----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 21:12:33]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 8 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.382257870440537 0.000000000000000 0.000000000000000 b 0.000000000000000 8.970460010000000 0.000000000000000 c -1.114835328724217 0.000000000000000 5.224496866787394 Atomic positions (fractional): *1 Li 0.24773566657863 0.00120427193012 0.01188745696820 6.941 2 Li 0.24773566657863 0.49879572806988 0.51188745696820 6.941 3 Li 0.75226433342137 0.99879572806988 0.98811254303180 6.941 4 Li 0.75226433342137 0.50120427193012 0.48811254303180 6.941 *5 O 0.60258989676362 0.22097618162576 0.58276612507035 15.999 6 O 0.60258989676362 0.27902381837424 0.08276612507035 15.999 7 O 0.39741010323638 0.77902381837424 0.41723387492965 15.999 8 O 0.39741010323638 0.72097618162576 0.91723387492965 15.999 *9 O 0.62615816848380 0.49504518889136 0.75765390222892 15.999 10 O 0.37384183151620 0.99504518889136 0.74234609777108 15.999 11 O 0.37384183151620 0.50495481110864 0.24234609777108 15.999 12 O 0.62615816848380 0.00495481110864 0.25765390222892 15.999 *13 O 0.87100291161617 0.66783411896169 0.70027160932530 15.999 14 O 0.12899708838383 0.16783411896170 0.79972839067470 15.999 15 O 0.12899708838383 0.33216588103831 0.29972839067470 15.999 16 O 0.87100291161617 0.83216588103831 0.20027160932530 15.999 *17 O 0.11942616936823 0.49834830249986 0.78962752567433 15.999 18 O 0.88057383063177 0.99834830249986 0.71037247432567 15.999 19 O 0.88057383063177 0.50165169750014 0.21037247432567 15.999 20 O 0.11942616936823 0.00165169750014 0.28962752567433 15.999 *21 O 0.10920313880304 0.73728601629170 0.51880837166926 15.999 22 O 0.89079686119696 0.23728601629170 0.98119162833074 15.999 23 O 0.89079686119696 0.26271398370830 0.48119162833074 15.999 24 O 0.10920313880304 0.76271398370830 0.01880837166926 15.999 *25 O 0.37042270182583 0.33530500743908 0.72410147240229 15.999 26 O 0.62957729817417 0.83530500743908 0.77589852759771 15.999 27 O 0.62957729817417 0.66469499256092 0.27589852759771 15.999 28 O 0.37042270182583 0.16469499256092 0.22410147240229 15.999 *29 Si 0.55012121584250 0.33636355195356 0.78495615119873 28.085 30 Si 0.44987878415750 0.83636355195356 0.71504384880127 28.085 31 Si 0.44987878415750 0.66363644804644 0.21504384880127 28.085 32 Si 0.55012121584250 0.16363644804644 0.28495615119873 28.085 *33 Si 0.05016511906364 0.83664666437495 0.25947072627723 28.085 34 Si 0.94983488093636 0.33664666437495 0.24052927372277 28.085 35 Si 0.94983488093636 0.16335333562505 0.74052927372277 28.085 36 Si 0.05016511906364 0.66335333562505 0.75947072627723 28.085 *37 Sc 0.25078658609395 0.14403443968737 0.51382010144247 44.956 38 Sc 0.74921341390605 0.64403443968737 0.98617989855753 44.956 39 Sc 0.74921341390605 0.85596556031263 0.48617989855753 44.956 40 Sc 0.25078658609395 0.35596556031263 0.01382010144247 44.956 -------------------------------- unit cell --------------------------------- Lattice vectors: a 9.382257870440537 0.000000000000000 0.000000000000000 b 0.000000000000000 8.970460010000000 0.000000000000000 c -1.114835328724217 0.000000000000000 5.224496866787394 Atomic positions (fractional): *1 Li 0.24773566657863 0.00120427193012 0.01188745696820 6.941 > 1 2 Li 0.24773566657863 0.49879572806988 0.51188745696820 6.941 > 2 3 Li 0.75226433342137 0.99879572806988 0.98811254303180 6.941 > 3 4 Li 0.75226433342137 0.50120427193012 0.48811254303180 6.941 > 4 *5 O 0.60258989676362 0.22097618162576 0.58276612507035 15.999 > 5 6 O 0.60258989676362 0.27902381837424 0.08276612507035 15.999 > 6 7 O 0.39741010323638 0.77902381837424 0.41723387492965 15.999 > 7 8 O 0.39741010323638 0.72097618162576 0.91723387492965 15.999 > 8 *9 O 0.62615816848380 0.49504518889136 0.75765390222892 15.999 > 9 10 O 0.37384183151620 0.99504518889136 0.74234609777108 15.999 > 10 11 O 0.37384183151620 0.50495481110864 0.24234609777108 15.999 > 11 12 O 0.62615816848380 0.00495481110864 0.25765390222892 15.999 > 12 *13 O 0.87100291161617 0.66783411896169 0.70027160932530 15.999 > 13 14 O 0.12899708838383 0.16783411896170 0.79972839067470 15.999 > 14 15 O 0.12899708838383 0.33216588103831 0.29972839067470 15.999 > 15 16 O 0.87100291161617 0.83216588103831 0.20027160932530 15.999 > 16 *17 O 0.11942616936823 0.49834830249986 0.78962752567433 15.999 > 17 18 O 0.88057383063177 0.99834830249986 0.71037247432567 15.999 > 18 19 O 0.88057383063177 0.50165169750014 0.21037247432567 15.999 > 19 20 O 0.11942616936823 0.00165169750014 0.28962752567433 15.999 > 20 *21 O 0.10920313880304 0.73728601629170 0.51880837166926 15.999 > 21 22 O 0.89079686119696 0.23728601629170 0.98119162833074 15.999 > 22 23 O 0.89079686119696 0.26271398370830 0.48119162833074 15.999 > 23 24 O 0.10920313880304 0.76271398370830 0.01880837166926 15.999 > 24 *25 O 0.37042270182583 0.33530500743908 0.72410147240229 15.999 > 25 26 O 0.62957729817417 0.83530500743908 0.77589852759771 15.999 > 26 27 O 0.62957729817417 0.66469499256092 0.27589852759771 15.999 > 27 28 O 0.37042270182583 0.16469499256092 0.22410147240229 15.999 > 28 *29 Si 0.55012121584250 0.33636355195356 0.78495615119873 28.085 > 29 30 Si 0.44987878415750 0.83636355195356 0.71504384880127 28.085 > 30 31 Si 0.44987878415750 0.66363644804644 0.21504384880127 28.085 > 31 32 Si 0.55012121584250 0.16363644804644 0.28495615119873 28.085 > 32 *33 Si 0.05016511906364 0.83664666437495 0.25947072627723 28.085 > 33 34 Si 0.94983488093636 0.33664666437495 0.24052927372277 28.085 > 34 35 Si 0.94983488093636 0.16335333562505 0.74052927372277 28.085 > 35 36 Si 0.05016511906364 0.66335333562505 0.75947072627723 28.085 > 36 *37 Sc 0.25078658609395 0.14403443968737 0.51382010144247 44.956 > 37 38 Sc 0.74921341390605 0.64403443968737 0.98617989855753 44.956 > 38 39 Sc 0.74921341390605 0.85596556031263 0.48617989855753 44.956 > 39 40 Sc 0.25078658609395 0.35596556031263 0.01382010144247 44.956 > 40 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.382257870440537 0.000000000000000 0.000000000000000 b 0.000000000000000 8.970460010000000 0.000000000000000 c -2.229670657448434 0.000000000000000 10.448993733574788 Atomic positions (fractional): *1 Li 0.24773566657863 0.00120427193012 0.00594372848410 6.941 > 1 2 Li 0.24773566657863 0.00120427193012 0.50594372848410 6.941 > 1 3 Li 0.24773566657863 0.49879572806988 0.25594372848410 6.941 > 2 4 Li 0.24773566657863 0.49879572806988 0.75594372848410 6.941 > 2 5 Li 0.75226433342137 0.99879572806988 0.49405627151590 6.941 > 3 6 Li 0.75226433342137 0.99879572806988 0.99405627151590 6.941 > 3 7 Li 0.75226433342137 0.50120427193012 0.24405627151590 6.941 > 4 8 Li 0.75226433342137 0.50120427193012 0.74405627151590 6.941 > 4 *9 O 0.60258989676362 0.22097618162576 0.29138306253518 15.999 > 5 10 O 0.60258989676362 0.22097618162576 0.79138306253518 15.999 > 5 11 O 0.60258989676362 0.27902381837424 0.04138306253518 15.999 > 6 12 O 0.60258989676362 0.27902381837424 0.54138306253518 15.999 > 6 13 O 0.39741010323638 0.77902381837424 0.20861693746482 15.999 > 7 14 O 0.39741010323638 0.77902381837424 0.70861693746482 15.999 > 7 15 O 0.39741010323638 0.72097618162576 0.45861693746482 15.999 > 8 16 O 0.39741010323638 0.72097618162576 0.95861693746482 15.999 > 8 *17 O 0.62615816848380 0.49504518889136 0.37882695111446 15.999 > 9 18 O 0.62615816848380 0.49504518889136 0.87882695111446 15.999 > 9 19 O 0.37384183151620 0.99504518889136 0.37117304888554 15.999 > 10 20 O 0.37384183151620 0.99504518889136 0.87117304888554 15.999 > 10 21 O 0.37384183151620 0.50495481110864 0.12117304888554 15.999 > 11 22 O 0.37384183151620 0.50495481110864 0.62117304888554 15.999 > 11 23 O 0.62615816848380 0.00495481110864 0.12882695111446 15.999 > 12 24 O 0.62615816848380 0.00495481110864 0.62882695111446 15.999 > 12 *25 O 0.87100291161617 0.66783411896169 0.35013580466265 15.999 > 13 26 O 0.87100291161617 0.66783411896169 0.85013580466265 15.999 > 13 27 O 0.12899708838383 0.16783411896170 0.39986419533735 15.999 > 14 28 O 0.12899708838383 0.16783411896170 0.89986419533735 15.999 > 14 29 O 0.12899708838383 0.33216588103831 0.14986419533735 15.999 > 15 30 O 0.12899708838383 0.33216588103831 0.64986419533735 15.999 > 15 31 O 0.87100291161617 0.83216588103831 0.10013580466265 15.999 > 16 32 O 0.87100291161617 0.83216588103831 0.60013580466265 15.999 > 16 *33 O 0.11942616936823 0.49834830249986 0.39481376283716 15.999 > 17 34 O 0.11942616936823 0.49834830249986 0.89481376283716 15.999 > 17 35 O 0.88057383063177 0.99834830249986 0.35518623716284 15.999 > 18 36 O 0.88057383063177 0.99834830249986 0.85518623716284 15.999 > 18 37 O 0.88057383063177 0.50165169750014 0.10518623716284 15.999 > 19 38 O 0.88057383063177 0.50165169750014 0.60518623716284 15.999 > 19 39 O 0.11942616936823 0.00165169750014 0.14481376283716 15.999 > 20 40 O 0.11942616936823 0.00165169750014 0.64481376283716 15.999 > 20 *41 O 0.10920313880304 0.73728601629170 0.25940418583463 15.999 > 21 42 O 0.10920313880304 0.73728601629170 0.75940418583463 15.999 > 21 43 O 0.89079686119696 0.23728601629170 0.49059581416537 15.999 > 22 44 O 0.89079686119696 0.23728601629170 0.99059581416537 15.999 > 22 45 O 0.89079686119696 0.26271398370830 0.24059581416537 15.999 > 23 46 O 0.89079686119696 0.26271398370830 0.74059581416537 15.999 > 23 47 O 0.10920313880304 0.76271398370830 0.00940418583463 15.999 > 24 48 O 0.10920313880304 0.76271398370830 0.50940418583463 15.999 > 24 *49 O 0.37042270182583 0.33530500743908 0.36205073620114 15.999 > 25 50 O 0.37042270182583 0.33530500743908 0.86205073620114 15.999 > 25 51 O 0.62957729817417 0.83530500743908 0.38794926379886 15.999 > 26 52 O 0.62957729817417 0.83530500743908 0.88794926379886 15.999 > 26 53 O 0.62957729817417 0.66469499256092 0.13794926379886 15.999 > 27 54 O 0.62957729817417 0.66469499256092 0.63794926379886 15.999 > 27 55 O 0.37042270182583 0.16469499256092 0.11205073620114 15.999 > 28 56 O 0.37042270182583 0.16469499256092 0.61205073620114 15.999 > 28 *57 Si 0.55012121584250 0.33636355195356 0.39247807559937 28.085 > 29 58 Si 0.55012121584250 0.33636355195356 0.89247807559937 28.085 > 29 59 Si 0.44987878415750 0.83636355195356 0.35752192440063 28.085 > 30 60 Si 0.44987878415750 0.83636355195356 0.85752192440063 28.085 > 30 61 Si 0.44987878415750 0.66363644804644 0.10752192440063 28.085 > 31 62 Si 0.44987878415750 0.66363644804644 0.60752192440063 28.085 > 31 63 Si 0.55012121584250 0.16363644804644 0.14247807559937 28.085 > 32 64 Si 0.55012121584250 0.16363644804644 0.64247807559937 28.085 > 32 *65 Si 0.05016511906364 0.83664666437495 0.12973536313861 28.085 > 33 66 Si 0.05016511906364 0.83664666437495 0.62973536313861 28.085 > 33 67 Si 0.94983488093636 0.33664666437495 0.12026463686139 28.085 > 34 68 Si 0.94983488093636 0.33664666437495 0.62026463686139 28.085 > 34 69 Si 0.94983488093636 0.16335333562505 0.37026463686139 28.085 > 35 70 Si 0.94983488093636 0.16335333562505 0.87026463686139 28.085 > 35 71 Si 0.05016511906364 0.66335333562505 0.37973536313861 28.085 > 36 72 Si 0.05016511906364 0.66335333562505 0.87973536313861 28.085 > 36 *73 Sc 0.25078658609395 0.14403443968737 0.25691005072123 44.956 > 37 74 Sc 0.25078658609395 0.14403443968737 0.75691005072123 44.956 > 37 75 Sc 0.74921341390605 0.64403443968737 0.49308994927877 44.956 > 38 76 Sc 0.74921341390605 0.64403443968737 0.99308994927877 44.956 > 38 77 Sc 0.74921341390605 0.85596556031263 0.24308994927877 44.956 > 39 78 Sc 0.74921341390605 0.85596556031263 0.74308994927877 44.956 > 39 79 Sc 0.25078658609395 0.35596556031263 0.00691005072123 44.956 > 40 80 Sc 0.25078658609395 0.35596556031263 0.50691005072123 44.956 > 40 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.1840429 0.0000000 0.0265059 0.0000000 3.2128735 0.0000000 0.0265053 0.0000000 3.2005976 -------------------------- Born effective charges -------------------------- 1 Li 1.0532778 0.0313634 -0.0732680 0.0225852 1.1053988 -0.0087997 -0.1048998 -0.0182784 1.1474022 2 Li 1.0532778 -0.0313634 -0.0732680 -0.0225852 1.1053988 0.0087997 -0.1048998 0.0182784 1.1474022 3 Li 1.0532778 0.0313634 -0.0732680 0.0225852 1.1053988 -0.0087997 -0.1048998 -0.0182784 1.1474022 4 Li 1.0532778 -0.0313634 -0.0732680 -0.0225852 1.1053988 0.0087997 -0.1048998 0.0182784 1.1474022 5 O -1.4777222 0.1910071 0.1815536 0.2033498 -1.6585831 -0.7193038 0.2218244 -0.7628234 -2.3383611 6 O -1.4777222 -0.1910071 0.1815536 -0.2033498 -1.6585831 0.7193038 0.2218244 0.7628234 -2.3383611 7 O -1.4777222 0.1910071 0.1815536 0.2033498 -1.6585831 -0.7193038 0.2218244 -0.7628234 -2.3383611 8 O -1.4777222 -0.1910071 0.1815536 -0.2033498 -1.6585831 0.7193038 0.2218244 0.7628234 -2.3383611 9 O -1.7482837 -0.8795114 -0.2721179 -0.8047811 -2.4706588 -0.4331235 -0.2227491 -0.4842929 -1.6460122 10 O -1.7482837 0.8795114 -0.2721179 0.8047811 -2.4706588 0.4331235 -0.2227491 0.4842929 -1.6460122 11 O -1.7482837 -0.8795114 -0.2721179 -0.8047811 -2.4706588 -0.4331235 -0.2227491 -0.4842929 -1.6460122 12 O -1.7482837 0.8795114 -0.2721179 0.8047811 -2.4706588 0.4331235 -0.2227491 0.4842929 -1.6460122 13 O -2.5471087 0.2013726 0.1373294 0.1347355 -1.6378115 0.3717626 0.0670691 0.3377104 -1.9185152 14 O -2.5471087 -0.2013726 0.1373294 -0.1347355 -1.6378115 -0.3717626 0.0670691 -0.3377104 -1.9185152 15 O -2.5471087 0.2013726 0.1373294 0.1347355 -1.6378115 0.3717626 0.0670691 0.3377104 -1.9185152 16 O -2.5471087 -0.2013726 0.1373294 -0.1347355 -1.6378115 -0.3717626 0.0670691 -0.3377104 -1.9185152 17 O -1.7485939 0.8714151 -0.3886854 0.7913107 -2.5230320 0.6027941 -0.3048044 0.5356390 -1.6809761 18 O -1.7485939 -0.8714151 -0.3886854 -0.7913107 -2.5230320 -0.6027941 -0.3048044 -0.5356390 -1.6809761 19 O -1.7485939 0.8714151 -0.3886854 0.7913107 -2.5230320 0.6027941 -0.3048044 0.5356390 -1.6809761 20 O -1.7485939 -0.8714151 -0.3886854 -0.7913107 -2.5230320 -0.6027941 -0.3048044 -0.5356390 -1.6809761 21 O -1.4872799 -0.0709663 0.1831532 -0.1124884 -1.6868769 0.7579401 0.2556082 0.7718800 -2.3299893 22 O -1.4872799 0.0709663 0.1831532 0.1124884 -1.6868769 -0.7579401 0.2556082 -0.7718800 -2.3299893 23 O -1.4872799 -0.0709663 0.1831532 -0.1124884 -1.6868769 0.7579401 0.2556082 0.7718800 -2.3299893 24 O -1.4872799 0.0709663 0.1831532 0.1124884 -1.6868769 -0.7579401 0.2556082 -0.7718800 -2.3299893 25 O -2.5627253 -0.1737939 0.1459075 -0.1091760 -1.6230254 -0.3319792 0.0587343 -0.3647444 -1.9083103 26 O -2.5627253 0.1737939 0.1459075 0.1091760 -1.6230254 0.3319792 0.0587343 0.3647444 -1.9083103 27 O -2.5627253 -0.1737939 0.1459075 -0.1091760 -1.6230254 -0.3319792 0.0587343 -0.3647444 -1.9083103 28 O -2.5627253 0.1737939 0.1459075 0.1091760 -1.6230254 0.3319792 0.0587343 0.3647444 -1.9083103 29 Si 3.5039215 0.4838020 -0.0774479 0.4103604 3.3309374 -0.1235603 -0.0721125 0.3974507 3.3823442 30 Si 3.5039215 -0.4838020 -0.0774479 -0.4103604 3.3309374 0.1235603 -0.0721125 -0.3974507 3.3823442 31 Si 3.5039215 0.4838020 -0.0774479 0.4103604 3.3309374 -0.1235603 -0.0721125 0.3974507 3.3823442 32 Si 3.5039215 -0.4838020 -0.0774479 -0.4103604 3.3309374 0.1235603 -0.0721125 -0.3974507 3.3823442 33 Si 3.4961474 0.5716715 0.0182684 0.3210305 3.4219378 0.0322782 -0.0724797 0.1484332 3.4264613 34 Si 3.4961474 -0.5716715 0.0182684 -0.3210305 3.4219378 -0.0322782 -0.0724797 -0.1484332 3.4264613 35 Si 3.4961474 0.5716715 0.0182684 0.3210305 3.4219378 0.0322782 -0.0724797 0.1484332 3.4264613 36 Si 3.4961474 -0.5716715 0.0182684 -0.3210305 3.4219378 -0.0322782 -0.0724797 -0.1484332 3.4264613 37 Sc 3.5183670 -0.0098421 0.1453070 0.0505074 3.7417138 0.0178997 0.1738094 0.0108599 3.8659565 38 Sc 3.5183670 0.0098421 0.1453070 -0.0505074 3.7417138 -0.0178997 0.1738094 -0.0108599 3.8659565 39 Sc 3.5183670 -0.0098421 0.1453070 0.0505074 3.7417138 0.0178997 0.1738094 0.0108599 3.8659565 40 Sc 3.5183670 0.0098421 0.1453070 -0.0505074 3.7417138 -0.0178997 0.1738094 -0.0108599 3.8659565 ---------------------------------------------------------------------------- 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: 240/240 Permutation basis: 14520/14520 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3690 Number of blocks in projector: 3690 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: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 282 eigenvectors found. (1) Complementary block size: 38 (1) Compute compressed projector. (1) Use standard solver. (1) 18 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 282 eigenvectors found. (1) Complementary block size: 38 (1) Compute compressed projector. (1) Use standard solver. (1) 18 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 800 / 800 (1) 287 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 430 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 430 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 430 Use standard eigh solver. Tree of FC basis block matrices: - (3690, 3601), data: False |-- (430, 420), data: True |-- (430, 420), data: True |-- (430, 420), data: True |-- (800, 781), data: False |-- (800, 13), data: (800, 32) @ (32, 13) |-- (300, 287), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True |-- (800, 780), data: False |-- (800, 18), data: (800, 38) @ (38, 18) |-- (300, 282), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True |-- (800, 780), data: False |-- (800, 18), data: (800, 38) @ (38, 18) |-- (300, 282), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 1200 - Time: 0.810 Solver_block: 200 / 1200 - Time: 0.621 Solver_block: 300 / 1200 - Time: 1.583 Solver_block: 400 / 1200 - Time: 1.620 Solver_block: 500 / 1200 - Time: 1.330 Solver_block: 600 / 1200 - Time: 1.265 Solver_block: 700 / 1200 - Time: 0.643 Solver_block: 800 / 1200 - Time: 0.837 Solver_block: 900 / 1200 - Time: 1.011 Solver_block: 1000 / 1200 - Time: 0.957 Solver_block: 1100 / 1200 - Time: 0.828 Solver_block: 1200 / 1200 - Time: 1.235 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 13.430 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 240/240 Permutation basis: 14520/14520 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3690 Number of blocks in projector: 3690 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: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 