0 1.424 1.646 1.618 -0.000 -0.103 0.000 3/28800 280.0 1.371 1.583 1.557 -0.000 -0.099 0.000 3/28800 290.0 1.323 1.524 1.501 -0.000 -0.095 0.000 3/28800 300.0 1.277 1.470 1.448 -0.000 -0.091 0.000 3/28800 310.0 1.235 1.419 1.399 -0.000 -0.088 0.000 3/28800 320.0 1.195 1.372 1.354 -0.000 -0.085 0.000 3/28800 330.0 1.158 1.328 1.311 -0.000 -0.082 0.000 3/28800 340.0 1.123 1.287 1.271 -0.000 -0.079 0.000 3/28800 350.0 1.090 1.248 1.234 -0.000 -0.077 0.000 3/28800 360.0 1.059 1.212 1.198 -0.000 -0.075 0.000 3/28800 370.0 1.030 1.177 1.165 -0.000 -0.072 0.000 3/28800 380.0 1.003 1.145 1.133 -0.000 -0.070 0.000 3/28800 390.0 0.976 1.114 1.103 -0.000 -0.068 0.000 3/28800 400.0 0.952 1.085 1.075 -0.000 -0.067 0.000 3/28800 410.0 0.928 1.058 1.048 -0.000 -0.065 0.000 3/28800 420.0 0.906 1.032 1.023 -0.000 -0.063 0.000 3/28800 430.0 0.884 1.007 0.998 -0.000 -0.062 0.000 3/28800 440.0 0.864 0.983 0.975 -0.000 -0.060 0.000 3/28800 450.0 0.845 0.961 0.953 -0.000 -0.059 0.000 3/28800 460.0 0.826 0.939 0.932 -0.000 -0.057 0.000 3/28800 470.0 0.808 0.919 0.912 -0.000 -0.056 0.000 3/28800 480.0 0.791 0.899 0.892 -0.000 -0.055 0.000 3/28800 490.0 0.775 0.880 0.874 -0.000 -0.054 0.000 3/28800 500.0 0.759 0.862 0.856 -0.000 -0.053 0.000 3/28800 510.0 0.744 0.845 0.839 -0.000 -0.052 0.000 3/28800 520.0 0.730 0.828 0.823 -0.000 -0.050 0.000 3/28800 530.0 0.716 0.812 0.807 -0.000 -0.049 0.000 3/28800 540.0 0.703 0.797 0.792 -0.000 -0.049 0.000 3/28800 550.0 0.690 0.782 0.777 -0.000 -0.048 0.000 3/28800 560.0 0.677 0.768 0.763 -0.000 -0.047 0.000 3/28800 570.0 0.665 0.754 0.750 -0.000 -0.046 0.000 3/28800 580.0 0.654 0.741 0.737 -0.000 -0.045 0.000 3/28800 590.0 0.643 0.728 0.724 -0.000 -0.044 0.000 3/28800 600.0 0.632 0.716 0.712 -0.000 -0.044 0.000 3/28800 610.0 0.622 0.704 0.700 -0.000 -0.043 0.000 3/28800 620.0 0.611 0.692 0.689 -0.000 -0.042 0.000 3/28800 630.0 0.602 0.681 0.678 -0.000 -0.041 0.000 3/28800 640.0 0.592 0.670 0.667 -0.000 -0.041 0.000 3/28800 650.0 0.583 0.660 0.657 -0.000 -0.040 0.000 3/28800 660.0 0.574 0.650 0.646 -0.000 -0.039 0.000 3/28800 670.0 0.566 0.640 0.637 -0.000 -0.039 0.000 3/28800 680.0 0.557 0.630 0.627 -0.000 -0.038 0.000 3/28800 690.0 0.549 0.621 0.618 -0.000 -0.038 0.000 3/28800 700.0 0.541 0.612 0.609 -0.000 -0.037 0.000 3/28800 710.0 0.534 0.603 0.601 -0.000 -0.037 0.000 3/28800 720.0 0.526 0.595 0.592 -0.000 -0.036 0.000 3/28800 730.0 0.519 0.586 0.584 -0.000 -0.036 0.000 3/28800 740.0 0.512 0.578 0.576 -0.000 -0.035 0.000 3/28800 750.0 0.505 0.571 0.568 -0.000 -0.035 0.000 3/28800 760.0 0.498 0.563 0.561 -0.000 -0.034 0.000 3/28800 770.0 0.492 0.556 0.554 -0.000 -0.034 0.000 3/28800 780.0 0.486 0.548 0.546 -0.000 -0.033 0.000 3/28800 790.0 0.479 0.541 0.539 -0.000 -0.033 0.000 3/28800 800.0 0.473 0.535 0.533 -0.000 -0.032 0.000 3/28800 810.0 0.468 0.528 0.526 -0.000 -0.032 0.000 3/28800 820.0 0.462 0.521 0.520 -0.000 -0.032 0.000 3/28800 830.0 0.456 0.515 0.513 -0.000 -0.031 0.000 3/28800 840.0 0.451 0.509 0.507 -0.000 -0.031 0.000 3/28800 850.0 0.446 0.503 0.501 -0.000 -0.030 0.000 3/28800 860.0 0.440 0.497 0.495 -0.000 -0.030 0.000 3/28800 870.0 0.435 0.491 0.490 -0.000 -0.030 0.000 3/28800 880.0 0.430 0.486 0.484 -0.000 -0.029 0.000 3/28800 890.0 0.425 0.480 0.479 -0.000 -0.029 0.000 3/28800 900.0 0.421 0.475 0.473 -0.000 -0.029 0.000 3/28800 910.0 0.416 0.469 0.468 -0.000 -0.028 0.000 3/28800 920.0 0.412 0.464 0.463 -0.000 -0.028 0.000 3/28800 930.0 0.407 0.459 0.458 -0.000 -0.028 0.000 3/28800 940.0 0.403 0.454 0.453 -0.000 -0.028 0.000 3/28800 950.0 0.399 0.450 0.448 -0.000 -0.027 0.000 3/28800 960.0 0.394 0.445 0.443 -0.000 -0.027 0.000 3/28800 970.0 0.390 0.440 0.439 -0.000 -0.027 0.000 3/28800 980.0 0.386 0.436 0.434 -0.000 -0.026 0.000 3/28800 990.0 0.382 0.431 0.430 -0.000 -0.026 0.000 3/28800 1000.0 0.379 0.427 0.426 -0.000 -0.026 0.000 3/28800 Thermal conductivity related properties were written into "kappa-m10104.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 04:00:41]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|