282 eigenvectors found. (1) Complementary block size: 38 (1) Compute compressed projector. (1) Use standard solver. (1) 18 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 282 eigenvectors found. (1) Complementary block size: 38 (1) Compute compressed projector. (1) Use standard solver. (1) 18 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 800 / 800 (1) 287 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 430 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 430 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 430 Use standard eigh solver. Tree of FC basis block matrices: - (3690, 3601), data: False |-- (430, 420), data: True |-- (430, 420), data: True |-- (430, 420), data: True |-- (800, 781), data: False |-- (800, 13), data: (800, 32) @ (32, 13) |-- (300, 287), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True |-- (800, 780), data: False |-- (800, 18), data: (800, 38) @ (38, 18) |-- (300, 282), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True |-- (800, 780), data: False |-- (800, 18), data: (800, 38) @ (38, 18) |-- (300, 282), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True Max drift after symmetrization by symfc projector: -0.00000000 (zz) -0.00000000 (zz) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 21:13:50]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 21:13:51]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.382257870440537 0.000000000000000 0.000000000000000 b 0.000000000000000 8.970460010000000 0.000000000000000 c -1.114835328724217 0.000000000000000 5.224496866787394 Atomic positions (fractional): 1 Li 0.24773566657863 0.00120427193012 0.01188745696820 6.941 2 Li 0.24773566657863 0.49879572806988 0.51188745696820 6.941 3 Li 0.75226433342137 0.99879572806988 0.98811254303180 6.941 4 Li 0.75226433342137 0.50120427193012 0.48811254303180 6.941 5 O 0.60258989676362 0.22097618162576 0.58276612507035 15.999 6 O 0.60258989676362 0.27902381837424 0.08276612507035 15.999 7 O 0.39741010323638 0.77902381837424 0.41723387492965 15.999 8 O 0.39741010323638 0.72097618162576 0.91723387492965 15.999 9 O 0.62615816848380 0.49504518889136 0.75765390222892 15.999 10 O 0.37384183151620 0.99504518889136 0.74234609777108 15.999 11 O 0.37384183151620 0.50495481110864 0.24234609777108 15.999 12 O 0.62615816848380 0.00495481110864 0.25765390222892 15.999 13 O 0.87100291161617 0.66783411896169 0.70027160932530 15.999 14 O 0.12899708838383 0.16783411896170 0.79972839067470 15.999 15 O 0.12899708838383 0.33216588103831 0.29972839067470 15.999 16 O 0.87100291161617 0.83216588103831 0.20027160932530 15.999 17 O 0.11942616936823 0.49834830249986 0.78962752567433 15.999 18 O 0.88057383063177 0.99834830249986 0.71037247432567 15.999 19 O 0.88057383063177 0.50165169750014 0.21037247432567 15.999 20 O 0.11942616936823 0.00165169750014 0.28962752567433 15.999 21 O 0.10920313880304 0.73728601629170 0.51880837166926 15.999 22 O 0.89079686119696 0.23728601629170 0.98119162833074 15.999 23 O 0.89079686119696 0.26271398370830 0.48119162833074 15.999 24 O 0.10920313880304 0.76271398370830 0.01880837166926 15.999 25 O 0.37042270182583 0.33530500743908 0.72410147240229 15.999 26 O 0.62957729817417 0.83530500743908 0.77589852759771 15.999 27 O 0.62957729817417 0.66469499256092 0.27589852759771 15.999 28 O 0.37042270182583 0.16469499256092 0.22410147240229 15.999 29 Si 0.55012121584250 0.33636355195356 0.78495615119873 28.085 30 Si 0.44987878415750 0.83636355195356 0.71504384880127 28.085 31 Si 0.44987878415750 0.66363644804644 0.21504384880127 28.085 32 Si 0.55012121584250 0.16363644804644 0.28495615119873 28.085 33 Si 0.05016511906364 0.83664666437495 0.25947072627723 28.085 34 Si 0.94983488093636 0.33664666437495 0.24052927372277 28.085 35 Si 0.94983488093636 0.16335333562505 0.74052927372277 28.085 36 Si 0.05016511906364 0.66335333562505 0.75947072627723 28.085 37 Sc 0.25078658609395 0.14403443968737 0.51382010144247 44.956 38 Sc 0.74921341390605 0.64403443968737 0.98617989855753 44.956 39 Sc 0.74921341390605 0.85596556031263 0.48617989855753 44.956 40 Sc 0.25078658609395 0.35596556031263 0.01382010144247 44.956 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.382257870440537 0.000000000000000 0.000000000000000 b 0.000000000000000 8.970460010000000 0.000000000000000 c -2.229670657448434 0.000000000000000 10.448993733574788 Atomic positions (fractional): 1 Li 0.24773566657863 0.00120427193012 0.00594372848410 6.941 > 1 2 Li 0.24773566657863 0.00120427193012 0.50594372848410 6.941 > 1 3 Li 0.24773566657863 0.49879572806988 0.25594372848410 6.941 > 3 4 Li 0.24773566657863 0.49879572806988 0.75594372848410 6.941 > 3 5 Li 0.75226433342137 0.99879572806988 0.49405627151590 6.941 > 5 6 Li 0.75226433342137 0.99879572806988 0.99405627151590 6.941 > 5 7 Li 0.75226433342137 0.50120427193012 0.24405627151590 6.941 > 7 8 Li 0.75226433342137 0.50120427193012 0.74405627151590 6.941 > 7 9 O 0.60258989676362 0.22097618162576 0.29138306253518 15.999 > 9 10 O 0.60258989676362 0.22097618162576 0.79138306253518 15.999 > 9 11 O 0.60258989676362 0.27902381837424 0.04138306253518 15.999 > 11 12 O 0.60258989676362 0.27902381837424 0.54138306253518 15.999 > 11 13 O 0.39741010323638 0.77902381837424 0.20861693746482 15.999 > 13 14 O 0.39741010323638 0.77902381837424 0.70861693746482 15.999 > 13 15 O 0.39741010323638 0.72097618162576 0.45861693746482 15.999 > 15 16 O 0.39741010323638 0.72097618162576 0.95861693746482 15.999 > 15 17 O 0.62615816848380 0.49504518889136 0.37882695111446 15.999 > 17 18 O 0.62615816848380 0.49504518889136 0.87882695111446 15.999 > 17 19 O 0.37384183151620 0.99504518889136 0.37117304888554 15.999 > 19 20 O 0.37384183151620 0.99504518889136 0.87117304888554 15.999 > 19 21 O 0.37384183151620 0.50495481110864 0.12117304888554 15.999 > 21 22 O 0.37384183151620 0.50495481110864 0.62117304888554 15.999 > 21 23 O 0.62615816848380 0.00495481110864 0.12882695111446 15.999 > 23 24 O 0.62615816848380 0.00495481110864 0.62882695111446 15.999 > 23 25 O 0.87100291161617 0.66783411896169 0.35013580466265 15.999 > 25 26 O 0.87100291161617 0.66783411896169 0.85013580466265 15.999 > 25 27 O 0.12899708838383 0.16783411896170 0.39986419533735 15.999 > 27 28 O 0.12899708838383 0.16783411896170 0.89986419533735 15.999 > 27 29 O 0.12899708838383 0.33216588103831 0.14986419533735 15.999 > 29 30 O 0.12899708838383 0.33216588103831 0.64986419533735 15.999 > 29 31 O 0.87100291161617 0.83216588103831 0.10013580466265 15.999 > 31 32 O 0.87100291161617 0.83216588103831 0.60013580466265 15.999 > 31 33 O 0.11942616936823 0.49834830249986 0.39481376283716 15.999 > 33 34 O 0.11942616936823 0.49834830249986 0.89481376283716 15.999 > 33 35 O 0.88057383063177 0.99834830249986 0.35518623716284 15.999 > 35 36 O 0.88057383063177 0.99834830249986 0.85518623716284 15.999 > 35 37 O 0.88057383063177 0.50165169750014 0.10518623716284 15.999 > 37 38 O 0.88057383063177 0.50165169750014 0.60518623716284 15.999 > 37 39 O 0.11942616936823 0.00165169750014 0.14481376283716 15.999 > 39 40 O 0.11942616936823 0.00165169750014 0.64481376283716 15.999 > 39 41 O 0.10920313880304 0.73728601629170 0.25940418583463 15.999 > 41 42 O 0.10920313880304 0.73728601629170 0.75940418583463 15.999 > 41 43 O 0.89079686119696 0.23728601629170 0.49059581416537 15.999 > 43 44 O 0.89079686119696 0.23728601629170 0.99059581416537 15.999 > 43 45 O 0.89079686119696 0.26271398370830 0.24059581416537 15.999 > 45 46 O 0.89079686119696 0.26271398370830 0.74059581416537 15.999 > 45 47 O 0.10920313880304 0.76271398370830 0.00940418583463 15.999 > 47 48 O 0.10920313880304 0.76271398370830 0.50940418583463 15.999 > 47 49 O 0.37042270182583 0.33530500743908 0.36205073620114 15.999 > 49 50 O 0.37042270182583 0.33530500743908 0.86205073620114 15.999 > 49 51 O 0.62957729817417 0.83530500743908 0.38794926379886 15.999 > 51 52 O 0.62957729817417 0.83530500743908 0.88794926379886 15.999 > 51 53 O 0.62957729817417 0.66469499256092 0.13794926379886 15.999 > 53 54 O 0.62957729817417 0.66469499256092 0.63794926379886 15.999 > 53 55 O 0.37042270182583 0.16469499256092 0.11205073620114 15.999 > 55 56 O 0.37042270182583 0.16469499256092 0.61205073620114 15.999 > 55 57 Si 0.55012121584250 0.33636355195356 0.39247807559937 28.085 > 57 58 Si 0.55012121584250 0.33636355195356 0.89247807559937 28.085 > 57 59 Si 0.44987878415750 0.83636355195356 0.35752192440063 28.085 > 59 60 Si 0.44987878415750 0.83636355195356 0.85752192440063 28.085 > 59 61 Si 0.44987878415750 0.66363644804644 0.10752192440063 28.085 > 61 62 Si 0.44987878415750 0.66363644804644 0.60752192440063 28.085 > 61 63 Si 0.55012121584250 0.16363644804644 0.14247807559937 28.085 > 63 64 Si 0.55012121584250 0.16363644804644 0.64247807559937 28.085 > 63 65 Si 0.05016511906364 0.83664666437495 0.12973536313861 28.085 > 65 66 Si 0.05016511906364 0.83664666437495 0.62973536313861 28.085 > 65 67 Si 0.94983488093636 0.33664666437495 0.12026463686139 28.085 > 67 68 Si 0.94983488093636 0.33664666437495 0.62026463686139 28.085 > 67 69 Si 0.94983488093636 0.16335333562505 0.37026463686139 28.085 > 69 70 Si 0.94983488093636 0.16335333562505 0.87026463686139 28.085 > 69 71 Si 0.05016511906364 0.66335333562505 0.37973536313861 28.085 > 71 72 Si 0.05016511906364 0.66335333562505 0.87973536313861 28.085 > 71 73 Sc 0.25078658609395 0.14403443968737 0.25691005072123 44.956 > 73 74 Sc 0.25078658609395 0.14403443968737 0.75691005072123 44.956 > 73 75 Sc 0.74921341390605 0.64403443968737 0.49308994927877 44.956 > 75 76 Sc 0.74921341390605 0.64403443968737 0.99308994927877 44.956 > 75 77 Sc 0.74921341390605 0.85596556031263 0.24308994927877 44.956 > 77 78 Sc 0.74921341390605 0.85596556031263 0.74308994927877 44.956 > 77 79 Sc 0.25078658609395 0.35596556031263 0.00691005072123 44.956 > 79 80 Sc 0.25078658609395 0.35596556031263 0.50691005072123 44.956 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.1840429 0.0000000 0.0265059 0.0000000 3.2128735 0.0000000 0.0265053 0.0000000 3.2005976 -------------------------- Born effective charges -------------------------- 1 Li 1.0532778 0.0313634 -0.0732680 0.0225852 1.1053988 -0.0087997 -0.1048998 -0.0182784 1.1474022 2 Li 1.0532778 -0.0313634 -0.0732680 -0.0225852 1.1053988 0.0087997 -0.1048998 0.0182784 1.1474022 3 Li 1.0532778 0.0313634 -0.0732680 0.0225852 1.1053988 -0.0087997 -0.1048998 -0.0182784 1.1474022 4 Li 1.0532778 -0.0313634 -0.0732680 -0.0225852 1.1053988 0.0087997 -0.1048998 0.0182784 1.1474022 5 O -1.4777222 0.1910071 0.1815536 0.2033498 -1.6585831 -0.7193038 0.2218244 -0.7628234 -2.3383611 6 O -1.4777222 -0.1910071 0.1815536 -0.2033498 -1.6585831 0.7193038 0.2218244 0.7628234 -2.3383611 7 O -1.4777222 0.1910071 0.1815536 0.2033498 -1.6585831 -0.7193038 0.2218244 -0.7628234 -2.3383611 8 O -1.4777222 -0.1910071 0.1815536 -0.2033498 -1.6585831 0.7193038 0.2218244 0.7628234 -2.3383611 9 O -1.7482837 -0.8795114 -0.2721179 -0.8047811 -2.4706588 -0.4331235 -0.2227491 -0.4842929 -1.6460122 10 O -1.7482837 0.8795114 -0.2721179 0.8047811 -2.4706588 0.4331235 -0.2227491 0.4842929 -1.6460122 11 O -1.7482837 -0.8795114 -0.2721179 -0.8047811 -2.4706588 -0.4331235 -0.2227491 -0.4842929 -1.6460122 12 O -1.7482837 0.8795114 -0.2721179 0.8047811 -2.4706588 0.4331235 -0.2227491 0.4842929 -1.6460122 13 O -2.5471087 0.2013726 0.1373294 0.1347355 -1.6378115 0.3717626 0.0670691 0.3377104 -1.9185152 14 O -2.5471087 -0.2013726 0.1373294 -0.1347355 -1.6378115 -0.3717626 0.0670691 -0.3377104 -1.9185152 15 O -2.5471087 0.2013726 0.1373294 0.1347355 -1.6378115 0.3717626 0.0670691 0.3377104 -1.9185152 16 O -2.5471087 -0.2013726 0.1373294 -0.1347355 -1.6378115 -0.3717626 0.0670691 -0.3377104 -1.9185152 17 O -1.7485939 0.8714151 -0.3886854 0.7913107 -2.5230320 0.6027941 -0.3048044 0.5356390 -1.6809761 18 O -1.7485939 -0.8714151 -0.3886854 -0.7913107 -2.5230320 -0.6027941 -0.3048044 -0.5356390 -1.6809761 19 O -1.7485939 0.8714151 -0.3886854 0.7913107 -2.5230320 0.6027941 -0.3048044 0.5356390 -1.6809761 20 O -1.7485939 -0.8714151 -0.3886854 -0.7913107 -2.5230320 -0.6027941 -0.3048044 -0.5356390 -1.6809761 21 O -1.4872799 -0.0709663 0.1831532 -0.1124884 -1.6868769 0.7579401 0.2556082 0.7718800 -2.3299893 22 O -1.4872799 0.0709663 0.1831532 0.1124884 -1.6868769 -0.7579401 0.2556082 -0.7718800 -2.3299893 23 O -1.4872799 -0.0709663 0.1831532 -0.1124884 -1.6868769 0.7579401 0.2556082 0.7718800 -2.3299893 24 O -1.4872799 0.0709663 0.1831532 0.1124884 -1.6868769 -0.7579401 0.2556082 -0.7718800 -2.3299893 25 O -2.5627253 -0.1737939 0.1459075 -0.1091760 -1.6230254 -0.3319792 0.0587343 -0.3647444 -1.9083103 26 O -2.5627253 0.1737939 0.1459075 0.1091760 -1.6230254 0.3319792 0.0587343 0.3647444 -1.9083103 27 O -2.5627253 -0.1737939 0.1459075 -0.1091760 -1.6230254 -0.3319792 0.0587343 -0.3647444 -1.9083103 28 O -2.5627253 0.1737939 0.1459075 0.1091760 -1.6230254 0.3319792 0.0587343 0.3647444 -1.9083103 29 Si 3.5039215 0.4838020 -0.0774479 0.4103604 3.3309374 -0.1235603 -0.0721125 0.3974507 3.3823442 30 Si 3.5039215 -0.4838020 -0.0774479 -0.4103604 3.3309374 0.1235603 -0.0721125 -0.3974507 3.3823442 31 Si 3.5039215 0.4838020 -0.0774479 0.4103604 3.3309374 -0.1235603 -0.0721125 0.3974507 3.3823442 32 Si 3.5039215 -0.4838020 -0.0774479 -0.4103604 3.3309374 0.1235603 -0.0721125 -0.3974507 3.3823442 33 Si 3.4961474 0.5716715 0.0182684 0.3210305 3.4219378 0.0322782 -0.0724797 0.1484332 3.4264613 34 Si 3.4961474 -0.5716715 0.0182684 -0.3210305 3.4219378 -0.0322782 -0.0724797 -0.1484332 3.4264613 35 Si 3.4961474 0.5716715 0.0182684 0.3210305 3.4219378 0.0322782 -0.0724797 0.1484332 3.4264613 36 Si 3.4961474 -0.5716715 0.0182684 -0.3210305 3.4219378 -0.0322782 -0.0724797 -0.1484332 3.4264613 37 Sc 3.5183670 -0.0098421 0.1453070 0.0505074 3.7417138 0.0178997 0.1738094 0.0108599 3.8659565 38 Sc 3.5183670 0.0098421 0.1453070 -0.0505074 3.7417138 -0.0178997 0.1738094 -0.0108599 3.8659565 39 Sc 3.5183670 -0.0098421 0.1453070 0.0505074 3.7417138 0.0178997 0.1738094 0.0108599 3.8659565 40 Sc 3.5183670 0.0098421 0.1453070 -0.0505074 3.7417138 -0.0178997 0.1738094 -0.0108599 3.8659565 ---------------------------------------------------------------------------- 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] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] 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] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] Computing fc3[ 41, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] 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] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] Computing fc3[ 57, 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] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] 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] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] 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] [-0.0021 0.0000 0.0098] [ 0.0021 0.0000 -0.0098] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000001 (xxx) -0.00000001 (xxx) -0.00000001 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xz) 0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 21:14:18]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 21:14:18]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 9.382257870440537 0.000000000000000 0.000000000000000 b 0.000000000000000 8.970460010000000 0.000000000000000 c -1.114835328724217 0.000000000000000 5.224496866787394 Atomic positions (fractional): 1 Li 0.24773566657863 0.00120427193012 0.01188745696820 6.941 2 Li 0.24773566657863 0.49879572806988 0.51188745696820 6.941 3 Li 0.75226433342137 0.99879572806988 0.98811254303180 6.941 4 Li 0.75226433342137 0.50120427193012 0.48811254303180 6.941 5 O 0.60258989676362 0.22097618162576 0.58276612507035 15.999 6 O 0.60258989676362 0.27902381837424 0.08276612507035 15.999 7 O 0.39741010323638 0.77902381837424 0.41723387492965 15.999 8 O 0.39741010323638 0.72097618162576 0.91723387492965 15.999 9 O 0.62615816848380 0.49504518889136 0.75765390222892 15.999 10 O 0.37384183151620 0.99504518889136 0.74234609777108 15.999 11 O 0.37384183151620 0.50495481110864 0.24234609777108 15.999 12 O 0.62615816848380 0.00495481110864 0.25765390222892 15.999 13 O 0.87100291161617 0.66783411896169 0.70027160932530 15.999 14 O 0.12899708838383 0.16783411896170 0.79972839067470 15.999 15 O 0.12899708838383 0.33216588103831 0.29972839067470 15.999 16 O 0.87100291161617 0.83216588103831 0.20027160932530 15.999 17 O 0.11942616936823 0.49834830249986 0.78962752567433 15.999 18 O 0.88057383063177 0.99834830249986 0.71037247432567 15.999 19 O 0.88057383063177 0.50165169750014 0.21037247432567 15.999 20 O 0.11942616936823 0.00165169750014 0.28962752567433 15.999 21 O 0.10920313880304 0.73728601629170 0.51880837166926 15.999 22 O 0.89079686119696 0.23728601629170 0.98119162833074 15.999 23 O 0.89079686119696 0.26271398370830 0.48119162833074 15.999 24 O 0.10920313880304 0.76271398370830 0.01880837166926 15.999 25 O 0.37042270182583 0.33530500743908 0.72410147240229 15.999 26 O 0.62957729817417 0.83530500743908 0.77589852759771 15.999 27 O 0.62957729817417 0.66469499256092 0.27589852759771 15.999 28 O 0.37042270182583 0.16469499256092 0.22410147240229 15.999 29 Si 0.55012121584250 0.33636355195356 0.78495615119873 28.085 30 Si 0.44987878415750 0.83636355195356 0.71504384880127 28.085 31 Si 0.44987878415750 0.66363644804644 0.21504384880127 28.085 32 Si 0.55012121584250 0.16363644804644 0.28495615119873 28.085 33 Si 0.05016511906364 0.83664666437495 0.25947072627723 28.085 34 Si 0.94983488093636 0.33664666437495 0.24052927372277 28.085 35 Si 0.94983488093636 0.16335333562505 0.74052927372277 28.085 36 Si 0.05016511906364 0.66335333562505 0.75947072627723 28.085 37 Sc 0.25078658609395 0.14403443968737 0.51382010144247 44.956 38 Sc 0.74921341390605 0.64403443968737 0.98617989855753 44.956 39 Sc 0.74921341390605 0.85596556031263 0.48617989855753 44.956 40 Sc 0.25078658609395 0.35596556031263 0.01382010144247 44.956 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.382257870440537 0.000000000000000 0.000000000000000 b 0.000000000000000 8.970460010000000 0.000000000000000 c -2.229670657448434 0.000000000000000 10.448993733574788 Atomic positions (fractional): 1 Li 0.24773566657863 0.00120427193012 0.00594372848410 6.941 > 1 2 Li 0.24773566657863 0.00120427193012 0.50594372848410 6.941 > 1 3 Li 0.24773566657863 0.49879572806988 0.25594372848410 6.941 > 3 4 Li 0.24773566657863 0.49879572806988 0.75594372848410 6.941 > 3 5 Li 0.75226433342137 0.99879572806988 0.49405627151590 6.941 > 5 6 Li 0.75226433342137 0.99879572806988 0.99405627151590 6.941 > 5 7 Li 0.75226433342137 0.50120427193012 0.24405627151590 6.941 > 7 8 Li 0.75226433342137 0.50120427193012 0.74405627151590 6.941 > 7 9 O 0.60258989676362 0.22097618162576 0.29138306253518 15.999 > 9 10 O 0.60258989676362 0.22097618162576 0.79138306253518 15.999 > 9 11 O 0.60258989676362 0.27902381837424 0.04138306253518 15.999 > 11 12 O 0.60258989676362 0.27902381837424 0.54138306253518 15.999 > 11 13 O 0.39741010323638 0.77902381837424 0.20861693746482 15.999 > 13 14 O 0.39741010323638 0.77902381837424 0.70861693746482 15.999 > 13 15 O 0.39741010323638 0.72097618162576 0.45861693746482 15.999 > 15 16 O 0.39741010323638 0.72097618162576 0.95861693746482 15.999 > 15 17 O 0.62615816848380 0.49504518889136 0.37882695111446 15.999 > 17 18 O 0.62615816848380 0.49504518889136 0.87882695111446 15.999 > 17 19 O 0.37384183151620 0.99504518889136 0.37117304888554 15.999 > 19 20 O 0.37384183151620 0.99504518889136 0.87117304888554 15.999 > 19 21 O 0.37384183151620 0.50495481110864 0.12117304888554 15.999 > 21 22 O 0.37384183151620 0.50495481110864 0.62117304888554 15.999 > 21 23 O 0.62615816848380 0.00495481110864 0.12882695111446 15.999 > 23 24 O 0.62615816848380 0.00495481110864 0.62882695111446 15.999 > 23 25 O 0.87100291161617 0.66783411896169 0.35013580466265 15.999 > 25 26 O 0.87100291161617 0.66783411896169 0.85013580466265 15.999 > 25 27 O 0.12899708838383 0.16783411896170 0.39986419533735 15.999 > 27 28 O 0.12899708838383 0.16783411896170 0.89986419533735 15.999 > 27 29 O 0.12899708838383 0.33216588103831 0.14986419533735 15.999 > 29 30 O 0.12899708838383 0.33216588103831 0.64986419533735 15.999 > 29 31 O 0.87100291161617 0.83216588103831 0.10013580466265 15.999 > 31 32 O 0.87100291161617 0.83216588103831 0.60013580466265 15.999 > 31 33 O 0.11942616936823 0.49834830249986 0.39481376283716 15.999 > 33 34 O 0.11942616936823 0.49834830249986 0.89481376283716 15.999 > 33 35 O 0.88057383063177 0.99834830249986 0.35518623716284 15.999 > 35 36 O 0.88057383063177 0.99834830249986 0.85518623716284 15.999 > 35 37 O 0.88057383063177 0.50165169750014 0.10518623716284 15.999 > 37 38 O 0.88057383063177 0.50165169750014 0.60518623716284 15.999 > 37 39 O 0.11942616936823 0.00165169750014 0.14481376283716 15.999 > 39 40 O 0.11942616936823 0.00165169750014 0.64481376283716 15.999 > 39 41 O 0.10920313880304 0.73728601629170 0.25940418583463 15.999 > 41 42 O 0.10920313880304 0.73728601629170 0.75940418583463 15.999 > 41 43 O 0.89079686119696 0.23728601629170 0.49059581416537 15.999 > 43 44 O 0.89079686119696 0.23728601629170 0.99059581416537 15.999 > 43 45 O 0.89079686119696 0.26271398370830 0.24059581416537 15.999 > 45 46 O 0.89079686119696 0.26271398370830 0.74059581416537 15.999 > 45 47 O 0.10920313880304 0.76271398370830 0.00940418583463 15.999 > 47 48 O 0.10920313880304 0.76271398370830 0.50940418583463 15.999 > 47 49 O 0.37042270182583 0.33530500743908 0.36205073620114 15.999 > 49 50 O 0.37042270182583 0.33530500743908 0.86205073620114 15.999 > 49 51 O 0.62957729817417 0.83530500743908 0.38794926379886 15.999 > 51 52 O 0.62957729817417 0.83530500743908 0.88794926379886 15.999 > 51 53 O 0.62957729817417 0.66469499256092 0.13794926379886 15.999 > 53 54 O 0.62957729817417 0.66469499256092 0.63794926379886 15.999 > 53 55 O 0.37042270182583 0.16469499256092 0.11205073620114 15.999 > 55 56 O 0.37042270182583 0.16469499256092 0.61205073620114 15.999 > 55 57 Si 0.55012121584250 0.33636355195356 0.39247807559937 28.085 > 57 58 Si 0.55012121584250 0.33636355195356 0.89247807559937 28.085 > 57 59 Si 0.44987878415750 0.83636355195356 0.35752192440063 28.085 > 59 60 Si 0.44987878415750 0.83636355195356 0.85752192440063 28.085 > 59 61 Si 0.44987878415750 0.66363644804644 0.10752192440063 28.085 > 61 62 Si 0.44987878415750 0.66363644804644 0.60752192440063 28.085 > 61 63 Si 0.55012121584250 0.16363644804644 0.14247807559937 28.085 > 63 64 Si 0.55012121584250 0.16363644804644 0.64247807559937 28.085 > 63 65 Si 0.05016511906364 0.83664666437495 0.12973536313861 28.085 > 65 66 Si 0.05016511906364 0.83664666437495 0.62973536313861 28.085 > 65 67 Si 0.94983488093636 0.33664666437495 0.12026463686139 28.085 > 67 68 Si 0.94983488093636 0.33664666437495 0.62026463686139 28.085 > 67 69 Si 0.94983488093636 0.16335333562505 0.37026463686139 28.085 > 69 70 Si 0.94983488093636 0.16335333562505 0.87026463686139 28.085 > 69 71 Si 0.05016511906364 0.66335333562505 0.37973536313861 28.085 > 71 72 Si 0.05016511906364 0.66335333562505 0.87973536313861 28.085 > 71 73 Sc 0.25078658609395 0.14403443968737 0.25691005072123 44.956 > 73 74 Sc 0.25078658609395 0.14403443968737 0.75691005072123 44.956 > 73 75 Sc 0.74921341390605 0.64403443968737 0.49308994927877 44.956 > 75 76 Sc 0.74921341390605 0.64403443968737 0.99308994927877 44.956 > 75 77 Sc 0.74921341390605 0.85596556031263 0.24308994927877 44.956 > 77 78 Sc 0.74921341390605 0.85596556031263 0.74308994927877 44.956 > 77 79 Sc 0.25078658609395 0.35596556031263 0.00691005072123 44.956 > 79 80 Sc 0.25078658609395 0.35596556031263 0.50691005072123 44.956 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.1840429 0.0000000 0.0265059 0.0000000 3.2128735 0.0000000 0.0265053 0.0000000 3.2005976 -------------------------- Born effective charges -------------------------- 1 Li 1.0532778 0.0313634 -0.0732680 0.0225852 1.1053988 -0.0087997 -0.1048998 -0.0182784 1.1474022 2 Li 1.0532778 -0.0313634 -0.0732680 -0.0225852 1.1053988 0.0087997 -0.1048998 0.0182784 1.1474022 3 Li 1.0532778 0.0313634 -0.0732680 0.0225852 1.1053988 -0.0087997 -0.1048998 -0.0182784 1.1474022 4 Li 1.0532778 -0.0313634 -0.0732680 -0.0225852 1.1053988 0.0087997 -0.1048998 0.0182784 1.1474022 5 O -1.4777222 0.1910071 0.1815536 0.2033498 -1.6585831 -0.7193038 0.2218244 -0.7628234 -2.3383611 6 O -1.4777222 -0.1910071 0.1815536 -0.2033498 -1.6585831 0.7193038 0.2218244 0.7628234 -2.3383611 7 O -1.4777222 0.1910071 0.1815536 0.2033498 -1.6585831 -0.7193038 0.2218244 -0.7628234 -2.3383611 8 O -1.4777222 -0.1910071 0.1815536 -0.2033498 -1.6585831 0.7193038 0.2218244 0.7628234 -2.3383611 9 O -1.7482837 -0.8795114 -0.2721179 -0.8047811 -2.4706588 -0.4331235 -0.2227491 -0.4842929 -1.6460122 10 O -1.7482837 0.8795114 -0.2721179 0.8047811 -2.4706588 0.4331235 -0.2227491 0.4842929 -1.6460122 11 O -1.7482837 -0.8795114 -0.2721179 -0.8047811 -2.4706588 -0.4331235 -0.2227491 -0.4842929 -1.6460122 12 O -1.7482837 0.8795114 -0.2721179 0.8047811 -2.4706588 0.4331235 -0.2227491 0.4842929 -1.6460122 13 O -2.5471087 0.2013726 0.1373294 0.1347355 -1.6378115 0.3717626 0.0670691 0.3377104 -1.9185152 14 O -2.5471087 -0.2013726 0.1373294 -0.1347355 -1.6378115 -0.3717626 0.0670691 -0.3377104 -1.9185152 15 O -2.5471087 0.2013726 0.1373294 0.1347355 -1.6378115 0.3717626 0.0670691 0.3377104 -1.9185152 16 O -2.5471087 -0.2013726 0.1373294 -0.1347355 -1.6378115 -0.3717626 0.0670691 -0.3377104 -1.9185152 17 O -1.7485939 0.8714151 -0.3886854 0.7913107 -2.5230320 0.6027941 -0.3048044 0.5356390 -1.6809761 18 O -1.7485939 -0.8714151 -0.3886854 -0.7913107 -2.5230320 -0.6027941 -0.3048044 -0.5356390 -1.6809761 19 O -1.7485939 0.8714151 -0.3886854 0.7913107 -2.5230320 0.6027941 -0.3048044 0.5356390 -1.6809761 20 O -1.7485939 -0.8714151 -0.3886854 -0.7913107 -2.5230320 -0.6027941 -0.3048044 -0.5356390 -1.6809761 21 O -1.4872799 -0.0709663 0.1831532 -0.1124884 -1.6868769 0.7579401 0.2556082 0.7718800 -2.3299893 22 O -1.4872799 0.0709663 0.1831532 0.1124884 -1.6868769 -0.7579401 0.2556082 -0.7718800 -2.3299893 23 O -1.4872799 -0.0709663 0.1831532 -0.1124884 -1.6868769 0.7579401 0.2556082 0.7718800 -2.3299893 24 O -1.4872799 0.0709663 0.1831532 0.1124884 -1.6868769 -0.7579401 0.2556082 -0.7718800 -2.3299893 25 O -2.5627253 -0.1737939 0.1459075 -0.1091760 -1.6230254 -0.3319792 0.0587343 -0.3647444 -1.9083103 26 O -2.5627253 0.1737939 0.1459075 0.1091760 -1.6230254 0.3319792 0.0587343 0.3647444 -1.9083103 27 O -2.5627253 -0.1737939 0.1459075 -0.1091760 -1.6230254 -0.3319792 0.0587343 -0.3647444 -1.9083103 28 O -2.5627253 0.1737939 0.1459075 0.1091760 -1.6230254 0.3319792 0.0587343 0.3647444 -1.9083103 29 Si 3.5039215 0.4838020 -0.0774479 0.4103604 3.3309374 -0.1235603 -0.0721125 0.3974507 3.3823442 30 Si 3.5039215 -0.4838020 -0.0774479 -0.4103604 3.3309374 0.1235603 -0.0721125 -0.3974507 3.3823442 31 Si 3.5039215 0.4838020 -0.0774479 0.4103604 3.3309374 -0.1235603 -0.0721125 0.3974507 3.3823442 32 Si 3.5039215 -0.4838020 -0.0774479 -0.4103604 3.3309374 0.1235603 -0.0721125 -0.3974507 3.3823442 33 Si 3.4961474 0.5716715 0.0182684 0.3210305 3.4219378 0.0322782 -0.0724797 0.1484332 3.4264613 34 Si 3.4961474 -0.5716715 0.0182684 -0.3210305 3.4219378 -0.0322782 -0.0724797 -0.1484332 3.4264613 35 Si 3.4961474 0.5716715 0.0182684 0.3210305 3.4219378 0.0322782 -0.0724797 0.1484332 3.4264613 36 Si 3.4961474 -0.5716715 0.0182684 -0.3210305 3.4219378 -0.0322782 -0.0724797 -0.1484332 3.4264613 37 Sc 3.5183670 -0.0098421 0.1453070 0.0505074 3.7417138 0.0178997 0.1738094 0.0108599 3.8659565 38 Sc 3.5183670 0.0098421 0.1453070 -0.0505074 3.7417138 -0.0178997 0.1738094 -0.0108599 3.8659565 39 Sc 3.5183670 -0.0098421 0.1453070 0.0505074 3.7417138 0.0178997 0.1738094 0.0108599 3.8659565 40 Sc 3.5183670 0.0098421 0.1453070 -0.0505074 3.7417138 -0.0178997 0.1738094 -0.0108599 3.8659565 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000001 (xxx) -0.00000001 (xxx) -0.00000001 (xxx) Max drift of fc2: -0.00000000 (zz) -0.00000000 (zz) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 5 6 10 ] 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: 0.55, Number of G-points: 285, Lambda: 0.10 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/104) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 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 1.896 ( 0.000 0.000 0.000) 0.000 2.367 ( 0.000 0.000 0.000) 0.000 3.008 ( 0.000 0.000 0.000) 0.000 3.107 ( 0.000 0.000 0.000) 0.000 3.484 ( 0.000 0.000 0.000) 0.000 3.612 ( 0.000 0.000 0.000) 0.000 3.696 ( 0.000 0.000 0.000) 0.000 3.962 ( 0.000 0.000 0.000) 0.000 4.540 ( 0.000 0.000 0.000) 0.000 4.652 ( 0.000 0.000 0.000) 0.000 4.893 ( 0.000 0.000 0.000) 0.000 4.949 ( 0.000 0.000 0.000) 0.000 4.964 ( 0.000 0.000 0.000) 0.000 5.276 ( 0.000 0.000 0.000) 0.000 5.348 ( 0.000 0.000 0.000) 0.000 5.673 ( 0.000 0.000 0.000) 0.000 6.148 ( 0.000 0.000 0.000) 0.000 6.326 ( 0.000 0.000 0.000) 0.000 6.514 ( 0.000 0.000 0.000) 0.000 6.585 ( 0.000 0.000 0.000) 0.000 6.674 ( 0.000 0.000 0.000) 0.000 6.975 ( 0.000 0.000 0.000) 0.000 7.206 ( 0.000 0.000 0.000) 0.000 7.253 ( 0.000 0.000 0.000) 0.000 7.416 ( 0.000 0.000 0.000) 0.000 7.428 ( 0.000 0.000 0.000) 0.000 7.730 ( 0.000 0.000 0.000) 0.000 7.883 ( 0.000 0.000 0.000) 0.000 8.049 ( 0.000 0.000 0.000) 0.000 8.268 ( 0.000 0.000 0.000) 0.000 8.283 ( 0.000 0.000 0.000) 0.000 8.399 ( 0.000 0.000 0.000) 0.000 8.468 ( 0.000 0.000 0.000) 0.000 8.503 ( 0.000 0.000 0.000) 0.000 8.735 ( 0.000 0.000 0.000) 0.000 8.775 ( 0.000 0.000 0.000) 0.000 8.842 ( 0.000 0.000 0.000) 0.000 8.860 ( 0.000 0.000 0.000) 0.000 8.958 ( 0.000 0.000 0.000) 0.000 9.119 ( 0.000 0.000 0.000) 0.000 9.124 ( 0.000 0.000 0.000) 0.000 9.304 ( 0.000 0.000 0.000) 0.000 9.388 ( 0.000 0.000 0.000) 0.000 9.502 ( 0.000 0.000 0.000) 0.000 9.585 ( 0.000 0.000 0.000) 0.000 9.866 ( 0.000 0.000 0.000) 0.000 9.979 ( 0.000 0.000 0.000) 0.000 10.164 ( 0.000 0.000 0.000) 0.000 10.442 ( 0.000 0.000 0.000) 0.000 10.576 ( 0.000 0.000 0.000) 0.000 10.731 ( 0.000 0.000 0.000) 0.000 10.867 ( 0.000 0.000 0.000) 0.000 10.899 ( 0.000 0.000 0.000) 0.000 11.041 ( 0.000 0.000 0.000) 0.000 11.085 ( 0.000 0.000 0.000) 0.000 11.228 ( 0.000 0.000 0.000) 0.000 11.271 ( 0.000 0.000 0.000) 0.000 11.387 ( 0.000 0.000 0.000) 0.000 11.574 ( 0.000 0.000 0.000) 0.000 11.757 ( 0.000 0.000 0.000) 0.000 11.850 ( 0.000 0.000 0.000) 0.000 12.021 ( 0.000 0.000 0.000) 0.000 12.267 ( 0.000 0.000 0.000) 0.000 12.431 ( 0.000 0.000 0.000) 0.000 12.797 ( 0.000 0.000 0.000) 0.000 12.862 ( 0.000 0.000 0.000) 0.000 12.870 ( 0.000 0.000 0.000) 0.000 13.158 ( 0.000 0.000 0.000) 0.000 13.178 ( 0.000 0.000 0.000) 0.000 13.692 ( 0.000 0.000 0.000) 0.000 13.914 ( 0.000 0.000 0.000) 0.000 13.953 ( 0.000 0.000 0.000) 0.000 14.233 ( 0.000 0.000 0.000) 0.000 14.415 ( 0.000 0.000 0.000) 0.000 14.794 ( 0.000 0.000 0.000) 0.000 15.115 ( 0.000 0.000 0.000) 0.000 15.318 ( 0.000 0.000 0.000) 0.000 15.511 ( 0.000 0.000 0.000) 0.000 15.676 ( 0.000 0.000 0.000) 0.000 15.726 ( 0.000 0.000 0.000) 0.000 15.943 ( 0.000 0.000 0.000) 0.000 16.511 ( 0.000 0.000 0.000) 0.000 16.615 ( 0.000 0.000 0.000) 0.000 16.829 ( 0.000 0.000 0.000) 0.000 17.210 ( 0.000 0.000 0.000) 0.000 18.433 ( 0.000 0.000 0.000) 0.000 19.277 ( 0.000 0.000 0.000) 0.000 19.460 ( 0.000 0.000 0.000) 0.000 19.677 ( 0.000 0.000 0.000) 0.000 22.409 ( 0.000 0.000 0.000) 0.000 22.663 ( 0.000 0.000 0.000) 0.000 22.706 ( 0.000 0.000 0.000) 0.000 22.960 ( 0.000 0.000 0.000) 0.000 24.944 ( 0.000 0.000 0.000) 0.000 24.997 ( 0.000 0.000 0.000) 0.000 25.360 ( 0.000 0.000 0.000) 0.000 25.454 ( 0.000 0.000 0.000) 0.000 25.668 ( 0.000 0.000 0.000) 0.000 26.092 ( 0.000 0.000 0.000) 0.000 27.508 ( 0.000 0.000 0.000) 0.000 28.323 ( 0.000 0.000 0.000) 0.000 28.660 ( 0.000 0.000 0.000) 0.000 28.719 ( 0.000 0.000 0.000) 0.000 29.177 ( 0.000 0.000 0.000) 0.000 29.315 ( 0.000 0.000 0.000) 0.000 29.348 ( 0.000 0.000 0.000) 0.000 29.595 ( 0.000 0.000 0.000) 0.000 29.600 ( 0.000 0.000 0.000) 0.000 29.637 ( 0.000 0.000 0.000) 0.000 29.771 ( 0.000 0.000 0.000) 0.000 29.916 ( 0.000 0.000 0.000) 0.000 30.211 ( 0.000 0.000 0.000) 0.000 30.831 ( 0.000 0.000 0.000) 0.000 31.238 ( 0.000 0.000 0.000) 0.000 31.434 ( 0.000 0.000 0.000) 0.000 32.015 ( 0.000 0.000 0.000) 0.000 33.126 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/104) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.876 ( 37.080 0.000 11.528) 38.831 1.014 ( 42.870 0.000 10.594) 44.159 1.791 ( 74.919 0.000 8.620) 75.413 1.968 ( 11.454 0.000 -10.670) 15.654 2.400 ( 2.047 0.000 -0.713) 2.167 2.962 ( -4.474 0.000 4.295) 6.201 3.087 ( -2.694 0.000 -0.052) 2.694 3.464 ( -2.869 0.000 3.679) 4.665 3.573 ( -11.078 0.000 3.430) 11.597 3.617 ( 0.408 0.000 -2.471) 2.505 4.079 ( 8.595 0.000 -1.299) 8.693 4.482 ( -5.174 0.000 8.233) 9.724 4.512 ( -13.387 0.000 7.405) 15.299 4.679 ( 0.571 0.000 1.557) 1.658 5.045 ( 5.019 0.000 -5.512) 7.455 5.119 ( -16.590 0.000 -6.066) 17.665 5.197 ( -4.021 0.000 -2.238) 4.602 5.416 ( 22.253 0.000 -7.544) 23.497 5.536 ( -5.147 0.000 3.181) 6.051 6.125 ( -33.551 0.000 1.753) 33.596 6.151 ( -12.238 0.000 -11.357) 16.696 6.541 ( 6.653 0.000 -0.728) 6.693 6.588 ( 12.309 0.000 13.473) 18.250 6.675 ( 4.126 0.000 5.636) 6.985 6.923 ( -15.819 0.000 -3.248) 16.149 7.236 ( 12.140 0.000 -5.433) 13.300 7.294 ( 3.689 0.000 -0.895) 3.796 7.536 ( 9.484 0.000 -5.836) 11.135 7.593 ( 6.060 0.000 -0.811) 6.114 7.643 ( -2.620 0.000 -6.214) 6.744 7.883 ( -2.083 0.000 6.472) 6.799 7.989 ( -5.782 0.000 -0.089) 5.782 8.280 ( 2.559 0.000 -7.844) 8.251 8.298 ( 1.869 0.000 1.650) 2.494 8.433 ( 0.925 0.000 4.957) 5.042 8.506 ( -1.445 0.000 -6.422) 6.582 8.508 ( 0.414 0.000 1.178) 1.248 8.743 ( -4.380 0.000 -7.723) 8.879 8.830 ( 2.431 0.000 13.501) 13.718 8.831 ( -1.107 0.000 -0.709) 1.315 8.897 ( -0.750 0.000 4.172) 4.239 9.035 ( -3.162 0.000 1.647) 3.565 9.189 ( -4.223 0.000 12.359) 13.061 9.258 ( -2.893 0.000 -2.242) 3.660 9.321 ( -1.262 0.000 -8.757) 8.847 9.449 ( -4.775 0.000 -2.974) 5.625 9.727 ( 8.514 0.000 6.083) 10.464 9.882 ( 1.557 0.000 -0.812) 1.756 9.888 ( 8.551 0.000 8.708) 12.204 9.975 ( -0.973 0.000 6.900) 6.968 10.260 ( 7.159 0.000 2.780) 7.680 10.422 ( -0.813 0.000 -0.796) 1.138 10.601 ( -12.402 0.000 5.283) 13.481 10.858 ( -2.145 0.000 1.039) 2.383 10.870 ( 0.756 0.000 -1.880) 2.026 10.998 ( -1.415 0.000 1.932) 2.395 11.023 ( -1.485 0.000 -7.187) 7.339 11.091 ( 1.599 0.000 5.208) 5.447 11.190 ( -9.257 0.000 -3.864) 10.031 11.387 ( 3.155 0.000 -12.446) 12.840 11.405 ( 8.306 0.000 -8.841) 12.130 11.613 ( 0.658 0.000 7.601) 7.630 11.810 ( -3.984 0.000 3.357) 5.210 11.971 ( 6.852 0.000 -13.733) 15.348 12.266 ( -6.275 0.000 3.998) 7.440 12.390 ( -5.302 0.000 8.279) 9.832 12.611 ( -9.919 0.000 8.915) 13.337 12.679 ( -1.834 0.000 42.518) 42.558 12.847 ( 4.514 0.000 -4.994) 6.732 13.096 ( -5.632 0.000 -0.284) 5.639 13.214 ( 12.571 0.000 -59.375) 60.691 13.453 ( 16.446 0.000 -8.528) 18.525 13.560 ( -10.444 0.000 -1.113) 10.503 13.929 ( 0.662 0.000 2.643) 2.725 13.998 ( 4.128 0.000 -2.151) 4.655 14.219 ( -0.652 0.000 -2.498) 2.581 14.433 ( 1.517 0.000 0.150) 1.524 14.787 ( -0.198 0.000 0.450) 0.492 15.077 ( -3.139 0.000 -0.899) 3.266 15.275 ( -3.233 0.000 -2.575) 4.133 15.446 ( 1.784 0.000 -3.595) 4.013 15.748 ( 1.598 0.000 0.930) 1.849 15.903 ( 10.883 0.000 12.948) 16.914 15.917 ( -2.654 0.000 2.184) 3.437 16.480 ( -1.905 0.000 -4.912) 5.268 16.743 ( -23.489 0.000 2.885) 23.666 16.846 ( 1.483 0.000 -0.357) 1.526 17.209 ( -0.301 0.000 0.877) 0.927 18.853 ( -6.452 0.000 29.037) 29.745 19.180 ( -7.372 0.000 -9.155) 11.755 19.544 ( 9.906 0.000 0.404) 9.914 19.834 ( 8.310 0.000 2.198) 8.595 22.422 ( 1.345 0.000 -0.904) 1.621 22.597 ( -4.265 0.000 2.196) 4.797 22.769 ( 3.948 0.000 -1.944) 4.401 22.947 ( -1.430 0.000 0.811) 1.644 24.945 ( 0.089 0.000 0.262) 0.277 24.993 ( -0.438 0.000 0.333) 0.551 25.367 ( 0.858 0.000 -0.649) 1.075 25.449 ( -0.464 0.000 -0.177) 0.497 26.270 ( 15.363 0.000 0.923) 15.391 27.410 ( -8.559 0.000 -1.074) 8.626 28.145 ( 9.438 0.000 -18.225) 20.523 28.362 ( 3.368 0.000 0.297) 3.381 28.633 ( -2.551 0.000 0.322) 2.572 28.780 ( -2.800 0.000 -1.785) 3.321 29.201 ( 3.746 0.000 -6.450) 7.459 29.348 ( 3.834 0.000 -4.122) 5.630 29.556 ( -8.235 0.000 31.131) 32.202 29.602 ( -0.439 0.000 2.950) 2.982 29.612 ( -3.120 0.000 3.488) 4.680 29.715 ( -3.969 0.000 -2.817) 4.867 29.829 ( -1.281 0.000 8.693) 8.787 30.139 ( -2.697 0.000 -11.160) 11.481 30.832 ( 0.069 0.000 -0.030) 0.075 31.258 ( 1.562 0.000 0.269) 1.585 31.442 ( 0.632 0.000 0.824) 1.039 31.970 ( 15.293 0.000 -11.281) 19.004 31.977 ( -3.012 0.000 -0.985) 3.169 33.034 ( -9.114 0.000 -1.483) 9.234 ======================= Grid point 2 (3/104) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( 21.491 0.000 9.962) 23.687 1.862 ( 30.901 0.000 8.633) 32.084 2.075 ( 6.919 0.000 -9.820) 12.012 2.338 ( -9.979 0.000 -4.898) 11.117 2.756 ( -6.522 0.000 -0.967) 6.593 2.981 ( -3.487 0.000 -5.171) 6.237 3.262 ( 13.362 0.000 0.424) 13.369 3.440 ( -0.491 0.000 9.551) 9.563 3.556 ( -3.605 0.000 -9.315) 9.988 3.572 ( 39.872 0.000 15.556) 42.799 4.171 ( -1.704 0.000 2.838) 3.311 4.355 ( -5.698 0.000 -0.371) 5.710 4.514 ( 5.101 0.000 11.926) 12.971 4.722 ( -4.893 0.000 -5.365) 7.261 4.836 ( -12.845 0.000 -12.130) 17.667 4.875 ( 0.190 0.000 6.024) 6.027 5.286 ( -30.671 0.000 -3.433) 30.863 5.316 ( -14.140 0.000 -1.132) 14.185 5.348 ( 9.601 0.000 4.064) 10.426 5.847 ( -9.903 0.000 -7.677) 12.530 5.927 ( 23.501 0.000 -5.592) 24.157 6.400 ( -22.426 0.000 3.516) 22.700 6.706 ( 6.919 0.000 -1.756) 7.139 6.778 ( 2.388 0.000 2.503) 3.459 7.036 ( 12.024 0.000 11.795) 16.844 7.284 ( -3.698 0.000 -11.284) 11.874 7.367 ( 2.318 0.000 -0.292) 2.336 7.570 ( 0.410 0.000 -1.169) 1.239 7.679 ( 6.665 0.000 -7.763) 10.231 7.733 ( 3.779 0.000 -0.884) 3.881 7.827 ( -7.995 0.000 8.650) 11.778 7.850 ( -3.005 0.000 -0.334) 3.024 8.328 ( 4.193 0.000 -7.712) 8.778 8.353 ( 2.455 0.000 1.579) 2.918 8.441 ( -1.981 0.000 -5.336) 5.692 8.468 ( 0.325 0.000 4.526) 4.538 8.519 ( 0.122 0.000 -0.609) 0.621 8.679 ( -0.809 0.000 -1.540) 1.740 8.816 ( 1.638 0.000 -2.169) 2.718 8.820 ( -1.423 0.000 -0.619) 1.552 8.964 ( -6.524 0.000 9.000) 11.116 9.004 ( 1.533 0.000 11.448) 11.550 9.136 ( -0.334 0.000 -0.853) 0.916 9.197 ( -1.679 0.000 1.469) 2.231 9.294 ( 1.618 0.000 -7.905) 8.069 9.306 ( -5.503 0.000 -1.375) 5.672 9.853 ( -2.692 0.000 2.698) 3.811 9.944 ( 10.667 0.000 0.465) 10.678 10.046 ( 2.848 0.000 2.231) 3.617 10.161 ( 3.843 0.000 9.074) 9.855 10.341 ( -0.424 0.000 0.928) 1.020 10.378 ( -1.032 0.000 5.847) 5.938 10.508 ( 6.550 0.000 1.510) 6.722 10.760 ( -12.073 0.000 -13.846) 18.371 10.878 ( -6.023 0.000 3.024) 6.740 10.881 ( 0.543 0.000 0.538) 0.764 10.944 ( -2.571 0.000 -5.265) 5.859 11.008 ( -1.972 0.000 1.482) 2.467 11.161 ( 2.194 0.000 1.277) 2.538 11.446 ( 8.438 0.000 -13.502) 15.922 11.537 ( 6.396 0.000 -9.030) 11.066 11.608 ( -6.117 0.000 10.564) 12.208 11.737 ( -3.840 0.000 4.999) 6.303 12.020 ( -9.948 0.000 1.464) 10.055 12.081 ( 6.734 0.000 -4.939) 8.351 12.279 ( -6.762 0.000 3.964) 7.838 12.668 ( 5.061 0.000 7.712) 9.225 12.815 ( 1.526 0.000 11.783) 11.881 12.948 ( -6.222 0.000 -3.128) 6.964 12.985 ( 9.018 0.000 -1.698) 9.177 13.176 ( -1.823 0.000 -14.714) 14.827 13.347 ( -5.855 0.000 -1.784) 6.121 13.667 ( 5.799 0.000 -4.614) 7.411 13.954 ( 0.367 0.000 2.100) 2.132 14.080 ( 3.247 0.000 -0.814) 3.347 14.193 ( -0.429 0.000 -1.964) 2.010 14.461 ( 0.429 0.000 0.677) 0.801 14.817 ( 2.787 0.000 -0.254) 2.798 14.992 ( -3.932 0.000 0.424) 3.955 15.188 ( -2.611 0.000 -2.244) 3.443 15.617 ( 13.793 0.000 -0.454) 13.800 15.790 ( 1.925 0.000 -0.362) 1.959 15.867 ( -2.530 0.000 2.218) 3.364 16.136 ( -3.741 0.000 8.563) 9.345 16.219 ( -12.874 0.000 1.326) 12.942 16.390 ( -3.862 0.000 -7.040) 8.030 16.874 ( 0.885 0.000 -0.286) 0.930 17.206 ( -0.220 0.000 0.587) 0.627 18.872 ( -1.310 0.000 15.212) 15.269 19.001 ( -3.879 0.000 -10.364) 11.066 19.741 ( 5.890 0.000 0.109) 5.891 19.963 ( 2.778 0.000 0.841) 2.902 22.458 ( 2.608 0.000 -1.642) 3.082 22.520 ( -3.704 0.000 2.095) 4.256 22.838 ( 3.085 0.000 -1.565) 3.459 22.910 ( -2.238 0.000 1.208) 2.544 24.950 ( 0.107 0.000 0.503) 0.515 24.984 ( -0.332 0.000 -0.196) 0.385 25.390 ( 1.344 0.000 -0.297) 1.377 25.431 ( -1.086 0.000 -0.153) 1.097 26.667 ( 18.335 0.000 0.890) 18.357 27.155 ( -13.784 0.000 -0.785) 13.807 28.261 ( 5.070 0.000 -5.304) 7.337 28.455 ( 4.928 0.000 0.128) 4.929 28.558 ( -4.455 0.000 0.261) 4.463 28.705 ( -3.115 0.000 1.339) 3.391 29.281 ( 7.194 0.000 -11.687) 13.724 29.430 ( 5.415 0.000 -5.748) 7.897 29.471 ( -12.191 0.000 29.155) 31.601 29.542 ( -4.952 0.000 5.350) 7.290 29.608 ( -1.228 0.000 7.798) 7.894 29.632 ( 1.708 0.000 -17.705) 17.788 29.837 ( -0.079 0.000 1.173) 1.175 30.059 ( -0.821 0.000 -5.114) 5.180 30.833 ( 0.043 0.000 -0.017) 0.046 31.290 ( 0.955 0.000 0.110) 0.961 31.464 ( 0.773 0.000 0.713) 1.052 31.907 ( -2.231 0.000 -0.758) 2.356 32.291 ( 14.426 0.000 0.836) 14.451 32.773 ( -12.331 0.000 -2.868) 12.660 ======================= Grid point 5 (4/104) ======================= q-point: ( 0.00 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.856 ( 0.000 45.481 0.000) 45.481 0.905 ( 0.000 46.256 0.000) 46.256 1.353 ( 0.000 69.770 0.000) 69.770 1.989 ( 0.000 8.688 0.000) 8.688 2.523 ( 0.000 13.725 0.000) 13.725 3.064 ( 0.000 5.296 0.000) 5.296 3.135 ( 0.000 2.830 0.000) 2.830 3.552 ( 0.000 -2.796 0.000) 2.796 3.592 ( 0.000 9.329 0.000) 9.329 3.768 ( 0.000 4.933 0.000) 4.933 4.023 ( 0.000 3.252 0.000) 3.252 4.360 ( 0.000 -22.794 0.000) 22.794 4.596 ( 0.000 5.985 0.000) 5.985 4.855 ( 0.000 -3.762 0.000) 3.762 4.960 ( 0.000 6.716 0.000) 6.716 5.155 ( 0.000 -6.628 0.000) 6.628 5.390 ( 0.000 5.870 0.000) 5.870 5.690 ( 0.000 13.335 0.000) 13.335 5.715 ( 0.000 5.332 0.000) 5.332 6.103 ( 0.000 -5.068 0.000) 5.068 6.199 ( 0.000 -13.932 0.000) 13.932 6.455 ( 0.000 -6.086 0.000) 6.086 6.509 ( 0.000 -7.555 0.000) 7.555 6.540 ( 0.000 -12.723 0.000) 12.723 6.841 ( 0.000 -10.459 0.000) 10.459 7.066 ( 0.000 -13.576 0.000) 13.576 7.109 ( 0.000 -7.971 0.000) 7.971 7.507 ( 0.000 6.035 0.000) 6.035 7.526 ( 0.000 2.305 0.000) 2.305 7.615 ( 0.000 -6.323 0.000) 6.323 8.024 ( 0.000 3.512 0.000) 3.512 8.075 ( 0.000 -0.897 0.000) 0.897 8.302 ( 0.000 3.042 0.000) 3.042 8.362 ( 0.000 5.806 0.000) 5.806 8.428 ( 0.000 -5.924 0.000) 5.924 8.503 ( 0.000 -2.581 0.000) 2.581 8.588 ( 0.000 -4.805 0.000) 4.805 8.663 ( 0.000 -0.352 0.000) 0.352 8.778 ( 0.000 -0.343 0.000) 0.343 8.905 ( 0.000 5.363 0.000) 5.363 8.967 ( 0.000 1.741 0.000) 1.741 9.137 ( 0.000 2.312 0.000) 2.312 9.226 ( 0.000 1.283 0.000) 1.283 9.248 ( 0.000 14.582 0.000) 14.582 9.299 ( 0.000 1.023 0.000) 1.023 9.399 ( 0.000 1.314 0.000) 1.314 9.490 ( 0.000 -0.643 0.000) 0.643 9.609 ( 0.000 0.536 0.000) 0.536 9.844 ( 0.000 -2.453 0.000) 2.453 9.993 ( 0.000 1.712 0.000) 1.712 10.155 ( 0.000 0.127 0.000) 0.127 10.437 ( 0.000 0.308 0.000) 0.308 10.537 ( 0.000 -3.908 0.000) 3.908 10.711 ( 0.000 -2.499 0.000) 2.499 10.849 ( 0.000 -6.315 0.000) 6.315 10.913 ( 0.000 -9.319 0.000) 9.319 10.951 ( 0.000 -4.028 0.000) 4.028 11.214 ( 0.000 -3.636 0.000) 3.636 11.296 ( 0.000 1.432 0.000) 1.432 11.350 ( 0.000 5.735 0.000) 5.735 11.590 ( 0.000 1.866 0.000) 1.866 11.770 ( 0.000 1.075 0.000) 1.075 11.823 ( 0.000 -2.853 0.000) 2.853 11.986 ( 0.000 6.633 0.000) 6.633 12.052 ( 0.000 3.245 0.000) 3.245 12.057 ( 0.000 -11.614 0.000) 11.614 12.566 ( 0.000 4.354 0.000) 4.354 12.741 ( 0.000 -5.993 0.000) 5.993 12.865 ( 0.000 6.801 0.000) 6.801 13.090 ( 0.000 15.478 0.000) 15.478 13.171 ( 0.000 0.175 0.000) 0.175 13.748 ( 0.000 6.097 0.000) 6.097 13.875 ( 0.000 -3.720 0.000) 3.720 13.939 ( 0.000 -1.396 0.000) 1.396 14.156 ( 0.000 -7.229 0.000) 7.229 14.482 ( 0.000 6.420 0.000) 6.420 14.830 ( 0.000 4.082 0.000) 4.082 14.928 ( 0.000 -10.566 0.000) 10.566 15.074 ( 0.000 -4.287 0.000) 4.287 15.373 ( 0.000 5.940 0.000) 5.940 15.428 ( 0.000 -7.325 0.000) 7.325 15.779 ( 0.000 9.562 0.000) 9.562 15.789 ( 0.000 5.131 0.000) 5.131 16.381 ( 0.000 -7.469 0.000) 7.469 16.547 ( 0.000 -7.274 0.000) 7.274 16.750 ( 0.000 -8.264 0.000) 8.264 16.817 ( 0.000 10.983 0.000) 10.983 17.187 ( 0.000 -1.913 0.000) 1.913 18.526 ( 0.000 9.415 0.000) 9.415 19.262 ( 0.000 -1.771 0.000) 1.771 19.455 ( 0.000 -0.473 0.000) 0.473 19.623 ( 0.000 -5.360 0.000) 5.360 22.448 ( 0.000 1.962 0.000) 1.962 22.687 ( 0.000 -1.952 0.000) 1.952 22.703 ( 0.000 2.021 0.000) 2.021 22.942 ( 0.000 -1.915 0.000) 1.915 25.005 ( 0.000 0.769 0.000) 0.769 25.066 ( 0.000 -0.078 0.000) 0.078 25.464 ( 0.000 1.073 0.000) 1.073 25.539 ( 0.000 -0.402 0.000) 0.402 25.678 ( 0.000 1.098 0.000) 1.098 26.033 ( 0.000 -5.800 0.000) 5.800 27.579 ( 0.000 7.461 0.000) 7.461 28.402 ( 0.000 7.652 0.000) 7.652 28.554 ( 0.000 -10.487 0.000) 10.487 28.718 ( 0.000 0.083 0.000) 0.083 29.164 ( 0.000 -1.236 0.000) 1.236 29.321 ( 0.000 -2.447 0.000) 2.447 29.399 ( 0.000 7.121 0.000) 7.121 29.595 ( 0.000 0.126 0.000) 0.126 29.597 ( 0.000 -0.278 0.000) 0.278 29.759 ( 0.000 -1.282 0.000) 1.282 29.923 ( 0.000 0.844 0.000) 0.844 30.181 ( 0.000 -2.977 0.000) 2.977 30.477 ( 0.000 7.135 0.000) 7.135 31.213 ( 0.000 -2.914 0.000) 2.914 31.293 ( 0.000 3.819 0.000) 3.819 31.904 ( 0.000 -10.674 0.000) 10.674 33.220 ( 0.000 9.101 0.000) 9.101 33.995 ( 0.000 -5.267 0.000) 5.267 ======================= Grid point 6 (5/104) ======================= q-point: ( 0.20 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.198 ( 25.447 31.214 0.905) 40.283 1.422 ( 33.392 31.903 6.216) 46.599 2.046 ( 9.911 10.697 -1.256) 14.636 2.147 ( 52.602 30.495 2.922) 60.873 2.569 ( 5.122 16.765 -1.518) 17.595 3.006 ( -4.682 4.756 3.391) 7.486 3.105 ( -3.747 1.558 -1.163) 4.221 3.508 ( -4.861 -1.383 2.527) 5.650 3.572 ( -2.300 8.819 2.539) 9.461 3.726 ( -2.732 6.068 -0.679) 6.689 4.144 ( 7.310 1.799 2.750) 8.014 4.309 ( -3.087 -16.635 -0.797) 16.937 4.487 ( -8.508 0.180 1.809) 8.700 4.615 ( -9.586 -0.415 5.760) 11.191 5.125 ( 3.387 5.916 -0.006) 6.817 5.176 ( -6.355 4.503 -2.783) 8.270 5.310 ( -4.289 7.551 0.208) 8.687 5.529 ( 9.155 6.658 -5.909) 12.770 5.617 ( -5.237 8.053 -1.131) 9.673 5.978 ( -24.023 -9.588 -4.579) 26.268 6.174 ( -12.528 -3.641 -7.799) 15.199 6.437 ( 5.658 -15.308 10.547) 19.432 6.472 ( 7.520 -6.420 -1.956) 10.079 6.608 ( 3.448 -4.550 8.608) 10.329 6.956 ( -5.752 3.243 -1.652) 6.807 7.084 ( 8.805 -9.837 -2.452) 13.428 7.226 ( 8.572 -12.014 -1.998) 14.893 7.383 ( -0.261 -12.500 -8.853) 15.320 7.577 ( 1.826 1.771 2.504) 3.570 7.681 ( 2.536 0.967 2.994) 4.042 7.973 ( -3.846 3.249 0.690) 5.082 7.987 ( -6.417 -0.663 -6.813) 9.382 8.291 ( 0.038 2.006 -5.008) 5.395 8.353 ( 2.267 3.645 -1.547) 4.563 8.396 ( -2.755 -6.362 4.416) 8.220 8.503 ( 1.241 0.493 4.748) 4.932 8.576 ( 0.951 4.050 0.121) 4.162 8.621 ( 0.820 -2.040 -10.944) 11.163 8.768 ( -3.729 0.620 -2.377) 4.466 8.869 ( -3.096 2.697 10.228) 11.021 9.047 ( -1.544 0.679 7.423) 7.613 9.079 ( -3.722 2.349 8.333) 9.424 9.227 ( -1.583 6.710 4.519) 8.243 9.330 ( 2.857 4.254 -8.418) 9.855 9.360 ( -1.457 3.332 -6.181) 7.171 9.420 ( -3.870 -0.203 1.815) 4.280 9.614 ( 15.644 -14.238 0.495) 21.159 9.694 ( 7.225 -4.172 0.999) 8.402 9.901 ( 3.986 1.393 5.976) 7.317 9.984 ( -0.643 1.817 3.807) 4.267 10.257 ( 6.289 -1.672 9.519) 11.531 10.422 ( -1.378 0.642 -1.078) 1.863 10.558 ( -5.298 -5.335 5.377) 9.244 10.686 ( 3.276 -2.744 -5.037) 6.605 10.810 ( -3.056 -7.758 -3.948) 9.226 10.908 ( -0.911 -6.340 0.904) 6.468 10.962 ( 1.729 -3.037 -5.354) 6.394 11.156 ( -6.217 -1.691 -3.761) 7.460 11.288 ( -0.907 5.530 -1.812) 5.890 11.339 ( 2.810 -3.956 -2.244) 5.347 11.531 ( -3.238 6.289 -6.719) 9.756 11.642 ( -4.085 2.280 6.692) 8.165 11.812 ( -3.488 1.228 2.285) 4.347 12.023 ( 3.303 2.237 -7.043) 8.094 12.126 ( 5.650 -5.018 -3.363) 8.271 12.226 ( 0.155 -12.471 12.330) 17.538 12.432 ( -7.088 -7.626 8.703) 13.570 12.793 ( 7.018 6.058 -1.743) 9.433 12.898 ( -0.814 7.700 1.151) 7.828 12.960 ( -0.272 7.311 -1.224) 7.417 13.435 ( 12.231 -0.894 -7.422) 14.334 13.618 ( -7.726 5.399 -3.266) 9.975 13.861 ( -12.274 3.213 5.492) 13.825 13.920 ( -7.816 1.505 2.117) 8.236 14.057 ( -11.333 11.581 -27.169) 31.634 14.153 ( -0.192 -5.839 -1.411) 6.011 14.539 ( 1.316 9.931 -2.405) 10.302 14.836 ( -0.319 4.986 1.317) 5.167 15.068 ( -2.039 -1.569 -2.643) 3.689 15.353 ( -2.928 7.457 -1.340) 8.122 15.406 ( 2.925 -3.356 -4.384) 6.248 15.763 ( -0.265 1.684 7.201) 7.401 15.934 ( 1.107 3.117 4.985) 5.983 16.037 ( -1.604 10.492 0.899) 10.652 16.429 ( -2.172 -5.006 -5.142) 7.498 16.572 ( -6.705 -7.234 1.380) 9.960 17.067 ( -5.285 9.266 2.692) 11.002 17.239 ( -2.155 3.147 2.745) 4.699 18.669 ( 1.250 -12.179 21.555) 24.790 19.125 ( -8.659 -5.363 -9.177) 13.710 19.548 ( 9.715 0.636 0.239) 9.739 19.790 ( 8.829 -4.084 2.454) 10.033 22.447 ( 0.844 2.358 -0.858) 2.648 22.609 ( -4.231 0.836 1.874) 4.702 22.765 ( 3.520 -0.221 -1.472) 3.822 22.930 ( -1.326 -1.808 0.734) 2.359 24.962 ( -1.717 1.387 0.271) 2.224 24.996 ( -0.968 0.234 0.282) 1.035 25.386 ( 0.068 1.816 -0.993) 2.070 25.455 ( -0.764 0.525 -0.438) 1.025 26.245 ( 17.776 -2.287 1.629) 17.996 27.141 ( 43.497 -48.401 1.109) 65.084 27.566 ( 4.882 -1.932 0.038) 5.250 28.399 ( -0.388 1.578 -0.632) 1.744 28.547 ( -0.896 -7.406 1.322) 7.576 28.712 ( -1.847 -1.544 3.206) 4.010 29.112 ( -2.494 -3.845 -1.992) 4.997 29.275 ( -4.559 -7.385 5.732) 10.401 29.485 ( 7.378 8.938 -3.974) 12.252 29.594 ( 0.605 0.114 -2.926) 2.990 29.601 ( -0.623 0.201 5.390) 5.430 29.790 ( 1.497 -0.344 -1.052) 1.861 29.912 ( -1.280 3.462 3.475) 5.070 30.226 ( -0.746 3.687 -0.233) 3.769 30.645 ( 13.825 -4.821 2.078) 14.788 31.209 ( -0.921 -3.443 1.730) 3.962 31.332 ( 3.654 2.924 0.419) 4.698 31.870 ( -2.685 -9.873 -0.820) 10.264 33.017 ( -30.180 34.393 -13.306) 47.652 33.156 ( -19.191 17.912 -2.779) 26.398 ======================= Grid point 7 (6/104) ======================= q-point: ( 0.40 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.781 ( 22.383 17.521 3.158) 28.600 2.079 ( 16.107 19.276 10.161) 27.097 2.178 ( 11.959 11.102 -6.657) 17.624 2.500 ( -5.773 15.206 -4.845) 16.971 2.801 ( -10.352 4.525 0.946) 11.337 2.963 ( -4.021 -1.428 -5.329) 6.827 3.407 ( 14.952 14.225 -1.655) 20.704 3.474 ( 6.362 2.632 6.229) 9.284 3.574 ( 11.992 7.412 3.306) 14.480 3.705 ( 11.007 6.022 2.938) 12.886 4.166 ( -6.132 -4.344 2.702) 7.986 4.254 ( -0.735 -10.816 -5.147) 12.000 4.446 ( 2.571 -1.434 8.370) 8.872 4.574 ( 0.263 -3.256 5.054) 6.018 4.865 ( -8.108 6.529 -8.700) 13.566 5.077 ( -19.752 5.910 -0.604) 20.626 5.307 ( -10.744 4.462 7.987) 14.111 5.427 ( -8.728 10.374 -6.673) 15.110 5.484 ( 5.811 11.249 3.408) 13.112 5.815 ( -1.657 -1.238 -6.615) 6.931 5.952 ( 9.789 -0.644 -9.213) 13.458 6.297 ( -15.300 -10.471 4.237) 19.018 6.691 ( 4.889 -1.034 -1.193) 5.137 6.720 ( 4.514 -5.473 3.626) 7.967 6.971 ( 5.208 -3.084 11.170) 12.704 7.140 ( -0.384 -11.796 -12.095) 16.899 7.294 ( 1.530 -7.929 -0.994) 8.137 7.489 ( 4.973 -13.363 0.235) 14.260 7.580 ( -2.488 -4.110 0.159) 4.807 7.732 ( 0.875 -0.760 0.781) 1.398 7.818 ( -2.703 -1.238 -5.487) 6.240 7.901 ( -3.241 1.312 2.885) 4.533 8.299 ( 2.220 -1.938 -5.379) 6.133 8.379 ( 0.430 -7.533 1.160) 7.634 8.421 ( 3.213 5.334 0.259) 6.232 8.558 ( 1.409 3.759 1.174) 4.182 8.593 ( 0.881 8.223 -3.905) 9.146 8.621 ( 0.886 -4.014 -1.169) 4.274 8.678 ( -1.720 -0.349 -2.944) 3.427 8.750 ( -8.336 -6.684 6.970) 12.757 9.044 ( 0.744 3.709 5.976) 7.073 9.138 ( -2.946 4.269 9.444) 10.775 9.180 ( 0.714 6.711 1.195) 6.854 9.266 ( -4.130 2.435 -4.189) 6.367 9.317 ( -0.497 -0.370 -5.589) 5.623 9.367 ( 0.075 13.414 -1.238) 13.471 9.778 ( 4.794 -12.408 -0.178) 13.303 9.887 ( 0.650 -1.177 2.090) 2.485 10.058 ( 9.834 -2.037 3.754) 10.722 10.101 ( 9.277 -1.164 7.294) 11.859 10.304 ( -5.988 -2.865 0.448) 6.653 10.393 ( 0.095 4.437 2.768) 5.231 10.539 ( 1.493 -5.253 5.774) 7.948 10.631 ( -8.375 -7.513 -9.463) 14.701 10.767 ( 2.743 -2.291 -2.297) 4.248 10.869 ( -5.684 -6.960 -5.458) 10.514 10.918 ( -1.213 -1.838 -2.772) 3.540 10.991 ( -3.057 2.957 3.125) 5.278 11.304 ( 1.474 4.678 1.017) 5.009 11.404 ( 4.387 -9.111 -8.243) 13.046 11.491 ( 3.604 1.614 -8.856) 9.696 11.586 ( -6.338 -2.051 10.179) 12.165 11.755 ( -1.831 2.326 1.781) 3.455 12.001 ( -8.504 -3.228 5.669) 10.718 12.086 ( 1.479 0.721 -2.351) 2.869 12.257 ( 3.215 1.177 -0.955) 3.555 12.483 ( 1.986 -11.696 1.724) 11.988 12.831 ( -2.682 1.053 5.044) 5.810 13.006 ( 11.392 4.271 -3.062) 12.545 13.026 ( 3.042 7.539 0.128) 8.130 13.333 ( -13.509 5.599 10.021) 17.728 13.416 ( -7.993 6.929 -16.531) 19.626 13.675 ( 4.906 -0.123 -3.437) 5.992 13.921 ( 0.756 -2.991 0.939) 3.225 14.050 ( 2.098 -4.035 -1.964) 4.954 14.150 ( 0.608 -3.849 -1.852) 4.315 14.571 ( 0.976 10.874 -0.094) 10.918 14.841 ( 1.130 2.338 -0.088) 2.598 14.992 ( -3.438 -0.165 -0.736) 3.520 15.271 ( -2.458 6.933 -1.449) 7.497 15.551 ( 10.054 -5.096 -2.159) 11.477 15.734 ( -6.652 -7.079 3.683) 10.389 15.951 ( 6.643 10.085 3.557) 12.589 16.192 ( 5.002 4.248 6.670) 9.357 16.255 ( -14.016 3.590 -2.045) 14.612 16.385 ( -4.869 -0.026 -4.954) 6.946 16.978 ( -1.712 9.801 -0.171) 9.951 17.213 ( -0.651 0.843 0.754) 1.305 18.771 ( 1.201 -10.074 16.190) 19.106 18.916 ( -5.333 -8.355 -12.105) 15.646 19.740 ( 5.828 0.164 -0.000) 5.831 19.928 ( 2.959 -3.362 0.931) 4.574 22.476 ( 2.295 1.815 -1.444) 3.263 22.534 ( -3.435 1.378 1.857) 4.141 22.829 ( 2.838 -0.897 -1.338) 3.263 22.895 ( -2.076 -1.517 1.083) 2.790 24.950 ( -0.180 -0.010 0.441) 0.476 24.979 ( -0.500 -0.502 -0.104) 0.716 25.399 ( 1.042 0.875 -0.366) 1.409 25.433 ( -1.004 0.246 -0.266) 1.067 26.693 ( 20.027 2.884 1.443) 20.285 27.197 ( -12.521 4.014 -0.804) 13.173 27.949 ( 14.097 -26.838 -2.752) 30.439 28.360 ( -3.054 -14.753 0.714) 15.083 28.542 ( 0.189 1.075 0.577) 1.235 28.667 ( -2.506 -1.371 1.682) 3.315 29.075 ( -0.396 -9.035 -1.127) 9.113 29.214 ( -2.576 -9.662 3.336) 10.541 29.579 ( 1.826 1.301 -4.474) 5.005 29.595 ( 0.454 0.269 -1.810) 1.885 29.666 ( 4.284 8.626 6.084) 11.392 29.791 ( -0.937 2.559 -1.373) 3.052 29.906 ( -0.689 9.408 3.046) 9.913 30.155 ( -3.135 9.107 -2.138) 9.866 30.871 ( 4.713 1.807 0.883) 5.124 31.200 ( -0.196 -10.766 0.848) 10.801 31.423 ( 3.076 3.064 0.827) 4.420 31.803 ( -2.419 -8.350 -0.694) 8.721 32.606 ( -2.606 23.380 -2.738) 23.684 32.879 ( -10.237 9.221 -2.366) 13.980 ======================= Grid point 10 (7/104) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.613 ( 0.000 32.410 0.000) 32.410 1.728 ( 0.000 43.841 0.000) 43.841 2.096 ( 0.000 4.025 0.000) 4.025 2.528 ( 0.000 44.369 0.000) 44.369 2.821 ( 0.000 20.052 0.000) 20.052 3.135 ( 0.000 -0.873 0.000) 0.873 3.167 ( 0.000 -1.242 0.000) 1.242 3.562 ( 0.000 4.041 0.000) 4.041 3.737 ( 0.000 3.252 0.000) 3.252 3.765 ( 0.000 -18.222 0.000) 18.222 3.854 ( 0.000 4.744 0.000) 4.744 4.233 ( 0.000 -2.527 0.000) 2.527 4.756 ( 0.000 10.740 0.000) 10.740 4.869 ( 0.000 8.171 0.000) 8.171 5.066 ( 0.000 -2.293 0.000) 2.293 5.101 ( 0.000 6.225 0.000) 6.225 5.353 ( 0.000 -7.096 0.000) 7.096 5.793 ( 0.000 -23.834 0.000) 23.834 5.803 ( 0.000 2.541 0.000) 2.541 5.898 ( 0.000 8.333 0.000) 8.333 5.989 ( 0.000 -10.900 0.000) 10.900 6.292 ( 0.000 -12.666 0.000) 12.666 6.307 ( 0.000 -8.453 0.000) 8.453 6.383 ( 0.000 -6.980 0.000) 6.980 6.701 ( 0.000 -2.813 0.000) 2.813 6.810 ( 0.000 -11.195 0.000) 11.195 7.041 ( 0.000 3.806 0.000) 3.806 7.420 ( 0.000 -6.832 0.000) 6.832 7.600 ( 0.000 4.040 0.000) 4.040 7.659 ( 0.000 3.554 0.000) 3.554 7.931 ( 0.000 -11.185 0.000) 11.185 7.991 ( 0.000 -7.900 0.000) 7.900 8.327 ( 0.000 0.052 0.000) 0.052 8.381 ( 0.000 2.127 0.000) 2.127 8.462 ( 0.000 4.928 0.000) 4.928 8.482 ( 0.000 4.840 0.000) 4.840 8.645 ( 0.000 4.597 0.000) 4.597 8.692 ( 0.000 0.378 0.000) 0.378 8.763 ( 0.000 -1.413 0.000) 1.413 8.913 ( 0.000 -7.952 0.000) 7.952 9.043 ( 0.000 7.499 0.000) 7.499 9.198 ( 0.000 -2.195 0.000) 2.195 9.219 ( 0.000 6.973 0.000) 6.973 9.326 ( 0.000 -0.110 0.000) 0.110 9.423 ( 0.000 3.652 0.000) 3.652 9.450 ( 0.000 3.860 0.000) 3.860 9.491 ( 0.000 0.181 0.000) 0.181 9.559 ( 0.000 -4.248 0.000) 4.248 9.837 ( 0.000 3.033 0.000) 3.033 10.019 ( 0.000 -1.158 0.000) 1.158 10.228 ( 0.000 9.523 0.000) 9.523 10.425 ( 0.000 -4.188 0.000) 4.188 10.524 ( 0.000 6.365 0.000) 6.365 10.602 ( 0.000 -11.136 0.000) 11.136 10.670 ( 0.000 -10.018 0.000) 10.018 10.835 ( 0.000 -7.678 0.000) 7.678 10.852 ( 0.000 3.123 0.000) 3.123 11.138 ( 0.000 -5.868 0.000) 5.868 11.336 ( 0.000 2.851 0.000) 2.851 11.404 ( 0.000 0.632 0.000) 0.632 11.637 ( 0.000 2.813 0.000) 2.813 11.749 ( 0.000 -4.261 0.000) 4.261 11.788 ( 0.000 0.914 0.000) 0.914 11.876 ( 0.000 -5.414 0.000) 5.414 12.140 ( 0.000 6.263 0.000) 6.263 12.180 ( 0.000 10.238 0.000) 10.238 12.528 ( 0.000 -6.897 0.000) 6.897 12.615 ( 0.000 -7.794 0.000) 7.794 13.021 ( 0.000 9.038 0.000) 9.038 13.191 ( 0.000 1.156 0.000) 1.156 13.410 ( 0.000 17.837 0.000) 17.837 13.803 ( 0.000 -3.112 0.000) 3.112 13.857 ( 0.000 -0.329 0.000) 0.329 13.967 ( 0.000 10.545 0.000) 10.545 13.983 ( 0.000 -11.170 0.000) 11.170 14.561 ( 0.000 -6.339 0.000) 6.339 14.710 ( 0.000 -3.585 0.000) 3.585 14.949 ( 0.000 7.885 0.000) 7.885 14.964 ( 0.000 -7.317 0.000) 7.317 15.273 ( 0.000 -8.940 0.000) 8.940 15.568 ( 0.000 14.628 0.000) 14.628 15.877 ( 0.000 3.451 0.000) 3.451 15.968 ( 0.000 9.187 0.000) 9.187 16.292 ( 0.000 -1.341 0.000) 1.341 16.344 ( 0.000 -14.302 0.000) 14.302 16.555 ( 0.000 -11.374 0.000) 11.374 16.996 ( 0.000 7.787 0.000) 7.787 17.153 ( 0.000 -1.882 0.000) 1.882 18.749 ( 0.000 13.657 0.000) 13.657 19.191 ( 0.000 -6.731 0.000) 6.731 19.446 ( 0.000 -0.339 0.000) 0.339 19.512 ( 0.000 -5.357 0.000) 5.357 22.499 ( 0.000 3.373 0.000) 3.373 22.637 ( 0.000 -3.367 0.000) 3.367 22.755 ( 0.000 3.419 0.000) 3.419 22.893 ( 0.000 -3.324 0.000) 3.324 25.024 ( 0.000 1.188 0.000) 1.188 25.061 ( 0.000 -0.541 0.000) 0.541 25.490 ( 0.000 1.502 0.000) 1.502 25.529 ( 0.000 -0.622 0.000) 0.622 25.712 ( 0.000 2.779 0.000) 2.779 25.905 ( 0.000 -7.161 0.000) 7.161 27.772 ( 0.000 12.834 0.000) 12.834 28.315 ( 0.000 -14.439 0.000) 14.439 28.563 ( 0.000 8.450 0.000) 8.450 28.716 ( 0.000 -0.516 0.000) 0.516 29.146 ( 0.000 -0.093 0.000) 0.093 29.255 ( 0.000 -4.412 0.000) 4.412 29.532 ( 0.000 5.780 0.000) 5.780 29.590 ( 0.000 -0.394 0.000) 0.394 29.605 ( 0.000 1.430 0.000) 1.430 29.725 ( 0.000 -2.424 0.000) 2.424 29.954 ( 0.000 2.686 0.000) 2.686 30.109 ( 0.000 -4.502 0.000) 4.502 30.660 ( 0.000 12.119 0.000) 12.119 31.112 ( 0.000 -8.415 0.000) 8.415 31.385 ( 0.000 5.830 0.000) 5.830 31.684 ( 0.000 -11.402 0.000) 11.402 33.425 ( 0.000 12.218 0.000) 12.218 33.855 ( 0.000 -9.486 0.000) 9.486 ======================= Grid point 11 (8/104) ======================= q-point: ( 0.20 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.798 ( 13.091 28.250 -1.230) 31.160 2.017 ( 25.571 29.943 -4.104) 39.589 2.210 ( 8.404 8.366 0.708) 11.879 2.704 ( 10.137 19.857 2.939) 22.488 3.011 ( 13.054 26.710 -1.435) 29.764 3.101 ( -0.833 -0.130 0.980) 1.293 3.120 ( 0.417 3.719 0.664) 3.801 3.499 ( -2.692 0.247 -4.761) 5.475 3.672 ( -4.313 -7.947 4.713) 10.197 3.812 ( 0.732 -3.483 0.245) 3.567 3.854 ( 2.171 3.169 -2.601) 4.639 4.363 ( 9.423 -4.578 -0.256) 10.479 4.538 ( -13.543 11.205 1.987) 17.689 4.648 ( -12.637 6.473 5.965) 15.401 5.246 ( 4.170 3.977 1.075) 5.862 5.268 ( 6.540 5.841 6.641) 10.999 5.373 ( -2.403 0.708 4.956) 5.554 5.591 ( -7.559 3.714 -0.950) 8.475 5.754 ( -3.608 1.505 -6.926) 7.954 5.769 ( -5.503 -13.691 -6.723) 16.215 5.978 ( -11.916 -12.047 -0.233) 16.946 6.177 ( 5.722 -12.293 -1.547) 13.647 6.370 ( 6.592 -3.359 -2.434) 7.789 6.516 ( 6.460 -6.868 5.336) 10.834 6.927 ( 11.873 -7.919 3.655) 14.732 6.961 ( 9.693 -9.592 -0.754) 13.658 7.039 ( -0.326 4.518 2.606) 5.226 7.216 ( -10.041 -1.674 -7.860) 12.861 7.614 ( -2.224 0.168 1.521) 2.699 7.659 ( -1.293 -3.389 4.460) 5.748 7.874 ( -4.739 -8.781 -6.588) 11.956 7.952 ( -3.436 -6.394 -1.451) 7.402 8.267 ( -6.166 -0.815 1.075) 6.312 8.349 ( 0.630 1.585 -8.720) 8.885 8.429 ( 1.971 4.228 -2.928) 5.508 8.557 ( 3.189 3.374 8.349) 9.553 8.637 ( -0.274 2.504 -5.076) 5.667 8.677 ( -0.144 5.527 3.119) 6.348 8.772 ( -3.968 -0.304 3.360) 5.208 8.807 ( -7.445 -8.180 -0.718) 11.084 9.051 ( 3.545 1.189 6.445) 7.451 9.187 ( -2.341 7.486 1.688) 8.023 9.226 ( -1.162 -5.466 -0.204) 5.591 9.354 ( -1.594 1.536 7.085) 7.423 9.417 ( -0.786 1.858 -1.225) 2.361 9.478 ( 2.965 -1.394 -1.639) 3.663 9.542 ( 6.715 4.643 -4.899) 9.521 9.629 ( 6.436 -1.471 -2.533) 7.071 9.936 ( 6.294 3.715 7.918) 10.775 10.042 ( 1.651 2.253 1.877) 3.365 10.248 ( 1.713 3.882 2.154) 4.758 10.450 ( -1.318 -5.305 0.262) 5.472 10.500 ( -1.173 4.702 1.027) 4.954 10.592 ( 0.343 -9.215 -5.799) 10.894 10.651 ( 1.552 -6.273 -7.637) 10.004 10.827 ( -0.330 -6.036 -0.246) 6.050 10.890 ( 2.277 0.543 0.078) 2.343 11.113 ( -3.235 -4.073 -2.172) 5.637 11.292 ( -2.019 1.044 -2.082) 3.083 11.357 ( -5.380 0.405 4.301) 6.900 11.588 ( -2.892 1.860 -0.693) 3.507 11.648 ( -6.430 -1.136 2.858) 7.127 11.853 ( 0.074 1.720 -0.420) 1.772 11.968 ( 7.446 -4.820 -1.692) 9.029 12.045 ( -7.035 -0.697 11.621) 13.602 12.244 ( 2.375 0.932 -2.775) 3.770 12.353 ( -5.533 4.015 2.186) 7.178 12.750 ( 7.991 -7.618 -4.697) 11.998 13.071 ( 4.311 9.231 -2.095) 10.401 13.179 ( -3.624 10.324 -0.690) 10.964 13.458 ( 3.960 4.887 -0.135) 6.291 13.744 ( -10.275 6.912 -2.072) 12.556 13.813 ( -2.734 -3.556 5.665) 7.226 13.874 ( -4.402 -2.790 1.262) 5.363 13.997 ( 0.176 -8.771 -5.988) 10.622 14.138 ( -17.919 -4.548 -22.042) 28.769 14.710 ( 3.280 8.236 -1.819) 9.050 14.951 ( -0.684 5.553 0.116) 5.596 15.005 ( 0.530 -3.856 -1.241) 4.085 15.271 ( -0.174 -8.358 -2.924) 8.857 15.592 ( -1.312 14.234 2.105) 14.448 15.804 ( -6.271 2.052 6.396) 9.189 16.008 ( 0.457 5.175 5.556) 7.606 16.207 ( -2.162 6.632 -3.165) 7.660 16.336 ( 0.038 -4.765 -4.790) 6.757 16.449 ( 0.433 -7.463 1.076) 7.553 17.151 ( 0.348 2.121 4.599) 5.076 17.254 ( 3.988 -2.641 9.477) 10.616 18.600 ( -8.080 5.010 5.238) 10.855 18.984 ( -12.072 -9.759 -7.413) 17.202 19.572 ( 9.984 2.048 0.640) 10.212 19.704 ( 9.744 -4.782 2.328) 11.101 22.501 ( 0.482 3.313 -0.515) 3.388 22.608 ( -2.403 -1.279 0.936) 2.879 22.775 ( 1.741 1.595 -0.500) 2.414 22.883 ( -0.979 -3.068 0.544) 3.266 24.985 ( -2.883 0.911 0.319) 3.040 24.999 ( -2.169 0.065 0.224) 2.182 25.424 ( -1.021 2.027 -1.450) 2.693 25.463 ( -1.365 0.105 -1.039) 1.718 26.212 ( 24.027 -0.395 3.214) 24.244 26.490 ( 45.325 -20.739 5.587) 50.156 27.709 ( -5.996 11.878 -0.765) 13.327 28.241 ( -6.743 -14.414 -1.149) 15.955 28.571 ( 0.529 5.935 0.487) 5.978 28.699 ( -2.063 -0.719 2.065) 3.007 29.071 ( -4.794 -0.800 -1.491) 5.084 29.167 ( -5.770 -5.121 0.275) 7.720 29.579 ( 1.639 0.895 -3.007) 3.540 29.591 ( 0.528 -0.280 -2.188) 2.268 29.663 ( 5.044 5.672 5.428) 9.331 29.774 ( 2.134 -1.285 1.244) 2.784 29.986 ( 3.502 5.278 -0.294) 6.341 30.217 ( 7.348 -4.222 1.554) 8.615 30.692 ( 3.508 8.416 1.305) 9.211 31.105 ( -1.656 -8.636 1.454) 8.913 31.421 ( 3.325 5.857 0.951) 6.802 31.679 ( -0.212 -9.343 -0.117) 9.346 33.281 ( -11.736 10.068 -3.874) 15.941 33.465 ( -26.548 5.430 -7.268) 28.055 ======================= Grid point 12 (9/104) ======================= q-point: ( 0.40 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( 16.305 17.926 -1.207) 24.262 2.319 ( 2.674 7.350 -0.389) 7.831 2.550 ( 18.346 23.359 2.568) 29.813 2.788 ( -2.374 12.349 2.718) 12.865 2.896 ( -11.441 1.670 -5.059) 12.621 2.983 ( -3.505 8.813 -2.234) 9.744 3.487 ( 5.528 -8.884 -3.332) 10.981 3.574 ( -0.489 -2.651 4.681) 5.402 3.708 ( 17.315 5.149 0.536) 18.072 3.854 ( 3.985 16.109 -1.315) 16.647 3.905 ( 5.209 -9.112 -2.124) 10.709 4.272 ( -7.526 4.952 0.059) 9.009 4.508 ( -2.981 5.719 13.525) 14.984 4.580 ( 6.208 0.909 -4.791) 7.894 4.991 ( -14.526 5.541 -1.791) 15.650 5.113 ( -18.259 1.657 3.538) 18.673 5.442 ( 3.739 8.369 7.803) 12.038 5.584 ( -4.673 3.869 -4.450) 7.524 5.687 ( 6.312 4.488 -0.444) 7.757 5.770 ( 7.284 -6.484 -2.776) 10.140 5.871 ( -2.477 0.331 -3.445) 4.256 6.155 ( -4.874 -0.124 -3.367) 5.925 6.542 ( 6.857 -11.820 1.637) 13.763 6.667 ( 4.429 -8.250 2.365) 9.658 6.971 ( 1.742 0.239 -9.314) 9.478 7.022 ( -4.959 6.441 5.807) 9.990 7.139 ( 6.026 -6.547 6.307) 10.906 7.219 ( 4.565 -12.270 -0.311) 13.096 7.521 ( -6.293 -2.233 -2.348) 7.079 7.595 ( -3.661 -11.026 0.155) 11.619 7.728 ( -3.370 -9.687 -2.374) 10.528 7.868 ( -1.974 -7.007 -2.385) 7.661 8.203 ( -0.485 -3.725 0.822) 3.845 8.320 ( -1.269 2.500 -2.102) 3.504 8.504 ( 5.129 3.161 -1.617) 6.238 8.610 ( 0.434 -0.192 -5.003) 5.025 8.638 ( -2.885 3.626 3.403) 5.750 8.664 ( -1.505 -0.398 0.166) 1.566 8.700 ( 0.648 1.091 -3.973) 4.171 8.727 ( 0.647 3.204 5.475) 6.377 9.078 ( -2.835 1.787 6.441) 7.261 9.117 ( -5.389 -2.831 -0.003) 6.087 9.261 ( 3.127 -1.597 3.363) 4.862 9.322 ( -0.929 5.488 2.468) 6.089 9.421 ( 0.247 6.685 0.820) 6.740 9.493 ( -0.298 -8.868 -2.926) 9.343 9.645 ( 3.417 8.018 -4.184) 9.668 9.806 ( 8.340 -3.995 -0.713) 9.275 10.057 ( 2.751 2.546 9.548) 10.257 10.162 ( 5.003 3.936 5.560) 8.452 10.278 ( -0.080 1.779 -4.597) 4.930 10.400 ( -1.346 -4.733 -2.365) 5.460 10.456 ( -6.384 -3.038 -5.754) 9.116 10.512 ( 1.962 -3.263 2.669) 4.649 10.730 ( 2.783 -5.469 -2.217) 6.524 10.791 ( -2.930 -1.951 -4.614) 5.803 10.913 ( 0.677 2.384 -1.800) 3.064 10.972 ( -6.365 -1.471 4.529) 7.949 11.273 ( 1.130 -4.552 -2.884) 5.506 11.292 ( -0.528 -4.444 -0.922) 4.569 11.522 ( -1.552 1.136 -5.061) 5.414 11.557 ( -3.870 -0.401 7.611) 8.548 11.812 ( -1.677 3.050 0.411) 3.505 11.929 ( -6.280 -3.919 7.072) 10.238 12.096 ( 4.271 0.957 -1.058) 4.503 12.238 ( -0.525 -5.423 1.309) 5.603 12.459 ( 9.427 9.384 -3.992) 13.888 12.816 ( -3.489 -4.348 -0.157) 5.577 13.091 ( 0.717 5.895 1.598) 6.150 13.185 ( 7.311 6.872 -4.282) 10.909 13.435 ( -14.203 3.410 14.861) 20.838 13.474 ( -8.131 2.919 -14.093) 16.530 13.641 ( 0.570 -3.146 -0.371) 3.218 13.886 ( 2.979 -1.571 -3.714) 5.014 13.919 ( -0.926 -7.164 -1.748) 7.432 14.072 ( 2.227 -4.725 -4.202) 6.703 14.794 ( 4.353 11.163 -1.837) 12.122 14.904 ( -2.937 4.991 1.235) 5.921 14.979 ( -1.566 -1.411 -1.809) 2.777 15.281 ( 2.157 -8.315 -1.486) 8.718 15.522 ( -2.230 3.133 0.098) 3.846 15.625 ( -9.385 -3.717 2.557) 10.413 16.165 ( 8.949 11.126 5.587) 15.333 16.252 ( 4.249 2.708 1.196) 5.179 16.314 ( -0.986 1.625 -1.377) 2.347 16.411 ( -5.694 2.213 -1.809) 6.371 17.161 ( -0.854 7.923 3.088) 8.546 17.249 ( -2.341 3.036 0.553) 3.874 18.574 ( 1.558 -8.194 10.201) 13.176 18.724 ( -7.846 -11.430 -9.807) 16.982 19.755 ( 5.268 1.513 0.128) 5.482 19.858 ( 3.522 -3.766 0.905) 5.235 22.519 ( 1.438 2.483 -0.873) 2.999 22.560 ( -2.293 0.949 1.121) 2.723 22.813 ( 1.839 -0.520 -0.728) 2.045 22.858 ( -1.475 -2.284 0.739) 2.818 24.951 ( -0.700 0.147 0.303) 0.777 24.967 ( -0.825 -0.682 0.060) 1.072 25.418 ( 0.387 1.043 -0.493) 1.217 25.437 ( -0.733 0.075 -0.466) 0.872 26.782 ( 23.752 7.007 2.558) 24.895 27.208 ( 9.600 -8.560 1.116) 12.911 27.577 ( 2.336 -4.604 -0.559) 5.193 28.023 ( -12.136 -18.552 -0.654) 22.178 28.587 ( 0.735 2.997 -0.104) 3.088 28.658 ( -1.926 -0.351 1.292) 2.346 28.987 ( -2.031 -1.669 -0.436) 2.665 29.077 ( -2.259 -5.720 0.132) 6.152 29.586 ( 0.233 0.119 -0.686) 0.734 29.592 ( 0.221 -0.249 -0.833) 0.897 29.766 ( 2.086 2.468 2.036) 3.820 29.799 ( 0.238 -0.241 -0.123) 0.360 30.101 ( 5.687 10.623 -0.052) 12.050 30.303 ( -0.243 4.556 0.703) 4.616 30.845 ( 9.075 -2.589 1.534) 9.560 31.026 ( -6.414 -8.074 0.286) 10.316 31.521 ( 4.106 5.814 1.196) 7.217 31.678 ( -0.174 -4.459 0.081) 4.464 32.950 ( -11.102 12.457 -3.967) 17.151 33.037 ( -9.915 6.301 -2.507) 12.012 ======================= Grid point 15 (10/104) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 52 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.026 ( 0.000 -12.303 0.000) 12.303 2.026 ( 0.000 12.303 0.000) 12.303 2.485 ( 0.000 -34.014 0.000) 34.014 2.485 ( 0.000 34.014 0.000) 34.014 3.084 ( 0.000 -6.213 0.000) 6.213 3.084 ( 0.000 6.213 0.000) 6.213 3.463 ( 0.000 -23.285 0.000) 23.285 3.463 ( 0.000 23.285 0.000) 23.285 3.689 ( 0.000 -4.832 0.000) 4.832 3.689 ( 0.000 4.832 0.000) 4.832 4.029 ( 0.000 -14.921 0.000) 14.921 4.029 ( 0.000 14.921 0.000) 14.921 4.953 ( 0.000 -7.668 0.000) 7.668 4.953 ( 0.000 7.668 0.000) 7.668 5.095 ( 0.000 -5.477 0.000) 5.477 5.095 ( 0.000 5.477 0.000) 5.477 5.412 ( 0.000 -17.102 0.000) 17.102 5.412 ( 0.000 17.102 0.000) 17.102 5.800 ( 0.000 -2.593 0.000) 2.593 5.800 ( 0.000 2.593 0.000) 2.593 6.073 ( 0.000 -10.790 0.000) 10.790 6.073 ( 0.000 10.790 0.000) 10.790 6.260 ( 0.000 -3.843 0.000) 3.843 6.260 ( 0.000 3.843 0.000) 3.843 6.702 ( 0.000 -1.897 0.000) 1.897 6.702 ( 0.000 1.897 0.000) 1.897 7.238 ( 0.000 -13.449 0.000) 13.449 7.238 ( 0.000 13.449 0.000) 13.449 7.661 ( 0.000 -2.520 0.000) 2.520 7.661 ( 0.000 2.520 0.000) 2.520 7.850 ( 0.000 -3.835 0.000) 3.835 7.850 ( 0.000 3.835 0.000) 3.835 8.366 ( 0.000 -3.167 0.000) 3.167 8.366 ( 0.000 3.167 0.000) 3.167 8.552 ( 0.000 -1.405 0.000) 1.405 8.552 ( 0.000 1.405 0.000) 1.405 8.718 ( 0.000 -1.847 0.000) 1.847 8.718 ( 0.000 1.847 0.000) 1.847 8.734 ( 0.000 -6.446 0.000) 6.446 8.734 ( 0.000 6.446 0.000) 6.446 9.146 ( 0.000 -3.942 0.000) 3.942 9.146 ( 0.000 3.942 0.000) 3.942 9.312 ( 0.000 -1.208 0.000) 1.208 9.312 ( 0.000 1.208 0.000) 1.208 9.456 ( 0.000 -2.868 0.000) 2.868 9.456 ( 0.000 2.868 0.000) 2.868 9.517 ( 0.000 -1.916 0.000) 1.916 9.517 ( 0.000 1.916 0.000) 1.916 9.940 ( 0.000 -6.294 0.000) 6.294 9.940 ( 0.000 6.294 0.000) 6.294 10.409 ( 0.000 -5.571 0.000) 5.571 10.409 ( 0.000 5.571 0.000) 5.571 10.466 ( 0.000 -12.859 0.000) 12.859 10.466 ( 0.000 12.859 0.000) 12.859 10.679 ( 0.000 -8.871 0.000) 8.871 10.679 ( 0.000 8.871 0.000) 8.871 10.985 ( 0.000 -9.377 0.000) 9.377 10.985 ( 0.000 9.377 0.000) 9.377 11.388 ( 0.000 -2.194 0.000) 2.194 11.388 ( 0.000 2.194 0.000) 2.194 11.687 ( 0.000 -2.650 0.000) 2.650 11.687 ( 0.000 2.650 0.000) 2.650 11.812 ( 0.000 -2.003 0.000) 2.003 11.812 ( 0.000 2.003 0.000) 2.003 12.266 ( 0.000 -4.803 0.000) 4.803 12.266 ( 0.000 4.803 0.000) 4.803 12.469 ( 0.000 -5.561 0.000) 5.561 12.469 ( 0.000 5.561 0.000) 5.561 13.162 ( 0.000 -5.050 0.000) 5.050 13.162 ( 0.000 5.050 0.000) 5.050 13.712 ( 0.000 -13.045 0.000) 13.045 13.712 ( 0.000 13.045 0.000) 13.045 13.819 ( 0.000 -0.017 0.000) 0.017 13.819 ( 0.000 0.017 0.000) 0.017 14.259 ( 0.000 -18.413 0.000) 18.413 14.259 ( 0.000 18.413 0.000) 18.413 14.815 ( 0.000 -8.258 0.000) 8.258 14.815 ( 0.000 8.258 0.000) 8.258 15.107 ( 0.000 -8.844 0.000) 8.844 15.107 ( 0.000 8.844 0.000) 8.844 15.843 ( 0.000 -10.519 0.000) 10.519 15.843 ( 0.000 10.519 0.000) 10.519 16.099 ( 0.000 -8.124 0.000) 8.124 16.099 ( 0.000 8.124 0.000) 8.124 16.363 ( 0.000 -8.456 0.000) 8.456 16.363 ( 0.000 8.456 0.000) 8.456 17.103 ( 0.000 -3.911 0.000) 3.911 17.103 ( 0.000 3.911 0.000) 3.911 19.003 ( 0.000 -12.826 0.000) 12.826 19.003 ( 0.000 12.826 0.000) 12.826 19.452 ( 0.000 -1.302 0.000) 1.302 19.452 ( 0.000 1.302 0.000) 1.302 22.568 ( 0.000 -3.880 0.000) 3.880 22.568 ( 0.000 3.880 0.000) 3.880 22.824 ( 0.000 -3.873 0.000) 3.873 22.824 ( 0.000 3.873 0.000) 3.873 25.046 ( 0.000 -1.077 0.000) 1.077 25.046 ( 0.000 1.077 0.000) 1.077 25.514 ( 0.000 -1.064 0.000) 1.064 25.514 ( 0.000 1.064 0.000) 1.064 25.787 ( 0.000 -5.294 0.000) 5.294 25.787 ( 0.000 5.294 0.000) 5.294 28.037 ( 0.000 -15.078 0.000) 15.078 28.037 ( 0.000 15.078 0.000) 15.078 28.681 ( 0.000 -3.858 0.000) 3.858 28.681 ( 0.000 3.858 0.000) 3.858 29.176 ( 0.000 -3.367 0.000) 3.367 29.176 ( 0.000 3.367 0.000) 3.367 29.581 ( 0.000 -0.753 0.000) 0.753 29.581 ( 0.000 0.753 0.000) 0.753 29.666 ( 0.000 -3.897 0.000) 3.897 29.666 ( 0.000 3.897 0.000) 3.897 30.023 ( 0.000 -4.486 0.000) 4.486 30.023 ( 0.000 4.486 0.000) 4.486 30.904 ( 0.000 -13.221 0.000) 13.221 30.904 ( 0.000 13.221 0.000) 13.221 31.508 ( 0.000 -7.642 0.000) 7.642 31.508 ( 0.000 7.642 0.000) 7.642 33.653 ( 0.000 -11.940 0.000) 11.940 33.653 ( 0.000 11.940 0.000) 11.940 ======================= Grid point 17 (11/104) ======================= q-point: ( 0.20 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.142 ( 9.840 -8.714 -2.088) 13.309 2.142 ( 9.840 8.714 -2.088) 13.309 2.674 ( 15.881 -28.310 -1.979) 32.520 2.674 ( 15.881 28.310 -1.979) 32.520 3.032 ( -4.632 -4.762 0.261) 6.648 3.032 ( -4.632 4.762 0.261) 6.648 3.445 ( -2.837 -13.528 1.944) 13.959 3.445 ( -2.837 13.528 1.944) 13.959 3.690 ( 2.971 -14.465 -2.884) 15.046 3.690 ( 2.971 14.465 -2.884) 15.046 4.101 ( 6.141 -17.499 -4.766) 19.147 4.101 ( 6.141 17.499 -4.766) 19.147 4.729 ( -12.589 -5.444 9.866) 16.896 4.729 ( -12.589 5.444 9.866) 16.896 5.305 ( 3.973 -5.390 6.706) 9.477 5.305 ( 3.973 5.390 6.706) 9.477 5.474 ( 6.522 -9.405 -2.720) 11.763 5.474 ( 6.522 9.405 -2.720) 11.763 5.689 ( -13.111 -6.612 -1.327) 14.744 5.689 ( -13.111 6.612 -1.327) 14.744 5.952 ( 4.497 -7.911 -2.260) 9.376 5.952 ( 4.497 7.911 -2.260) 9.376 6.384 ( 4.638 -5.177 -1.946) 7.218 6.384 ( 4.638 5.177 -1.946) 7.218 6.854 ( 10.885 -1.229 3.402) 11.470 6.854 ( 10.885 1.229 3.402) 11.470 7.191 ( -3.610 -6.600 -1.742) 7.722 7.191 ( -3.610 6.600 -1.742) 7.722 7.586 ( -6.619 -1.331 2.491) 7.197 7.586 ( -6.619 1.331 2.491) 7.197 7.827 ( -2.787 -4.290 -3.637) 6.277 7.827 ( -2.787 4.290 -3.637) 6.277 8.316 ( -2.957 -3.940 -5.208) 7.168 8.316 ( -2.957 3.940 -5.208) 7.168 8.550 ( 1.111 -5.980 -0.954) 6.157 8.550 ( 1.111 5.980 -0.954) 6.157 8.681 ( -1.682 -3.084 -1.448) 3.800 8.681 ( -1.682 3.084 -1.448) 3.800 8.753 ( -1.400 -2.302 8.009) 8.450 8.753 ( -1.400 2.302 8.009) 8.450 9.102 ( -2.385 -5.065 1.031) 5.693 9.102 ( -2.385 5.065 1.031) 5.693 9.317 ( -0.474 -3.530 1.415) 3.832 9.317 ( -0.474 3.530 1.415) 3.832 9.450 ( -0.607 -2.357 1.256) 2.739 9.450 ( -0.607 2.357 1.256) 2.739 9.609 ( 7.689 -2.096 -1.749) 8.159 9.609 ( 7.689 2.096 -1.749) 8.159 10.026 ( 5.912 -3.923 3.773) 8.036 10.026 ( 5.912 3.923 3.773) 8.036 10.359 ( -3.205 -3.735 -1.670) 5.197 10.359 ( -3.205 3.735 -1.670) 5.197 10.490 ( 2.771 -6.711 -7.663) 10.556 10.490 ( 2.771 6.711 -7.663) 10.556 10.682 ( -0.214 -8.490 2.302) 8.799 10.682 ( -0.214 8.490 2.302) 8.799 10.993 ( 0.804 -7.866 -2.044) 8.167 10.993 ( 0.804 7.866 -2.044) 8.167 11.333 ( -5.752 -2.428 2.707) 6.805 11.333 ( -5.752 2.428 2.707) 6.805 11.622 ( -4.839 -1.701 1.793) 5.434 11.622 ( -4.839 1.701 1.793) 5.434 11.885 ( 3.666 -2.887 0.481) 4.691 11.885 ( 3.666 2.887 0.481) 4.691 12.133 ( -7.923 -7.385 7.087) 12.944 12.133 ( -7.923 7.385 7.087) 12.944 12.557 ( 6.942 -12.213 -6.634) 15.535 12.557 ( 6.942 12.213 -6.634) 15.535 13.215 ( 4.142 -4.977 -4.510) 7.891 13.215 ( 4.142 4.977 -4.510) 7.891 13.642 ( -8.536 -12.070 12.279) 19.218 13.642 ( -8.536 12.070 12.279) 19.218 13.849 ( -3.792 -5.192 2.784) 7.006 13.849 ( -3.792 5.192 2.784) 7.006 13.984 ( -7.179 -9.868 -23.770) 26.720 13.984 ( -7.179 9.868 -23.770) 26.720 14.862 ( 3.733 -8.002 -2.058) 9.067 14.862 ( 3.733 8.002 -2.058) 9.067 15.110 ( -1.492 -8.442 0.274) 8.577 15.110 ( -1.492 8.442 0.274) 8.577 15.788 ( -8.828 -5.204 3.427) 10.805 15.788 ( -8.828 5.204 3.427) 10.805 16.167 ( 5.828 -11.004 4.977) 13.410 16.167 ( 5.828 11.004 4.977) 13.410 16.325 ( 0.586 -4.711 -4.237) 6.363 16.325 ( 0.586 4.711 -4.237) 6.363 17.192 ( 3.675 -2.852 8.127) 9.364 17.192 ( 3.675 2.852 8.127) 9.364 18.776 ( -13.545 -11.740 -3.621) 18.287 18.776 ( -13.545 11.740 -3.621) 18.287 19.624 ( 10.249 -3.586 1.503) 10.962 19.624 ( 10.249 3.586 1.503) 10.962 22.563 ( -0.347 -3.195 0.039) 3.214 22.563 ( -0.347 3.195 0.039) 3.214 22.822 ( -0.160 -3.214 0.223) 3.226 22.822 ( -0.160 3.214 0.223) 3.226 24.997 ( -2.887 -0.393 0.265) 2.926 24.997 ( -2.887 0.393 0.265) 2.926 25.454 ( -1.554 -1.099 -1.494) 2.420 25.454 ( -1.554 1.099 -1.494) 2.420 26.259 ( 32.989 -6.251 4.766) 33.913 26.259 ( 32.989 6.251 4.766) 33.913 27.962 ( -7.108 -14.846 -1.252) 16.507 27.962 ( -7.108 14.846 -1.252) 16.507 28.664 ( -1.592 -3.467 0.928) 3.927 28.664 ( -1.592 3.467 0.928) 3.927 29.089 ( -5.530 -2.830 -1.039) 6.298 29.089 ( -5.530 2.830 -1.039) 6.298 29.586 ( 0.525 -0.248 -1.609) 1.710 29.586 ( 0.525 0.248 -1.609) 1.710 29.739 ( 3.493 -2.679 3.131) 5.402 29.739 ( 3.493 2.679 3.131) 5.402 30.105 ( 7.563 -6.969 0.110) 10.285 30.105 ( 7.563 6.969 0.110) 10.285 30.899 ( -0.816 -12.420 1.152) 12.500 30.899 ( -0.816 12.420 1.152) 12.500 31.536 ( 2.521 -6.533 0.808) 7.049 31.536 ( 2.521 6.533 0.808) 7.049 33.439 ( -16.472 -6.172 -4.731) 18.216 33.439 ( -16.472 6.172 -4.731) 18.216 ======================= Grid point 19 (12/104) ======================= q-point: ( 0.40 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( 8.361 -4.400 0.161) 9.450 2.356 ( 8.361 4.400 0.161) 9.450 2.852 ( -3.309 -6.180 -5.590) 8.966 2.852 ( -3.309 6.180 -5.590) 8.966 3.032 ( 7.081 -15.719 2.768) 17.461 3.032 ( 7.081 15.719 2.768) 17.461 3.385 ( -1.875 -11.894 -0.203) 12.043 3.385 ( -1.875 11.894 -0.203) 12.043 3.802 ( 5.377 -4.346 1.051) 6.993 3.802 ( 5.377 4.346 1.051) 6.993 4.205 ( 5.418 -14.736 -5.495) 16.635 4.205 ( 5.418 14.736 -5.495) 16.635 4.579 ( -4.800 -2.560 6.306) 8.328 4.579 ( -4.800 2.560 6.306) 8.328 5.101 ( -15.028 -5.483 2.725) 16.227 5.101 ( -15.028 5.483 2.725) 16.227 5.573 ( 2.167 -3.925 2.215) 5.000 5.573 ( 2.167 3.925 2.215) 5.000 5.639 ( 3.532 -0.636 -1.752) 3.994 5.639 ( 3.532 0.636 -1.752) 3.994 6.117 ( 7.880 -13.507 -2.455) 15.829 6.117 ( 7.880 13.507 -2.455) 15.829 6.437 ( 1.170 -8.035 -0.617) 8.143 6.437 ( 1.170 8.035 -0.617) 8.143 7.033 ( 0.772 -3.580 2.392) 4.375 7.033 ( 0.772 3.580 2.392) 4.375 7.147 ( 2.811 -2.995 0.304) 4.118 7.147 ( 2.811 2.995 0.304) 4.118 7.461 ( -4.795 -3.617 2.975) 6.703 7.461 ( -4.795 3.617 2.975) 6.703 7.679 ( -6.000 -8.455 -6.218) 12.089 7.679 ( -6.000 8.455 -6.218) 12.089 8.268 ( -0.655 -6.824 0.131) 6.856 8.268 ( -0.655 6.824 0.131) 6.856 8.579 ( 3.333 -3.408 -4.798) 6.764 8.579 ( 3.333 3.408 -4.798) 6.764 8.687 ( -0.177 -2.149 1.079) 2.412 8.687 ( -0.177 2.149 1.079) 2.412 8.715 ( -2.118 -3.218 1.708) 4.215 8.715 ( -2.118 3.218 1.708) 4.215 9.087 ( -1.410 -1.281 5.591) 5.906 9.087 ( -1.410 1.281 5.591) 5.906 9.302 ( -0.298 -6.092 -0.983) 6.178 9.302 ( -0.298 6.092 -0.983) 6.178 9.444 ( -0.582 -2.904 1.282) 3.227 9.444 ( -0.582 2.904 1.282) 3.227 9.757 ( 5.098 -2.957 -1.895) 6.190 9.757 ( 5.098 2.957 -1.895) 6.190 10.171 ( 3.535 -6.378 7.241) 10.276 10.171 ( 3.535 6.378 7.241) 10.276 10.309 ( 1.470 -0.553 -2.588) 3.027 10.309 ( 1.470 0.553 -2.588) 3.027 10.446 ( -4.011 -6.074 -8.309) 11.046 10.446 ( -4.011 6.074 -8.309) 11.046 10.713 ( 1.721 -4.450 2.018) 5.181 10.713 ( 1.721 4.450 2.018) 5.181 10.976 ( -1.818 -1.675 -0.001) 2.472 10.976 ( -1.818 1.675 -0.001) 2.472 11.218 ( -3.148 -0.689 -0.801) 3.321 11.218 ( -3.148 0.689 -0.801) 3.321 11.548 ( -2.283 -1.209 1.383) 2.931 11.548 ( -2.283 1.209 1.383) 2.931 11.864 ( -3.412 -2.950 3.396) 5.646 11.864 ( -3.412 2.950 3.396) 5.646 12.143 ( 3.371 -4.119 0.431) 5.340 12.143 ( 3.371 4.119 0.431) 5.340 12.667 ( 4.622 -10.868 -2.855) 12.150 12.667 ( 4.622 10.868 -2.855) 12.150 13.202 ( -3.954 -4.732 -3.020) 6.866 13.202 ( -3.954 4.732 -3.020) 6.866 13.485 ( -5.645 -4.998 6.512) 9.962 13.485 ( -5.645 4.998 6.512) 9.962 13.702 ( -1.890 -10.709 -4.106) 11.624 13.702 ( -1.890 10.709 -4.106) 11.624 13.973 ( 2.746 -5.576 -5.302) 8.170 13.973 ( 2.746 5.576 -5.302) 8.170 14.926 ( 2.139 -3.986 -2.301) 5.076 14.926 ( 2.139 3.986 -2.301) 5.076 15.074 ( -0.496 -11.770 0.830) 11.810 15.074 ( -0.496 11.770 0.830) 11.810 15.578 ( -7.987 -2.270 0.946) 8.358 15.578 ( -7.987 2.270 0.946) 8.358 16.272 ( 1.836 -1.706 -0.562) 2.568 16.272 ( 1.836 1.706 -0.562) 2.568 16.391 ( 3.627 -5.109 2.330) 6.684 16.391 ( 3.627 5.109 2.330) 6.684 17.262 ( 0.356 -2.914 3.841) 4.835 17.262 ( 0.356 2.914 3.841) 4.835 18.547 ( -5.446 -5.543 -1.836) 7.984 18.547 ( -5.446 5.543 -1.836) 7.984 19.796 ( 4.398 -2.815 0.546) 5.250 19.796 ( 4.398 2.815 0.546) 5.250 22.557 ( -0.186 -1.325 0.027) 1.338 22.557 ( -0.186 1.325 0.027) 1.338 22.821 ( -0.067 -1.423 0.123) 1.430 22.821 ( -0.067 1.423 0.123) 1.430 24.956 ( -0.960 -0.471 0.182) 1.084 24.956 ( -0.960 0.471 0.182) 1.084 25.433 ( -0.257 -0.526 -0.553) 0.806 25.433 ( -0.257 0.526 -0.553) 0.806 26.963 ( 25.947 -12.645 3.128) 29.033 26.963 ( 25.947 12.645 3.128) 29.033 27.716 ( -13.825 -13.900 -1.619) 19.671 27.716 ( -13.825 13.900 -1.619) 19.671 28.637 ( -0.906 -2.053 0.436) 2.286 28.637 ( -0.906 2.053 0.436) 2.286 28.998 ( -2.208 -2.640 -0.344) 3.459 28.998 ( -2.208 2.640 -0.344) 3.459 29.588 ( 0.168 -0.162 -0.544) 0.591 29.588 ( 0.168 0.162 -0.544) 0.591 29.791 ( 0.747 -0.689 0.976) 1.409 29.791 ( 0.747 0.689 0.976) 1.409 30.274 ( 5.591 -6.987 0.260) 8.952 30.274 ( 5.591 6.987 0.260) 8.952 30.881 ( -0.976 -6.459 0.737) 6.574 30.881 ( -0.976 6.459 0.737) 6.574 31.611 ( 3.001 -3.761 1.028) 4.921 31.611 ( 3.001 3.761 1.028) 4.921 33.080 ( -10.941 -2.069 -3.242) 11.597 33.080 ( -10.941 2.069 -3.242) 11.597 ======================= Grid point 35 (13/104) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.763 ( 21.691 0.000 44.677) 49.665 0.795 ( 5.032 0.000 42.035) 42.335 1.386 ( -13.153 0.000 73.498) 74.665 2.364 ( 0.547 0.000 0.404) 0.680 2.648 ( -19.338 0.000 57.118) 60.303 3.376 ( -5.128 0.000 33.832) 34.218 3.500 ( -3.609 0.000 35.288) 35.472 3.563 ( -0.705 0.000 7.078) 7.113 3.661 ( -0.437 0.000 5.021) 5.040 3.959 ( -6.408 0.000 27.760) 28.490 4.246 ( -4.423 0.000 25.373) 25.756 4.577 ( 9.937 0.000 3.585) 10.564 4.692 ( 6.789 0.000 4.419) 8.101 4.933 ( -6.296 0.000 -2.835) 6.905 4.952 ( 9.451 0.000 8.841) 12.941 5.023 ( -21.986 0.000 5.737) 22.723 5.278 ( -5.461 0.000 0.092) 5.462 5.375 ( -5.967 0.000 4.603) 7.536 5.653 ( 4.305 0.000 -1.635) 4.605 6.113 ( -5.392 0.000 -18.080) 18.867 6.306 ( 8.959 0.000 9.280) 12.899 6.431 ( -0.498 0.000 -0.911) 1.039 6.663 ( 10.516 0.000 -1.638) 10.643 6.708 ( 1.458 0.000 1.509) 2.099 7.025 ( -8.608 0.000 1.306) 8.707 7.162 ( -7.954 0.000 -2.079) 8.221 7.201 ( 2.423 0.000 -5.234) 5.768 7.317 ( -0.988 0.000 -7.889) 7.950 7.512 ( -0.462 0.000 1.510) 1.580 7.655 ( -6.851 0.000 -9.696) 11.872 7.769 ( 2.553 0.000 -8.687) 9.055 8.111 ( -1.177 0.000 1.150) 1.646 8.201 ( 3.144 0.000 -6.994) 7.668 8.201 ( 2.948 0.000 -6.445) 7.087 8.344 ( 6.833 0.000 -19.594) 20.752 8.432 ( -2.559 0.000 2.907) 3.873 8.519 ( 1.029 0.000 2.158) 2.391 8.651 ( -2.738 0.000 -16.772) 16.994 8.714 ( 10.586 0.000 -6.598) 12.474 8.871 ( -1.809 0.000 -0.384) 1.850 8.883 ( 8.465 0.000 -4.358) 9.521 9.014 ( 5.866 0.000 2.174) 6.256 9.185 ( -5.169 0.000 -0.615) 5.205 9.210 ( 7.733 0.000 -5.991) 9.782 9.273 ( 2.852 0.000 14.944) 15.214 9.418 ( 7.765 0.000 4.243) 8.849 9.616 ( -3.053 0.000 8.218) 8.767 9.778 ( 3.779 0.000 1.323) 4.003 9.842 ( -0.776 0.000 16.107) 16.126 10.004 ( 1.291 0.000 -4.628) 4.805 10.221 ( 2.942 0.000 4.488) 5.367 10.401 ( 0.035 0.000 -3.015) 3.015 10.481 ( 4.879 0.000 -8.566) 9.858 10.720 ( 0.031 0.000 -5.197) 5.197 10.775 ( -0.383 0.000 -7.691) 7.700 10.862 ( 2.217 0.000 -8.849) 9.123 10.992 ( -2.714 0.000 0.754) 2.817 11.033 ( 1.710 0.000 -5.444) 5.706 11.172 ( -0.151 0.000 -0.773) 0.787 11.332 ( -5.818 0.000 3.482) 6.780 11.393 ( -9.098 0.000 3.672) 9.811 11.613 ( 3.864 0.000 3.351) 5.114 11.754 ( -2.830 0.000 0.664) 2.907 11.876 ( -4.073 0.000 2.095) 4.580 12.217 ( 2.861 0.000 1.935) 3.454 12.265 ( 5.445 0.000 -0.509) 5.469 12.578 ( -2.358 0.000 5.327) 5.825 12.777 ( 16.228 0.000 -8.174) 18.171 12.886 ( -0.508 0.000 5.559) 5.582 13.174 ( 0.709 0.000 0.872) 1.124 13.215 ( -15.329 0.000 2.166) 15.481 13.770 ( -2.121 0.000 16.667) 16.801 13.943 ( -2.624 0.000 -0.825) 2.750 13.996 ( 0.912 0.000 1.394) 1.665 14.195 ( -6.216 0.000 1.160) 6.324 14.338 ( 0.842 0.000 -6.244) 6.300 14.793 ( 0.517 0.000 -0.449) 0.685 15.046 ( 0.213 0.000 -5.593) 5.597 15.263 ( -0.743 0.000 -3.740) 3.813 15.434 ( -6.024 0.000 -0.086) 6.025 15.760 ( 9.712 0.000 6.264) 11.557 15.885 ( -2.409 0.000 12.022) 12.261 16.006 ( 0.752 0.000 5.449) 5.501 16.154 ( -52.811 0.000 -0.900) 52.819 16.564 ( -17.136 0.000 5.774) 18.082 16.692 ( 2.235 0.000 -12.890) 13.082 17.093 ( 3.486 0.000 -10.717) 11.270 17.245 ( -17.880 0.000 -2.318) 18.030 19.172 ( 17.707 0.000 -0.757) 17.723 19.270 ( 16.363 0.000 -3.294) 16.692 19.493 ( -3.224 0.000 2.611) 4.149 19.677 ( 7.437 0.000 1.995) 7.700 22.318 ( 1.841 0.000 -10.923) 11.077 22.498 ( 6.621 0.000 -17.128) 18.363 22.582 ( -0.717 0.000 -11.443) 11.465 22.798 ( 4.173 0.000 -15.305) 15.863 25.019 ( -1.917 0.000 6.796) 7.061 25.075 ( -0.956 0.000 7.500) 7.561 25.439 ( -1.859 0.000 7.771) 7.990 25.502 ( -1.271 0.000 4.892) 5.054 25.696 ( 35.469 0.000 -1.589) 35.505 26.030 ( 2.857 0.000 -6.073) 6.712 27.481 ( -0.938 0.000 -2.960) 3.105 28.331 ( 0.234 0.000 0.779) 0.813 28.426 ( 7.061 0.000 -24.289) 25.294 28.701 ( -0.745 0.000 3.844) 3.916 29.094 ( 0.515 0.000 -7.069) 7.088 29.273 ( 0.193 0.000 -14.231) 14.232 29.356 ( -4.911 0.000 3.980) 6.321 29.661 ( 2.952 0.000 2.564) 3.910 29.819 ( -3.893 0.000 19.382) 19.769 29.948 ( 5.176 0.000 10.419) 11.634 30.056 ( 8.436 0.000 17.981) 19.862 30.257 ( 1.028 0.000 10.038) 10.091 30.908 ( -1.767 0.000 7.773) 7.971 31.235 ( 0.503 0.000 -0.060) 0.507 31.507 ( -0.934 0.000 7.277) 7.337 31.969 ( 0.026 0.000 -4.389) 4.389 32.837 ( -20.697 0.000 -5.961) 21.538 33.136 ( -11.405 0.000 -8.686) 14.336 ======================= Grid point 36 (14/104) ======================= q-point: ( 0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.440 ( 30.184 0.000 30.892) 43.190 1.572 ( 20.612 0.000 48.638) 52.825 2.150 ( 48.283 0.000 35.588) 59.981 2.399 ( 0.733 0.000 1.581) 1.742 2.536 ( -13.294 0.000 48.738) 50.518 3.428 ( -5.690 0.000 39.366) 39.775 3.548 ( -5.582 0.000 39.528) 39.920 3.555 ( -2.733 0.000 1.764) 3.253 3.651 ( -3.617 0.000 8.776) 9.492 3.829 ( -17.377 0.000 21.236) 27.440 4.266 ( -1.419 0.000 17.836) 17.892 4.644 ( -3.806 0.000 7.620) 8.517 4.673 ( -11.460 0.000 8.180) 14.080 4.826 ( 1.025 0.000 14.278) 14.314 4.918 ( -4.081 0.000 -7.054) 8.150 5.145 ( -13.934 0.000 13.095) 19.122 5.158 ( 5.517 0.000 -2.104) 5.905 5.313 ( 16.313 0.000 -0.712) 16.329 5.551 ( -7.956 0.000 -1.420) 8.082 5.873 ( -8.797 0.000 -15.175) 17.540 6.229 ( -31.017 0.000 8.770) 32.233 6.493 ( 6.458 0.000 -3.555) 7.372 6.665 ( 0.356 0.000 -8.221) 8.228 6.807 ( 4.535 0.000 5.848) 7.401 6.873 ( -1.280 0.000 -0.002) 1.280 7.146 ( 3.439 0.000 -4.977) 6.050 7.282 ( 5.240 0.000 -0.005) 5.241 7.414 ( 8.269 0.000 -4.414) 9.373 7.476 ( 2.294 0.000 -10.229) 10.483 7.595 ( 4.211 0.000 1.080) 4.347 7.798 ( 5.928 0.000 -15.343) 16.448 7.997 ( -7.940 0.000 -1.537) 8.087 8.196 ( -2.127 0.000 -0.312) 2.150 8.207 ( 1.423 0.000 -8.834) 8.948 8.298 ( 0.688 0.000 -11.367) 11.388 8.431 ( 2.183 0.000 -3.473) 4.102 8.554 ( -1.204 0.000 -5.511) 5.641 8.581 ( 2.391 0.000 0.532) 2.450 8.771 ( 1.464 0.000 -9.746) 9.856 8.791 ( -2.510 0.000 -4.023) 4.742 9.066 ( -2.874 0.000 -2.741) 3.971 9.105 ( 0.881 0.000 5.255) 5.328 9.246 ( 0.790 0.000 -8.730) 8.766 9.279 ( 0.700 0.000 -5.036) 5.084 9.339 ( 10.873 0.000 19.866) 22.646 9.518 ( -10.589 0.000 10.468) 14.890 9.849 ( 21.048 0.000 -0.578) 21.055 9.905 ( 1.833 0.000 11.184) 11.333 9.913 ( 3.105 0.000 -0.625) 3.167 9.986 ( 2.327 0.000 -0.774) 2.452 10.347 ( 6.961 0.000 -0.762) 7.003 10.384 ( -0.565 0.000 1.618) 1.714 10.569 ( -4.955 0.000 -12.715) 13.647 10.662 ( 8.106 0.000 -21.538) 23.013 10.763 ( 2.736 0.000 -8.492) 8.921 10.776 ( -7.804 0.000 -6.614) 10.230 10.917 ( -3.133 0.000 -1.975) 3.704 11.049 ( -0.211 0.000 -1.080) 1.100 11.157 ( 0.699 0.000 -7.211) 7.245 11.238 ( -5.862 0.000 4.540) 7.414 11.254 ( -1.338 0.000 -1.762) 2.212 11.719 ( 3.790 0.000 3.417) 5.103 11.779 ( 0.823 0.000 -1.867) 2.040 11.840 ( 4.357 0.000 -1.354) 4.563 12.327 ( -5.742 0.000 2.272) 6.175 12.346 ( 10.163 0.000 -11.148) 15.085 12.544 ( -3.039 0.000 6.087) 6.803 12.771 ( -5.962 0.000 5.893) 8.383 12.905 ( 0.071 0.000 3.123) 3.124 13.116 ( -6.111 0.000 1.656) 6.331 13.287 ( 16.352 0.000 -7.571) 18.020 13.726 ( -12.081 0.000 28.984) 31.401 13.920 ( 2.276 0.000 -5.473) 5.927 13.983 ( -6.304 0.000 -0.639) 6.336 14.062 ( -0.491 0.000 7.302) 7.319 14.359 ( 3.800 0.000 -6.146) 7.226 14.689 ( -53.016 0.000 62.915) 82.274 14.791 ( -0.053 0.000 -0.722) 0.724 15.024 ( -0.528 0.000 -2.976) 3.022 15.193 ( -3.513 0.000 -4.585) 5.776 15.460 ( 3.750 0.000 6.143) 7.197 15.884 ( -2.432 0.000 9.736) 10.035 16.021 ( -2.042 0.000 7.208) 7.491 16.115 ( 11.785 0.000 8.572) 14.573 16.376 ( -5.797 0.000 -4.849) 7.558 16.697 ( 3.934 0.000 -13.982) 14.525 16.766 ( -25.839 0.000 -0.783) 25.851 17.111 ( 2.269 0.000 -9.506) 9.773 18.979 ( -10.227 0.000 -10.142) 14.403 19.274 ( -7.919 0.000 11.923) 14.313 19.534 ( 6.320 0.000 0.444) 6.336 19.807 ( 7.419 0.000 -2.838) 7.943 22.317 ( 2.719 0.000 -10.964) 11.296 22.502 ( -0.138 0.000 -13.704) 13.705 22.574 ( 6.283 0.000 -15.658) 16.871 22.801 ( 2.425 0.000 -14.340) 14.543 25.006 ( -1.764 0.000 5.037) 5.337 25.077 ( -1.966 0.000 7.708) 7.954 25.455 ( -0.530 0.000 9.571) 9.586 25.497 ( -1.273 0.000 4.960) 5.121 26.215 ( 16.919 0.000 -6.273) 18.045 27.134 ( 57.718 0.000 -50.716) 76.834 27.354 ( -8.759 0.000 -5.081) 10.126 28.377 ( 3.411 0.000 1.306) 3.652 28.433 ( 4.147 0.000 -27.155) 27.470 28.670 ( -3.580 0.000 2.950) 4.639 29.053 ( -0.702 0.000 -7.506) 7.538 29.214 ( 1.701 0.000 -17.094) 17.178 29.309 ( -0.088 0.000 -0.214) 0.231 29.708 ( -0.694 0.000 6.748) 6.784 29.790 ( -4.543 0.000 15.341) 16.000 29.966 ( -3.278 0.000 12.798) 13.211 30.271 ( 0.180 0.000 30.814) 30.815 30.604 ( 5.867 0.000 20.089) 20.928 30.905 ( -1.701 0.000 7.369) 7.563 31.260 ( 1.540 0.000 0.057) 1.541 31.523 ( -0.807 0.000 7.346) 7.390 31.922 ( -2.108 0.000 -4.247) 4.741 32.137 ( -19.320 0.000 12.416) 22.965 32.865 ( -9.630 0.000 -15.609) 18.341 ======================= Grid point 37 (15/104) ======================= q-point: ( 0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( 22.001 0.000 19.540) 29.426 2.181 ( 5.802 0.000 43.371) 43.757 2.309 ( -12.581 0.000 2.354) 12.799 2.395 ( -5.679 0.000 32.180) 32.678 3.044 ( 9.297 0.000 25.750) 27.377 3.359 ( -13.993 0.000 39.089) 41.518 3.408 ( -7.664 0.000 -4.907) 9.101 3.521 ( -11.320 0.000 24.179) 26.698 3.671 ( 1.037 0.000 13.173) 13.213 3.994 ( 22.505 0.000 29.153) 36.829 4.370 ( 4.710 0.000 9.114) 10.259 4.510 ( -7.052 0.000 13.811) 15.507 4.516 ( -12.913 0.000 -14.303) 19.269 4.690 ( -17.878 0.000 16.466) 24.306 4.783 ( 5.876 0.000 9.032) 10.775 5.134 ( -9.281 0.000 10.001) 13.643 5.233 ( -4.381 0.000 7.900) 9.033 5.349 ( -25.507 0.000 4.727) 25.941 5.396 ( 3.880 0.000 0.338) 3.894 5.695 ( 3.013 0.000 -6.422) 7.094 5.922 ( 14.970 0.000 5.643) 15.999 6.476 ( -18.299 0.000 3.872) 18.704 6.625 ( 6.378 0.000 -4.999) 8.103 6.711 ( 5.871 0.000 -9.787) 11.413 7.013 ( -5.102 0.000 -14.980) 15.825 7.251 ( 13.165 0.000 7.544) 15.173 7.354 ( 0.630 0.000 -2.235) 2.322 7.509 ( 3.416 0.000 -7.383) 8.134 7.584 ( 2.367 0.000 2.978) 3.804 7.700 ( 5.650 0.000 -2.238) 6.077 7.811 ( -3.298 0.000 -4.444) 5.534 7.957 ( 8.128 0.000 -2.329) 8.456 8.151 ( -0.113 0.000 -0.970) 0.977 8.223 ( 4.182 0.000 -9.926) 10.771 8.272 ( 2.199 0.000 -11.552) 11.759 8.420 ( -0.819 0.000 -8.289) 8.329 8.479 ( -2.313 0.000 -5.307) 5.789 8.648 ( 2.211 0.000 1.596) 2.727 8.770 ( 2.155 0.000 -5.481) 5.889 8.788 ( 2.875 0.000 -5.084) 5.841 9.003 ( -3.587 0.000 -0.320) 3.601 9.128 ( -0.346 0.000 3.477) 3.494 9.142 ( -3.578 0.000 -7.661) 8.456 9.196 ( -7.941 0.000 6.350) 10.168 9.332 ( -7.448 0.000 6.894) 10.149 9.619 ( 3.195 0.000 25.851) 26.048 9.844 ( -3.197 0.000 -5.787) 6.611 9.967 ( 3.503 0.000 2.628) 4.380 10.051 ( -1.285 0.000 0.149) 1.294 10.200 ( -11.618 0.000 -13.912) 18.125 10.351 ( -1.298 0.000 -0.461) 1.377 10.368 ( 11.126 0.000 -4.448) 11.982 10.473 ( -7.530 0.000 -3.349) 8.241 10.514 ( 4.330 0.000 -1.167) 4.485 10.773 ( 2.843 0.000 -7.801) 8.303 10.780 ( 7.495 0.000 -18.858) 20.293 10.929 ( 4.698 0.000 -0.173) 4.701 11.007 ( -3.627 0.000 3.666) 5.157 11.135 ( 0.904 0.000 -8.542) 8.590 11.224 ( 4.213 0.000 -2.189) 4.748 11.273 ( 5.283 0.000 -8.396) 9.920 11.743 ( -0.368 0.000 -3.144) 3.165 11.787 ( -0.319 0.000 6.265) 6.273 12.027 ( 10.522 0.000 -2.889) 10.912 12.062 ( -12.974 0.000 2.804) 13.274 12.461 ( -3.328 0.000 -2.026) 3.897 12.496 ( 2.402 0.000 -2.902) 3.767 12.767 ( -4.253 0.000 1.977) 4.690 12.929 ( 1.667 0.000 1.535) 2.266 12.974 ( -4.042 0.000 5.154) 6.550 13.587 ( 13.036 0.000 -3.600) 13.524 13.625 ( -8.482 0.000 30.085) 31.258 13.823 ( -6.983 0.000 9.925) 12.135 13.971 ( 4.452 0.000 -9.764) 10.731 14.193 ( -5.482 0.000 39.340) 39.720 14.269 ( -4.664 0.000 15.769) 16.444 14.414 ( 2.406 0.000 -4.411) 5.024 14.813 ( 2.563 0.000 0.028) 2.563 14.968 ( -3.841 0.000 -2.223) 4.438 15.134 ( 1.023 0.000 -2.939) 3.112 15.675 ( 11.742 0.000 6.657) 13.498 15.876 ( -1.639 0.000 6.810) 7.004 15.987 ( -4.401 0.000 9.195) 10.194 16.170 ( -9.729 0.000 -8.534) 12.941 16.214 ( -19.735 0.000 2.755) 19.926 16.391 ( 6.558 0.000 6.429) 9.183 16.724 ( 4.271 0.000 -14.185) 14.814 17.100 ( 1.037 0.000 -10.255) 10.307 18.733 ( -7.703 0.000 -12.291) 14.505 19.206 ( -3.821 0.000 13.948) 14.462 19.692 ( 6.323 0.000 -4.306) 7.650 19.894 ( 2.307 0.000 -6.388) 6.792 22.335 ( 3.862 0.000 -11.592) 12.219 22.435 ( -0.444 0.000 -12.122) 12.130 22.642 ( 6.877 0.000 -17.341) 18.655 22.772 ( 0.976 0.000 -13.888) 13.922 24.991 ( -1.445 0.000 4.105) 4.352 25.073 ( -1.697 0.000 8.018) 8.196 25.488 ( -1.092 0.000 7.747) 7.824 25.492 ( -1.339 0.000 8.259) 8.367 26.599 ( 18.662 0.000 -7.527) 20.123 27.084 ( -12.165 0.000 -6.744) 13.909 27.751 ( 24.083 0.000 -36.129) 43.420 28.352 ( 1.477 0.000 -32.337) 32.370 28.474 ( 4.672 0.000 1.894) 5.042 28.581 ( -5.514 0.000 1.741) 5.783 29.014 ( 0.741 0.000 -8.153) 8.186 29.183 ( 2.234 0.000 -15.225) 15.388 29.349 ( 4.244 0.000 -2.770) 5.068 29.688 ( -4.741 0.000 9.713) 10.808 29.765 ( -3.719 0.000 12.312) 12.861 29.959 ( -2.603 0.000 11.819) 12.103 30.376 ( -11.682 0.000 42.210) 43.796 30.568 ( -9.046 0.000 38.031) 39.092 30.903 ( -1.503 0.000 7.110) 7.268 31.286 ( 0.722 0.000 -0.776) 1.060 31.531 ( -1.668 0.000 6.477) 6.688 31.872 ( -0.339 0.000 -2.570) 2.592 32.210 ( 14.030 0.000 -8.926) 16.628 32.576 ( -7.166 0.000 -16.642) 18.119 ======================= Grid point 38 (16/104) ======================= q-point: (-0.40 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.836 ( -32.389 0.000 5.673) 32.882 1.837 ( -34.612 0.000 25.629) 43.067 2.451 ( 1.373 0.000 5.229) 5.406 2.686 ( -9.769 0.000 41.947) 43.070 3.041 ( -5.697 0.000 20.335) 21.117 3.348 ( 4.034 0.000 1.499) 4.304 3.421 ( -7.650 0.000 19.137) 20.610 3.521 ( 4.575 0.000 35.247) 35.542 3.653 ( -51.317 0.000 37.321) 63.453 3.748 ( -1.371 0.000 9.795) 9.890 4.263 ( -1.074 0.000 -13.184) 13.227 4.320 ( 1.646 0.000 15.199) 15.287 4.490 ( -10.107 0.000 15.008) 18.094 4.769 ( -4.156 0.000 8.433) 9.401 5.013 ( 1.636 0.000 14.084) 14.179 5.060 ( 12.166 0.000 10.553) 16.105 5.271 ( -8.063 0.000 -2.963) 8.591 5.276 ( 21.565 0.000 0.089) 21.565 5.442 ( 15.751 0.000 8.195) 17.755 5.931 ( 13.480 0.000 0.288) 13.483 6.084 ( -20.822 0.000 9.659) 22.953 6.363 ( 19.588 0.000 0.004) 19.588 6.660 ( -2.065 0.000 -3.295) 3.889 6.714 ( -3.422 0.000 -4.406) 5.579 6.844 ( -4.888 0.000 -6.742) 8.327 7.319 ( -0.669 0.000 -7.616) 7.645 7.433 ( 1.052 0.000 3.513) 3.668 7.554 ( 4.761 0.000 -14.270) 15.043 7.631 ( 1.590 0.000 4.970) 5.218 7.723 ( -2.674 0.000 -1.991) 3.334 7.749 ( -1.285 0.000 0.063) 1.286 8.001 ( -3.284 0.000 9.471) 10.024 8.211 ( 0.179 0.000 -10.541) 10.543 8.268 ( 3.427 0.000 -6.093) 6.991 8.331 ( 4.927 0.000 -12.695) 13.617 8.355 ( 3.773 0.000 -12.416) 12.977 8.470 ( 4.511 0.000 -5.603) 7.193 8.691 ( 1.777 0.000 1.610) 2.398 8.804 ( 2.268 0.000 -6.248) 6.647 8.810 ( 2.261 0.000 -2.270) 3.203 8.920 ( -3.567 0.000 7.917) 8.683 9.011 ( -9.376 0.000 9.209) 13.142 9.066 ( 0.876 0.000 -10.052) 10.090 9.114 ( -3.474 0.000 -4.001) 5.299 9.374 ( 7.390 0.000 5.749) 9.363 9.674 ( -7.912 0.000 15.706) 17.586 9.800 ( 2.501 0.000 -3.653) 4.427 9.846 ( -11.313 0.000 -15.351) 19.070 9.936 ( -9.800 0.000 -1.497) 9.914 9.944 ( -6.004 0.000 -6.431) 8.798 10.248 ( 6.035 0.000 -3.853) 7.160 10.334 ( -0.686 0.000 0.250) 0.730 10.448 ( -5.773 0.000 -5.031) 7.657 10.763 ( 8.656 0.000 -13.165) 15.756 10.846 ( 2.940 0.000 -3.155) 4.312 10.875 ( 8.858 0.000 -1.102) 8.926 10.933 ( -3.882 0.000 -0.168) 3.886 11.007 ( 1.462 0.000 1.383) 2.013 11.137 ( 1.745 0.000 -2.736) 3.245 11.360 ( 8.901 0.000 -9.385) 12.935 11.397 ( 8.537 0.000 -7.527) 11.381 11.723 ( -7.078 0.000 11.136) 13.194 11.731 ( 0.195 0.000 -2.176) 2.185 12.001 ( 6.001 0.000 -1.328) 6.146 12.203 ( 2.808 0.000 -0.608) 2.873 12.338 ( -6.126 0.000 10.560) 12.208 12.470 ( -1.659 0.000 -7.862) 8.035 12.562 ( -10.273 0.000 -1.604) 10.397 12.976 ( -0.304 0.000 3.620) 3.633 13.016 ( 3.489 0.000 2.077) 4.061 13.619 ( -3.742 0.000 27.542) 27.795 13.761 ( 0.163 0.000 4.686) 4.688 13.808 ( 2.165 0.000 0.900) 2.344 13.979 ( 1.791 0.000 -11.005) 11.149 14.165 ( -0.943 0.000 15.564) 15.593 14.406 ( -0.734 0.000 -3.741) 3.812 14.589 ( 13.627 0.000 61.153) 62.653 14.819 ( -2.977 0.000 0.135) 2.980 14.959 ( 5.024 0.000 -2.074) 5.435 15.190 ( 4.200 0.000 -2.309) 4.793 15.675 ( -12.474 0.000 4.801) 13.366 15.888 ( 0.626 0.000 4.419) 4.464 15.915 ( -8.182 0.000 -11.675) 14.256 15.930 ( -4.985 0.000 11.387) 12.430 16.245 ( 18.084 0.000 3.067) 18.343 16.525 ( 3.408 0.000 7.190) 7.957 16.738 ( 2.627 0.000 -13.118) 13.379 17.074 ( 1.645 0.000 -12.060) 12.172 18.536 ( -5.092 0.000 -16.086) 16.873 19.234 ( 1.112 0.000 10.891) 10.948 19.699 ( -4.325 0.000 -2.966) 5.244 19.855 ( -2.409 0.000 -8.852) 9.174 22.375 ( 3.642 0.000 -12.852) 13.358 22.379 ( 1.643 0.000 -11.640) 11.755 22.701 ( 4.443 0.000 -15.284) 15.916 22.725 ( 2.156 0.000 -15.470) 15.620 24.990 ( -0.459 0.000 5.135) 5.156 25.072 ( -1.882 0.000 7.875) 8.097 25.477 ( -2.289 0.000 7.065) 7.427 25.509 ( -1.444 0.000 8.260) 8.385 26.559 ( -16.203 0.000 -10.035) 19.059 27.116 ( 15.315 0.000 -5.067) 16.132 27.835 ( -3.359 0.000 -39.883) 40.024 28.289 ( 9.242 0.000 -33.630) 34.877 28.463 ( -5.622 0.000 0.662) 5.661 28.583 ( 4.127 0.000 2.953) 5.075 29.020 ( 3.290 0.000 -7.573) 8.257 29.176 ( 2.966 0.000 -11.240) 11.624 29.449 ( 5.946 0.000 -2.856) 6.596 29.599 ( -7.533 0.000 10.061) 12.569 29.741 ( -3.321 0.000 9.991) 10.528 29.963 ( -2.396 0.000 12.892) 13.113 30.190 ( -16.639 0.000 35.028) 38.778 30.639 ( -6.437 0.000 28.966) 29.672 30.905 ( -1.421 0.000 7.335) 7.472 31.276 ( -1.028 0.000 -1.537) 1.849 31.513 ( -2.306 0.000 6.199) 6.614 31.896 ( 3.047 0.000 -1.850) 3.564 32.253 ( 0.890 0.000 1.409) 1.667 32.687 ( 16.663 0.000 -11.011) 19.973 ======================= Grid point 39 (17/104) ======================= q-point: (-0.20 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.100 ( -37.157 0.000 18.096) 41.329 1.129 ( -40.606 0.000 20.479) 45.478 1.956 ( -58.190 0.000 35.540) 68.184 2.399 ( -3.565 0.000 -0.674) 3.628 2.831 ( -22.825 0.000 59.791) 63.999 3.351 ( -6.517 0.000 31.230) 31.903 3.406 ( -2.826 0.000 32.510) 32.633 3.490 ( 4.880 0.000 6.414) 8.059 3.690 ( -4.609 0.000 4.386) 6.362 3.844 ( 5.042 0.000 35.056) 35.417 4.283 ( -9.976 0.000 12.569) 16.046 4.348 ( 10.271 0.000 -5.193) 11.509 4.472 ( 7.399 0.000 9.979) 12.423 4.801 ( 1.556 0.000 15.549) 15.627 5.100 ( -7.672 0.000 0.485) 7.688 5.277 ( 13.742 0.000 9.556) 16.738 5.286 ( 3.629 0.000 7.323) 8.173 5.425 ( 0.556 0.000 -7.311) 7.332 5.544 ( -17.677 0.000 4.631) 18.273 6.156 ( 22.936 0.000 4.899) 23.454 6.170 ( 8.511 0.000 -10.785) 13.739 6.442 ( -8.275 0.000 0.160) 8.277 6.530 ( -7.740 0.000 0.993) 7.803 6.629 ( -0.345 0.000 1.552) 1.590 6.980 ( 15.451 0.000 1.588) 15.532 7.243 ( -2.482 0.000 -8.256) 8.621 7.347 ( -10.402 0.000 4.983) 11.534 7.488 ( -6.012 0.000 -11.236) 12.744 7.589 ( -6.700 0.000 -1.536) 6.874 7.703 ( 2.640 0.000 -0.670) 2.724 7.754 ( 1.546 0.000 -3.377) 3.714 8.035 ( 4.472 0.000 1.252) 4.643 8.174 ( 1.243 0.000 -9.340) 9.423 8.209 ( -0.615 0.000 -7.760) 7.784 8.299 ( -0.536 0.000 -14.242) 14.253 8.438 ( 2.820 0.000 -3.099) 4.190 8.514 ( -0.351 0.000 1.689) 1.725 8.744 ( 2.725 0.000 -5.520) 6.156 8.779 ( -0.564 0.000 -9.214) 9.231 8.896 ( 1.790 0.000 -11.526) 11.664 8.909 ( -1.550 0.000 7.192) 7.357 8.964 ( -0.556 0.000 10.868) 10.883 9.050 ( 5.238 0.000 -1.978) 5.599 9.076 ( 3.070 0.000 -10.219) 10.670 9.460 ( -12.395 0.000 -16.397) 20.555 9.501 ( -11.845 0.000 -1.299) 11.916 9.573 ( 5.607 0.000 8.081) 9.835 9.785 ( -3.863 0.000 -8.405) 9.251 9.825 ( -5.527 0.000 18.902) 19.694 9.915 ( 7.087 0.000 -0.734) 7.125 10.243 ( -5.646 0.000 0.245) 5.651 10.396 ( 1.514 0.000 -3.045) 3.401 10.418 ( 8.630 0.000 -8.792) 12.320 10.767 ( -2.009 0.000 -7.185) 7.461 10.831 ( -1.503 0.000 -5.366) 5.573 10.856 ( 0.869 0.000 -10.282) 10.319 11.012 ( 4.172 0.000 -6.931) 8.090 11.018 ( -0.356 0.000 0.587) 0.686 11.165 ( 0.445 0.000 2.346) 2.388 11.449 ( -3.982 0.000 1.699) 4.329 11.464 ( 4.037 0.000 -5.783) 7.053 11.622 ( -7.738 0.000 11.277) 13.676 11.753 ( 2.686 0.000 -1.540) 3.096 12.071 ( -10.842 0.000 -3.045) 11.262 12.174 ( 7.126 0.000 -5.648) 9.093 12.228 ( -7.006 0.000 10.932) 12.985 12.476 ( 7.881 0.000 -4.530) 9.090 12.539 ( 5.235 0.000 1.248) 5.381 12.919 ( -5.916 0.000 9.480) 11.175 13.108 ( 4.333 0.000 -0.082) 4.334 13.577 ( -16.011 0.000 2.844) 16.262 13.711 ( 0.903 0.000 15.341) 15.368 13.904 ( 6.158 0.000 1.262) 6.286 13.991 ( 0.071 0.000 -2.411) 2.412 14.236 ( 0.475 0.000 7.034) 7.050 14.367 ( -0.907 0.000 -4.731) 4.817 14.782 ( -0.072 0.000 -0.205) 0.218 15.042 ( 2.832 0.000 -3.614) 4.592 15.256 ( 2.753 0.000 -3.420) 4.391 15.552 ( 8.289 0.000 7.699) 11.312 15.575 ( 6.517 0.000 17.956) 19.103 15.833 ( 44.929 0.000 70.850) 83.895 15.889 ( -3.212 0.000 11.203) 11.655 15.946 ( 1.993 0.000 5.746) 6.082 16.494 ( 2.205 0.000 -1.615) 2.733 16.716 ( 1.145 0.000 -12.425) 12.478 16.778 ( 16.850 0.000 13.396) 21.527 17.071 ( 3.274 0.000 -12.344) 12.770 18.355 ( -3.768 0.000 -14.087) 14.583 19.325 ( 1.633 0.000 3.618) 3.969 19.550 ( -5.485 0.000 3.179) 6.340 19.705 ( -7.620 0.000 -9.152) 11.909 22.338 ( 1.025 0.000 -11.259) 11.306 22.434 ( 6.088 0.000 -14.685) 15.897 22.651 ( -0.506 0.000 -12.584) 12.595 22.765 ( 5.673 0.000 -16.630) 17.571 25.013 ( -0.365 0.000 6.978) 6.988 25.066 ( -1.725 0.000 7.279) 7.481 25.456 ( -2.703 0.000 7.573) 8.041 25.508 ( -1.539 0.000 5.785) 5.986 26.177 ( -12.695 0.000 -8.475) 15.264 27.048 ( -47.994 0.000 -73.665) 87.921 27.417 ( 5.489 0.000 -3.997) 6.790 28.364 ( -3.469 0.000 0.429) 3.495 28.370 ( 9.240 0.000 -26.954) 28.494 28.667 ( 2.141 0.000 3.802) 4.363 29.077 ( 4.326 0.000 -7.833) 8.948 29.227 ( 5.859 0.000 -4.875) 7.622 29.468 ( -7.671 0.000 8.162) 11.201 29.568 ( 5.205 0.000 -1.214) 5.344 29.719 ( -1.756 0.000 7.725) 7.922 29.959 ( -5.293 0.000 14.422) 15.363 30.037 ( -9.802 0.000 25.607) 27.419 30.430 ( -16.202 0.000 2.183) 16.348 30.908 ( -1.577 0.000 7.763) 7.922 31.244 ( -1.028 0.000 -1.009) 1.440 31.501 ( -1.551 0.000 6.758) 6.934 31.954 ( 2.829 0.000 -3.141) 4.227 32.642 ( 27.937 0.000 30.126) 41.086 32.940 ( 10.989 0.000 -9.759) 14.696 ======================= Grid point 40 (18/104) ======================= q-point: ( 0.00 0.17 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.065 ( 0.288 36.491 21.982) 42.602 1.300 ( 2.108 36.589 31.418) 48.273 1.894 ( -3.340 44.081 52.707) 68.792 2.496 ( -0.235 12.200 2.513) 12.459 2.750 ( -17.306 9.159 53.996) 57.436 3.415 ( -6.225 4.172 30.861) 31.758 3.519 ( -4.314 1.679 31.218) 31.559 3.644 ( -1.087 1.989 7.964) 8.281 3.653 ( 0.036 3.288 10.685) 11.179 3.950 ( -5.889 -0.838 20.929) 21.758 4.293 ( -1.985 2.657 22.520) 22.762 4.416 ( -0.492 -23.104 6.943) 24.130 4.648 ( 2.876 5.973 5.717) 8.754 4.924 ( -12.330 -0.673 -0.386) 12.355 4.932 ( 9.665 0.535 6.099) 11.441 5.101 ( 3.032 3.368 -0.443) 4.553 5.378 ( -6.357 2.950 -1.034) 7.084 5.535 ( -4.935 13.263 -6.423) 15.541 5.699 ( 1.509 5.293 -1.470) 5.697 6.035 ( -7.336 -7.205 -12.298) 16.030 6.250 ( 8.340 -6.100 9.722) 14.188 6.385 ( -0.324 -4.708 0.066) 4.719 6.527 ( 3.724 -11.839 -0.785) 12.436 6.679 ( 2.974 -4.691 6.247) 8.359 6.898 ( -1.525 -8.255 3.546) 9.113 7.071 ( -7.666 -8.656 0.235) 11.565 7.099 ( 1.777 -7.546 0.436) 7.765 7.364 ( -8.732 0.357 -8.784) 12.391 7.529 ( 5.083 4.757 -1.247) 7.073 7.646 ( 1.382 0.615 -1.989) 2.499 7.860 ( -1.393 6.838 -10.587) 12.680 8.074 ( -3.685 -6.999 -3.272) 8.560 8.180 ( 2.278 0.801 -8.826) 9.150 8.272 ( 6.854 -2.852 -12.396) 14.449 8.319 ( 1.762 7.257 -9.347) 11.964 8.398 ( -3.838 -6.903 -2.794) 8.378 8.549 ( 4.721 1.413 -5.575) 7.441 8.637 ( -0.581 1.827 2.714) 3.323 8.731 ( -2.386 6.242 -12.826) 14.462 8.812 ( 9.572 -0.557 -0.393) 9.596 8.975 ( 2.745 1.386 -3.224) 4.455 9.113 ( 2.129 5.495 -8.171) 10.075 9.177 ( 3.590 1.659 -2.634) 4.752 9.257 ( 3.586 3.120 1.363) 4.945 9.279 ( -1.201 1.575 7.690) 7.941 9.421 ( 2.299 0.999 2.336) 3.427 9.588 ( -3.534 -2.760 8.843) 9.915 9.646 ( 1.314 -7.041 1.510) 7.320 9.953 ( 3.005 0.296 7.104) 7.719 9.987 ( 1.074 1.240 -0.310) 1.669 10.303 ( 2.953 1.420 3.097) 4.509 10.421 ( 0.400 0.034 2.960) 2.987 10.457 ( 3.326 -1.928 -6.640) 7.672 10.669 ( -3.044 -5.193 -9.516) 11.260 10.762 ( 1.395 -1.478 -4.214) 4.678 10.818 ( -0.654 -2.225 -7.683) 8.026 10.981 ( 0.399 -5.456 1.016) 5.564 11.094 ( -2.024 5.835 -9.605) 11.419 11.226 ( -1.128 3.928 -7.304) 8.370 11.307 ( -2.950 3.909 3.383) 5.952 11.504 ( -2.763 5.326 -0.954) 6.075 11.691 ( 3.887 7.691 -1.066) 8.683 11.766 ( -0.655 1.118 1.032) 1.657 11.876 ( -3.516 0.353 3.017) 4.646 12.150 ( 1.379 -8.562 5.711) 10.384 12.242 ( 0.218 2.587 2.979) 3.951 12.532 ( 11.284 -3.633 -4.505) 12.682 12.861 ( -6.041 0.115 12.733) 14.094 12.972 ( 10.954 13.049 -10.127) 19.820 13.110 ( -1.961 -3.850 8.428) 9.471 13.230 ( -15.272 1.839 2.785) 15.632 13.706 ( -2.618 -5.058 6.319) 8.506 13.837 ( 0.928 -7.940 -3.172) 8.601 13.991 ( -1.646 -2.543 -3.774) 4.840 14.156 ( -6.111 -0.618 5.171) 8.029 14.441 ( -0.099 7.350 -3.136) 7.992 14.853 ( 1.172 5.588 1.566) 5.920 15.038 ( 1.055 -1.918 -0.923) 2.376 15.295 ( 0.637 4.525 -4.140) 6.166 15.377 ( -6.692 -5.067 4.127) 9.354 15.590 ( -29.062 -24.467 25.190) 45.582 15.809 ( 12.755 1.589 5.426) 13.952 15.970 ( -4.271 7.042 10.208) 13.116 16.368 ( -19.039 9.276 -10.667) 23.713 16.443 ( -15.229 -11.454 1.495) 19.114 16.581 ( 0.725 -6.929 -1.827) 7.202 17.022 ( 7.225 -3.095 -6.147) 9.978 17.177 ( 16.355 -5.139 2.194) 17.283 18.805 ( 21.478 -14.931 19.330) 32.526 19.201 ( -7.937 -3.003 -6.720) 10.825 19.484 ( -3.636 -0.808 1.636) 4.068 19.604 ( 7.297 -4.594 1.379) 8.732 22.353 ( 1.626 2.369 -10.770) 11.147 22.516 ( 5.506 0.161 -16.973) 17.844 22.597 ( 0.470 1.807 -11.065) 11.221 22.788 ( 3.958 -1.144 -14.723) 15.289 25.079 ( -1.634 0.888 7.013) 7.256 25.108 ( -3.008 3.216 4.838) 6.542 25.500 ( -7.779 2.432 3.631) 8.923 25.521 ( -4.753 2.772 3.637) 6.596 25.705 ( 28.096 0.804 0.090) 28.108 25.980 ( 3.259 -4.891 -5.158) 7.820 27.497 ( 0.676 4.368 -5.493) 7.051 28.330 ( 3.010 -7.400 -19.190) 20.786 28.414 ( 2.314 6.237 -1.405) 6.799 28.732 ( 0.452 1.882 3.201) 3.741 29.085 ( 0.264 -0.886 -7.034) 7.094 29.238 ( -0.992 -3.244 -12.392) 12.848 29.390 ( -2.355 2.961 2.151) 4.352 29.586 ( 5.685 -3.684 4.855) 8.334 29.838 ( -5.639 1.792 18.886) 19.791 29.967 ( -3.753 -0.214 16.051) 16.486 30.155 ( 2.177 4.725 18.069) 18.803 30.279 ( 3.979 2.922 6.161) 7.895 30.733 ( -5.363 -8.553 20.003) 22.406 31.213 ( 1.463 -2.239 0.267) 2.688 31.407 ( -1.852 -0.861 10.804) 10.995 31.870 ( -0.160 -9.302 -3.097) 9.805 33.058 ( -1.261 10.354 -16.038) 19.131 33.462 ( -10.324 17.193 -30.505) 36.507 ======================= Grid point 41 (19/104) ======================= q-point: ( 0.20 0.17 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.536 ( 22.908 16.486 26.701) 38.852 1.823 ( 25.278 20.901 36.474) 49.052 2.446 ( 21.560 21.626 21.571) 37.387 2.582 ( 13.936 22.122 11.541) 28.580 2.655 ( -13.360 11.460 47.684) 50.829 3.417 ( -7.712 0.015 34.454) 35.307 3.548 ( -6.851 -1.345 36.899) 37.554 3.598 ( -5.965 0.372 4.622) 7.555 3.688 ( -1.538 4.955 13.113) 14.102 3.858 ( -9.795 2.118 13.279) 16.636 4.334 ( -5.266 -0.543 7.386) 9.087 4.376 ( -3.251 -17.637 12.987) 22.143 4.522 ( -7.233 -6.314 3.022) 10.066 4.804 ( -4.885 1.412 13.537) 14.461 5.106 ( -5.245 10.654 -1.492) 11.969 5.205 ( -1.820 7.775 9.067) 12.082 5.311 ( 7.245 7.154 2.075) 10.391 5.429 ( 6.219 11.952 -2.008) 13.622 5.582 ( -5.876 2.449 -2.073) 6.695 5.824 ( -9.199 -4.831 -9.540) 14.106 6.147 ( -23.456 -7.412 4.455) 24.999 6.422 ( 3.532 -7.285 -1.559) 8.245 6.645 ( 6.649 -14.761 7.789) 17.966 6.699 ( -2.722 2.867 -1.129) 4.111 6.925 ( -0.470 3.975 -1.396) 4.239 7.027 ( 1.501 -8.789 -1.934) 9.124 7.216 ( 4.061 -6.738 -1.100) 7.944 7.290 ( 11.859 -9.297 -0.484) 15.077 7.596 ( 0.145 2.348 -0.784) 2.479 7.624 ( 0.964 8.146 -6.023) 10.176 7.800 ( 1.356 -0.879 -14.472) 14.562 7.954 ( -4.796 -4.666 -1.242) 6.806 8.190 ( 2.215 1.511 -9.329) 9.707 8.239 ( -3.085 1.450 -2.184) 4.048 8.300 ( 2.151 -1.423 -10.612) 10.921 8.411 ( 3.120 -2.600 -8.366) 9.300 8.575 ( -0.966 -0.767 0.058) 1.235 8.625 ( 0.615 3.323 2.325) 4.102 8.657 ( 1.164 6.420 -7.748) 10.130 8.927 ( -3.800 -1.642 -7.153) 8.265 9.066 ( 2.145 -0.542 -6.639) 6.997 9.151 ( 0.359 4.608 -1.662) 4.911 9.260 ( 3.382 2.720 -6.472) 7.792 9.280 ( -0.216 0.692 2.916) 3.005 9.336 ( 7.974 0.237 10.023) 12.810 9.471 ( -4.985 -4.513 6.891) 9.628 9.633 ( 9.010 -9.088 8.131) 15.162 9.743 ( 5.350 -9.233 3.154) 11.128 9.973 ( 0.891 0.016 -4.987) 5.066 10.103 ( 5.632 5.763 10.421) 13.173 10.348 ( 1.229 -1.928 -6.303) 6.704 10.490 ( -1.933 0.076 1.853) 2.679 10.529 ( 0.486 -1.587 -4.580) 4.872 10.551 ( 7.147 -6.437 -9.616) 13.601 10.693 ( -8.059 -6.988 -2.010) 10.854 10.772 ( 2.305 0.170 -10.086) 10.348 10.958 ( -6.182 3.400 -5.743) 9.097 10.990 ( -0.304 -4.172 -3.538) 5.479 11.146 ( -1.633 2.092 -4.021) 4.818 11.281 ( -1.068 8.050 -5.278) 9.685 11.427 ( -3.100 8.199 -0.708) 8.794 11.728 ( 1.200 0.485 1.360) 1.877 11.825 ( -3.270 2.467 1.184) 4.264 11.889 ( 9.673 7.074 -2.265) 12.196 12.177 ( -1.954 -10.653 3.899) 11.511 12.300 ( 5.071 -4.631 -2.031) 7.162 12.587 ( -12.302 1.275 7.139) 14.280 12.788 ( 3.036 -1.553 1.633) 3.781 12.967 ( -3.687 7.951 0.113) 8.765 13.066 ( -4.988 -1.945 8.453) 10.006 13.305 ( 15.741 2.889 -6.490) 17.270 13.639 ( -7.105 -6.855 12.580) 15.991 13.852 ( 2.042 -5.688 -5.717) 8.320 13.929 ( -1.290 -5.369 -4.760) 7.290 14.061 ( -3.137 -0.522 4.125) 5.208 14.427 ( -4.834 0.291 3.988) 6.273 14.686 ( -36.283 2.236 39.443) 53.639 14.853 ( -0.791 5.137 -0.701) 5.245 15.028 ( -2.357 -0.949 -0.425) 2.576 15.315 ( -3.658 10.443 0.798) 11.093 15.403 ( 5.449 -2.921 5.101) 8.015 15.933 ( -3.804 -0.115 7.657) 8.551 16.034 ( -4.044 5.379 4.491) 8.090 16.130 ( 9.003 2.285 6.344) 11.248 16.363 ( -1.884 -2.413 -2.161) 3.747 16.539 ( -5.311 -5.096 -3.805) 8.286 16.990 ( -6.887 10.237 -8.835) 15.175 17.166 ( -3.273 6.229 -8.587) 11.102 18.937 ( -11.152 -4.501 -10.087) 15.696 19.034 ( -0.487 -19.951 14.209) 24.499 19.542 ( 6.811 0.917 0.260) 6.878 19.775 ( 7.667 -3.194 -2.362) 8.635 22.341 ( 2.315 2.333 -10.836) 11.324 22.500 ( 0.516 -0.347 -14.239) 14.253 22.600 ( 4.901 2.382 -14.008) 15.031 22.790 ( 2.361 -1.179 -13.836) 14.085 25.023 ( -3.066 1.531 5.043) 6.097 25.077 ( -2.395 0.031 7.514) 7.887 25.463 ( -0.792 0.766 8.856) 8.924 25.499 ( -1.579 0.168 4.819) 5.074 26.207 ( 19.091 -0.490 -5.174) 19.786 26.838 ( 53.705 -23.845 -25.720) 64.143 27.402 ( -6.345 5.945 -8.635) 12.255 28.269 ( -0.415 -10.361 -18.362) 21.088 28.470 ( 3.225 4.354 -2.855) 6.125 28.714 ( -3.133 2.575 1.178) 4.223 29.034 ( -1.333 -1.541 -6.191) 6.518 29.156 ( 0.058 -4.187 -12.745) 13.415 29.397 ( 2.651 6.796 -2.181) 7.614 29.686 ( -0.426 -1.980 9.364) 9.581 29.807 ( -4.208 1.797 14.548) 15.250 29.963 ( -2.587 -0.486 12.073) 12.357 30.262 ( -0.754 -0.769 29.124) 29.144 30.550 ( 3.010 -5.227 20.778) 21.636 30.768 ( 5.939 -5.609 11.614) 14.199 31.252 ( 0.476 -1.973 2.140) 2.949 31.425 ( -0.017 0.430 9.561) 9.571 31.832 ( -1.776 -8.133 -2.767) 8.773 32.693 ( -22.177 31.257 -16.626) 41.776 32.961 ( -11.906 9.621 -16.860) 22.773 ======================= Grid point 42 (20/104) ======================= q-point: ( 0.40 0.17 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.109 ( 15.427 6.508 23.676) 28.998 2.422 ( -0.984 14.312 10.660) 17.872 2.518 ( 11.505 18.091 23.277) 31.645 2.555 ( -15.185 17.248 33.953) 40.999 3.110 ( -0.638 5.892 23.054) 23.803 3.317 ( -9.433 -2.637 35.510) 36.836 3.467 ( -5.318 4.501 -0.278) 6.972 3.607 ( -6.658 7.822 20.223) 22.682 3.735 ( 1.259 4.854 13.447) 14.352 3.966 ( 16.816 -2.950 22.851) 28.524 4.225 ( -5.308 -16.688 0.759) 17.529 4.365 ( 1.732 -5.405 8.435) 10.167 4.495 ( -3.806 -1.146 2.134) 4.511 4.775 ( -16.252 4.525 14.187) 22.043 4.792 ( -2.034 3.376 9.441) 10.231 5.223 ( -11.438 7.784 9.396) 16.724 5.295 ( -13.891 -0.272 0.816) 13.918 5.429 ( -6.148 11.508 4.060) 13.664 5.570 ( -0.252 15.671 3.736) 16.112 5.707 ( 5.588 1.155 -1.654) 5.941 5.902 ( 10.745 -1.336 4.979) 11.918 6.383 ( -9.015 -10.510 4.272) 14.491 6.650 ( 0.163 2.802 -1.289) 3.089 6.688 ( 5.851 -0.880 -9.726) 11.384 6.908 ( -5.727 -9.210 -9.479) 14.404 7.181 ( 10.287 -5.930 5.966) 13.288 7.288 ( 2.247 -5.848 1.633) 6.475 7.488 ( 3.976 -13.066 -1.015) 13.696 7.566 ( -2.336 -5.478 -1.341) 6.104 7.637 ( 1.981 9.944 -6.330) 11.953 7.780 ( 1.146 -6.024 -1.233) 6.254 7.963 ( 5.078 -0.731 0.378) 5.145 8.177 ( 1.334 2.901 -1.127) 3.386 8.242 ( 4.536 1.965 -12.573) 13.510 8.290 ( 1.716 -0.346 -12.147) 12.272 8.406 ( 1.317 -0.461 -9.578) 9.679 8.553 ( -0.113 0.885 -0.196) 0.914 8.643 ( 0.236 -1.761 -1.238) 2.166 8.699 ( 3.026 5.950 -0.253) 6.680 8.789 ( -6.014 -7.844 -4.563) 10.887 9.014 ( -2.240 2.769 -5.435) 6.498 9.119 ( -0.690 4.976 -6.879) 8.518 9.202 ( -4.636 2.099 2.496) 5.668 9.232 ( -2.875 1.526 2.711) 4.236 9.392 ( -4.603 6.020 4.361) 8.743 9.547 ( 2.068 -4.739 14.986) 15.853 9.739 ( 0.166 -13.242 -2.435) 13.465 9.868 ( 3.364 -4.172 -3.689) 6.506 10.134 ( -8.994 0.412 -7.530) 11.737 10.181 ( 14.612 -2.347 3.408) 15.187 10.282 ( -1.849 1.364 1.286) 2.633 10.395 ( -5.234 -3.460 -5.913) 8.622 10.419 ( -3.103 1.015 -0.583) 3.316 10.641 ( -2.331 6.886 0.336) 7.277 10.670 ( 6.540 -8.835 -14.486) 18.185 10.760 ( 2.825 -0.899 -2.403) 3.816 10.891 ( 5.246 -3.396 0.757) 6.295 10.982 ( -0.900 -4.134 -1.832) 4.610 11.140 ( 4.074 1.851 -9.560) 10.555 11.249 ( 2.769 4.672 -6.463) 8.442 11.374 ( -1.335 6.324 -1.728) 6.691 11.729 ( -0.458 -1.895 -0.863) 2.132 11.790 ( -2.191 1.113 4.811) 5.402 12.046 ( -7.478 -0.431 0.059) 7.491 12.088 ( 5.527 3.927 0.096) 6.781 12.373 ( 1.943 -8.156 -9.307) 12.526 12.399 ( -5.135 -5.434 13.214) 15.182 12.823 ( -2.925 0.600 -4.138) 5.102 12.924 ( -1.001 3.889 2.466) 4.712 13.038 ( 1.138 5.448 3.513) 6.582 13.560 ( 5.105 -4.786 -2.015) 7.282 13.587 ( -1.109 -1.401 17.526) 17.617 13.827 ( 0.324 -0.123 1.892) 1.924 13.963 ( 4.888 -2.468 -7.754) 9.492 14.049 ( -6.519 -8.626 29.116) 31.059 14.206 ( -6.483 -5.598 12.619) 15.252 14.599 ( 3.047 12.738 5.239) 14.106 14.846 ( 0.551 3.332 1.058) 3.539 14.958 ( -2.501 -0.966 -2.026) 3.361 15.261 ( -1.327 10.001 1.774) 10.243 15.578 ( 7.292 -6.622 5.235) 11.154 15.826 ( -8.051 -9.899 3.589) 13.254 16.057 ( 4.014 13.634 6.780) 15.747 16.234 ( -16.892 5.140 -2.843) 17.884 16.272 ( -3.399 3.387 2.819) 5.565 16.375 ( 4.503 -0.925 5.205) 6.944 16.840 ( 0.424 10.971 -12.639) 16.742 17.115 ( 0.381 1.586 -9.642) 9.779 18.671 ( -8.675 -6.097 -11.510) 15.650 19.069 ( -0.855 -13.657 12.757) 18.708 19.693 ( 5.934 0.408 -3.801) 7.059 19.867 ( 2.329 -2.571 -5.687) 6.661 22.354 ( 3.647 1.881 -11.580) 12.285 22.442 ( -0.045 0.567 -12.509) 12.522 22.652 ( 6.040 1.001 -15.865) 17.005 22.764 ( 1.018 -0.937 -13.407) 13.478 24.995 ( -1.711 0.493 4.476) 4.817 25.066 ( -1.890 -0.711 7.860) 8.116 25.489 ( -1.099 0.133 7.038) 7.125 25.494 ( -1.178 0.126 8.310) 8.394 26.633 ( 19.695 3.671 -7.296) 21.321 27.129 ( -11.919 4.522 -6.544) 14.329 27.564 ( 25.720 -16.722 -29.177) 42.337 28.135 ( -2.732 -17.268 -24.010) 29.701 28.528 ( 3.002 2.918 -0.246) 4.193 28.627 ( -4.493 3.006 -0.553) 5.434 28.993 ( 0.081 -1.613 -5.133) 5.381 29.126 ( 1.875 -4.222 -10.482) 11.455 29.466 ( 4.624 8.415 -3.835) 10.339 29.672 ( -4.598 -1.313 10.038) 11.119 29.792 ( -2.639 2.868 10.920) 11.595 29.964 ( -2.390 0.230 11.275) 11.528 30.346 ( -7.716 -1.717 33.697) 34.611 30.555 ( -7.017 -0.902 31.563) 32.346 30.958 ( 2.491 2.633 8.160) 8.929 31.218 ( -2.912 -8.325 1.527) 8.951 31.495 ( 0.728 2.326 6.502) 6.944 31.785 ( -1.123 -6.559 -0.865) 6.710 32.448 ( 4.603 18.475 -12.830) 22.959 32.684 ( -4.604 9.068 -16.988) 19.799 ======================= Grid point 43 (21/104) ======================= q-point: (-0.40 0.17 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.024 ( -24.557 19.601 12.535) 33.829 2.043 ( -30.448 18.805 13.501) 38.249 2.585 ( 1.811 12.725 11.183) 17.037 2.790 ( -11.645 9.735 37.212) 40.188 3.120 ( 0.455 8.012 26.363) 27.557 3.374 ( -3.935 1.517 3.576) 5.529 3.474 ( -1.264 -1.435 33.676) 33.730 3.509 ( -5.192 8.092 10.108) 13.950 3.758 ( -31.142 10.096 28.287) 43.265 3.828 ( -9.657 4.710 15.442) 18.812 4.229 ( 4.828 -3.093 -8.824) 10.523 4.314 ( -1.617 -1.233 15.977) 16.106 4.492 ( 1.886 -18.101 12.571) 22.119 4.549 ( -11.357 5.734 10.235) 16.329 5.028 ( 2.516 1.933 9.220) 9.751 5.149 ( 17.670 -7.771 -3.412) 19.603 5.227 ( 2.557 8.686 8.045) 12.112 5.416 ( 2.653 7.720 -0.863) 8.209 5.541 ( 2.811 12.711 2.574) 13.270 5.930 ( 5.605 -0.742 5.572) 7.938 6.152 ( -2.288 -2.530 8.408) 9.074 6.267 ( 7.733 -1.530 3.256) 8.528 6.622 ( -3.180 -1.689 -2.299) 4.272 6.693 ( -9.959 -6.271 -3.939) 12.411 6.803 ( 7.608 1.264 -4.773) 9.069 7.232 ( -2.773 -10.390 -0.975) 10.798 7.425 ( 2.697 -4.768 7.526) 9.309 7.490 ( -1.582 -11.839 -3.452) 12.433 7.507 ( -0.709 -10.541 -3.547) 11.144 7.614 ( -0.904 5.283 -7.407) 9.142 7.845 ( 4.032 1.309 0.668) 4.292 8.024 ( -0.949 1.158 8.962) 9.086 8.230 ( -1.053 0.234 -11.364) 11.415 8.238 ( 0.808 2.234 -14.767) 14.957 8.302 ( 6.964 -3.028 -4.270) 8.712 8.413 ( 3.886 0.275 -11.818) 12.444 8.593 ( -1.785 1.996 -0.259) 2.690 8.630 ( 1.745 -4.818 0.644) 5.165 8.696 ( 2.962 -4.659 -2.304) 5.983 8.770 ( 4.075 7.846 -3.628) 9.557 8.930 ( -4.307 -1.782 -1.452) 4.882 9.043 ( -2.074 3.085 -5.826) 6.911 9.113 ( -3.880 3.701 2.558) 5.941 9.229 ( 0.931 6.223 -5.122) 8.114 9.377 ( 2.710 0.848 5.428) 6.126 9.582 ( -3.052 -6.575 1.950) 7.507 9.729 ( 1.722 -6.262 -3.668) 7.458 9.784 ( -10.058 -4.438 -6.450) 12.746 9.947 ( -6.567 -0.695 -6.480) 9.252 10.044 ( -8.049 5.457 1.558) 9.848 10.211 ( 0.123 1.510 -5.766) 5.962 10.412 ( 0.213 4.015 1.991) 4.487 10.469 ( -3.848 1.674 1.113) 4.342 10.726 ( 7.565 -9.475 -1.780) 12.255 10.733 ( 8.715 -2.761 -13.917) 16.651 10.843 ( 0.862 1.314 3.002) 3.389 10.921 ( -1.778 -0.805 -0.516) 2.019 11.040 ( 5.447 -4.391 5.346) 8.806 11.222 ( 4.215 6.696 -7.524) 10.918 11.349 ( 6.537 -1.191 -8.340) 10.663 11.385 ( 6.438 0.194 -4.139) 7.656 11.710 ( -4.309 -1.407 7.464) 8.732 11.732 ( -1.080 0.470 -0.101) 1.182 11.945 ( 1.103 -4.445 -1.250) 4.747 12.161 ( -1.821 -4.688 2.951) 5.831 12.321 ( -3.281 -5.368 -4.436) 7.698 12.374 ( -3.302 3.183 5.504) 7.164 12.721 ( -0.659 7.073 -4.544) 8.433 12.943 ( 0.943 0.379 1.343) 1.684 13.084 ( 0.033 5.187 4.746) 7.030 13.594 ( -0.778 -3.457 17.992) 18.337 13.657 ( 1.873 -5.734 -0.299) 6.040 13.896 ( -1.377 4.094 3.011) 5.265 13.920 ( -0.980 -5.997 -1.005) 6.159 14.177 ( 3.338 1.346 11.825) 12.361 14.268 ( 6.260 -8.426 17.868) 20.723 14.712 ( 4.253 8.743 22.814) 24.800 14.852 ( -1.648 2.277 2.624) 3.845 14.989 ( 6.941 1.986 0.364) 7.228 15.280 ( 2.224 7.551 -0.327) 7.878 15.639 ( -9.602 -4.779 6.336) 12.457 15.728 ( 1.100 -10.234 0.904) 10.332 15.871 ( -6.058 3.539 -3.219) 7.720 16.163 ( -4.503 13.808 4.904) 15.330 16.330 ( 10.597 5.330 4.957) 12.856 16.474 ( 1.920 -3.248 4.489) 5.864 16.845 ( 4.714 8.465 -12.612) 15.904 17.083 ( 1.548 1.178 -11.540) 11.703 18.466 ( -5.256 -5.845 -13.362) 15.502 19.138 ( 2.797 -10.021 9.548) 14.121 19.700 ( -4.134 0.270 -2.841) 5.023 19.829 ( -2.782 -2.481 -7.806) 8.650 22.390 ( 2.901 1.459 -12.787) 13.193 22.391 ( 2.631 1.291 -11.819) 12.177 22.702 ( 3.642 0.052 -14.095) 14.558 22.720 ( 2.471 -0.508 -15.081) 15.291 24.995 ( -0.385 0.465 5.408) 5.442 25.065 ( -1.649 -0.769 7.805) 8.015 25.484 ( -1.897 0.702 6.981) 7.268 25.512 ( -1.135 0.227 8.026) 8.109 26.576 ( -18.122 1.968 -10.367) 20.971 27.165 ( 14.912 4.670 -4.317) 16.211 27.574 ( -14.739 -22.941 -34.280) 43.803 28.105 ( 12.416 -14.171 -23.704) 30.280 28.524 ( -4.201 4.316 -0.516) 6.045 28.605 ( 3.397 1.619 0.807) 3.849 29.002 ( 3.081 -1.291 -4.775) 5.827 29.138 ( 3.209 -3.237 -7.774) 9.012 29.534 ( 2.601 4.744 -3.085) 6.228 29.592 ( -6.486 -0.527 7.936) 10.262 29.799 ( -0.826 5.876 9.516) 11.214 29.966 ( -2.548 0.261 12.912) 13.163 30.227 ( -13.827 3.593 29.212) 32.518 30.580 ( -6.295 -4.497 26.475) 27.582 30.916 ( -8.740 -0.588 5.372) 10.275 31.198 ( 0.057 -8.146 1.419) 8.269 31.459 ( -4.990 1.533 4.438) 6.852 31.806 ( 2.665 -7.227 -0.248) 7.707 32.572 ( 14.425 22.706 -3.963) 27.190 32.778 ( 15.282 8.073 -12.028) 21.057 ======================= Grid point 44 (22/104) ======================= q-point: (-0.20 0.17 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.440 ( -30.769 29.107 16.870) 45.591 1.495 ( -25.738 35.122 12.001) 45.167 2.268 ( -45.226 29.498 31.729) 62.628 2.549 ( -4.988 14.239 1.027) 15.123 2.898 ( -20.687 5.408 55.865) 59.817 3.410 ( -5.457 5.443 34.729) 35.574 3.451 ( -3.848 6.433 25.257) 26.346 3.580 ( 1.913 7.070 9.741) 12.187 3.618 ( -0.086 -4.801 11.217) 12.202 3.901 ( 1.335 3.577 22.775) 23.092 4.314 ( -10.214 1.285 14.602) 17.866 4.344 ( 2.786 -11.145 6.995) 13.450 4.441 ( 11.352 5.129 -1.148) 12.510 4.675 ( 8.110 -7.608 13.366) 17.387 5.119 ( -4.998 0.457 0.200) 5.023 5.218 ( -7.579 -1.620 2.667) 8.196 5.328 ( 14.990 2.504 1.979) 15.326 5.579 ( 2.587 13.567 -5.227) 14.767 5.597 ( -2.931 -0.561 1.004) 3.149 6.078 ( 14.871 -3.778 6.840) 16.799 6.217 ( 1.802 -2.395 -6.260) 6.940 6.327 ( -5.022 -8.598 1.238) 10.034 6.493 ( -7.133 -2.526 1.443) 7.703 6.578 ( 1.536 -3.413 6.515) 7.513 6.982 ( 7.767 -1.563 -0.844) 7.967 7.100 ( -8.742 -10.418 0.776) 13.623 7.315 ( -12.834 -11.809 5.976) 18.435 7.466 ( 1.175 3.969 -9.173) 10.063 7.529 ( 1.649 -6.378 -9.185) 11.303 7.560 ( -0.048 -4.305 5.549) 7.023 7.910 ( 1.620 7.480 -4.457) 8.856 8.084 ( 3.596 1.061 -0.333) 3.765 8.164 ( 2.522 -0.638 -12.501) 12.769 8.195 ( 1.958 1.538 -12.264) 12.514 8.343 ( -1.531 -4.946 -2.547) 5.770 8.457 ( 5.640 2.192 -11.528) 13.020 8.510 ( -5.056 -3.092 1.036) 6.016 8.635 ( -0.010 3.274 -0.363) 3.294 8.792 ( 1.906 2.335 -4.450) 5.375 8.845 ( 1.721 -1.045 -8.284) 8.525 8.904 ( 2.966 -4.565 -1.784) 5.729 9.025 ( 3.442 4.112 -3.600) 6.459 9.108 ( 2.966 5.715 6.275) 8.990 9.199 ( 0.122 8.477 -9.021) 12.380 9.411 ( -7.506 -3.548 -6.039) 10.267 9.487 ( -4.807 -1.598 1.969) 5.435 9.566 ( -1.427 -0.206 2.776) 3.128 9.688 ( -5.065 -5.123 -5.727) 9.203 9.869 ( 4.015 -1.979 1.341) 4.673 9.976 ( -2.139 5.244 5.929) 8.199 10.241 ( 1.655 -0.125 1.848) 2.484 10.409 ( 0.562 0.930 -2.361) 2.599 10.448 ( 1.047 2.134 -1.567) 2.847 10.740 ( 0.104 -3.495 -9.050) 9.702 10.757 ( -1.004 -2.755 -1.533) 3.309 10.850 ( 0.274 1.606 -6.938) 7.127 10.956 ( 2.363 -5.419 -0.081) 5.913 11.140 ( 1.729 -3.564 -2.272) 4.567 11.218 ( 1.517 11.247 -6.775) 13.217 11.393 ( -2.545 -3.264 2.330) 4.750 11.501 ( 3.506 2.426 -1.481) 4.513 11.662 ( -2.707 3.578 5.064) 6.765 11.755 ( 2.562 0.389 -2.313) 3.473 11.997 ( -1.925 -6.202 -2.778) 7.063 12.120 ( -1.207 -8.128 1.920) 8.439 12.247 ( 0.485 -0.672 -1.859) 2.035 12.316 ( 1.189 2.061 5.753) 6.226 12.803 ( 8.552 12.294 -7.538) 16.766 12.927 ( -5.247 1.763 11.066) 12.373 13.095 ( -0.059 0.660 4.864) 4.909 13.561 ( -12.973 -2.533 1.642) 13.320 13.690 ( 1.247 -2.384 9.456) 9.831 13.815 ( 1.347 -6.605 -3.348) 7.527 14.001 ( 1.907 0.524 2.959) 3.559 14.209 ( -1.820 -1.779 6.976) 7.426 14.439 ( 2.378 7.286 1.012) 7.730 14.826 ( -0.007 4.636 0.293) 4.645 14.981 ( 4.573 -5.505 8.193) 10.879 15.294 ( 3.595 5.431 -1.763) 6.747 15.369 ( 10.114 -14.047 24.664) 30.132 15.559 ( 4.404 -2.708 13.318) 14.286 15.662 ( 0.563 -5.974 4.198) 7.323 16.005 ( 1.911 5.323 13.943) 15.046 16.188 ( 20.260 12.554 22.385) 32.697 16.468 ( 1.293 -1.924 -6.416) 6.822 16.543 ( 3.189 -7.119 2.640) 8.235 16.892 ( 0.819 3.233 -11.839) 12.300 17.067 ( 0.684 -2.273 -13.044) 13.258 18.371 ( 4.386 4.414 -5.390) 8.232 19.260 ( 4.121 -6.920 2.998) 8.594 19.549 ( -6.632 0.093 2.011) 6.930 19.676 ( -8.069 -2.668 -7.343) 11.231 22.362 ( 1.637 2.086 -11.032) 11.347 22.448 ( 6.314 1.192 -14.591) 15.943 22.653 ( -0.292 0.273 -12.104) 12.111 22.758 ( 5.260 -0.762 -15.824) 16.693 25.030 ( 1.278 1.380 6.957) 7.207 25.069 ( -1.056 0.286 7.304) 7.385 25.476 ( -1.498 1.864 7.324) 7.705 25.519 ( -1.179 1.067 6.031) 6.237 26.146 ( -14.817 -2.860 -8.309) 17.227 26.672 ( -53.941 -28.554 -38.407) 72.111 27.418 ( 9.086 5.158 -5.750) 11.925 28.267 ( 10.544 -8.462 -20.518) 24.572 28.439 ( -3.107 6.107 -1.340) 6.982 28.681 ( 2.616 1.105 2.946) 4.092 29.067 ( 4.317 -0.915 -6.871) 8.166 29.204 ( 5.736 -2.400 -4.393) 7.614 29.474 ( -6.535 0.662 5.524) 8.582 29.540 ( -0.667 -1.216 -3.211) 3.497 29.839 ( -1.242 6.329 14.406) 15.784 29.971 ( -3.283 0.428 15.894) 16.235 30.103 ( -6.944 6.419 19.411) 21.592 30.414 ( -14.244 -1.730 5.251) 15.279 30.772 ( -6.776 -8.241 16.368) 19.538 31.200 ( -0.145 -3.844 0.241) 3.854 31.405 ( -2.483 -0.391 8.468) 8.833 31.859 ( 2.193 -8.829 -1.830) 9.279 33.017 ( 10.350 8.334 -12.505) 18.247 33.135 ( 35.247 25.904 -3.503) 43.882 ======================= Grid point 45 (23/104) ======================= q-point: ( 0.00 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.831 ( -3.189 42.387 12.164) 44.213 2.006 ( -6.207 36.537 26.846) 45.762 2.689 ( -2.041 27.395 19.754) 33.836 2.706 ( -7.532 9.267 34.024) 36.059 2.915 ( -3.204 11.765 26.247) 28.942 3.444 ( -5.140 -6.257 18.038) 19.772 3.458 ( -5.806 -9.422 23.351) 25.841 3.674 ( -7.310 6.478 19.570) 21.872 3.772 ( -0.969 3.300 7.274) 8.047 3.927 ( -1.064 0.124 12.682) 12.727 4.038 ( -8.988 -10.868 18.091) 22.939 4.246 ( -0.107 -9.335 7.025) 11.684 4.805 ( -0.859 10.247 5.717) 11.766 4.967 ( 11.591 3.063 5.158) 13.052 4.998 ( -1.537 5.382 0.455) 5.616 5.136 ( 3.359 5.329 3.622) 7.267 5.367 ( 1.680 -2.110 2.760) 3.859 5.682 ( -0.604 2.103 -9.632) 9.878 5.761 ( -5.337 -4.977 -2.071) 7.585 5.933 ( -10.136 0.607 0.303) 10.158 6.042 ( 8.559 -15.272 7.031) 18.866 6.277 ( 4.423 -9.569 0.101) 10.542 6.320 ( -10.041 -4.288 4.502) 11.810 6.561 ( 0.997 -9.026 10.486) 13.871 6.817 ( 1.691 -1.312 11.253) 11.455 6.902 ( -3.064 -7.067 8.974) 11.826 7.031 ( 1.334 2.669 -0.922) 3.123 7.312 ( -7.853 -4.457 -8.304) 12.267 7.637 ( 2.128 5.636 -0.406) 6.039 7.680 ( 5.474 2.043 2.988) 6.563 7.882 ( -4.457 -8.232 -6.019) 11.130 7.944 ( -0.990 -2.592 -5.659) 6.303 8.172 ( 0.049 -1.665 -13.784) 13.884 8.220 ( 0.939 -3.027 -11.052) 11.497 8.322 ( 3.845 4.623 -7.163) 9.353 8.501 ( 1.791 4.551 -0.392) 4.907 8.544 ( 3.404 2.637 -9.771) 10.678 8.724 ( -0.441 4.580 1.303) 4.782 8.779 ( 5.110 -1.235 0.546) 5.285 8.896 ( 0.605 6.776 -11.090) 13.010 8.957 ( -1.885 -3.120 -2.021) 4.168 9.139 ( 1.137 -0.720 -8.984) 9.084 9.242 ( 5.001 4.207 -4.189) 7.762 9.291 ( 1.742 1.127 2.709) 3.412 9.329 ( 0.846 2.594 -0.973) 2.897 9.451 ( 0.691 1.534 -0.887) 1.902 9.531 ( -0.299 -4.899 -0.274) 4.916 9.541 ( -0.286 -2.256 3.340) 4.040 9.895 ( 3.191 -3.185 -0.240) 4.515 9.960 ( 3.439 -5.276 -5.111) 8.111 10.352 ( -3.036 5.890 7.838) 10.264 10.396 ( -0.824 -1.337 -1.104) 1.920 10.462 ( 3.501 1.951 -0.596) 4.052 10.588 ( -4.576 -3.878 -2.377) 6.452 10.729 ( -5.962 -4.789 2.032) 7.912 10.746 ( 0.954 -2.745 -5.916) 6.591 10.876 ( -0.887 -2.957 1.964) 3.659 11.056 ( 0.470 -5.838 -8.007) 9.920 11.356 ( -1.528 5.224 2.836) 6.137 11.390 ( 2.905 3.663 -3.528) 5.857 11.581 ( 0.956 4.162 -3.637) 5.609 11.745 ( 4.270 -3.248 0.351) 5.376 11.805 ( -2.613 3.904 -2.099) 5.145 11.935 ( 2.241 2.698 3.665) 5.072 12.045 ( 0.851 -0.219 4.420) 4.506 12.272 ( 3.244 -2.385 -3.818) 5.549 12.491 ( 4.063 2.582 4.408) 6.527 12.798 ( -7.922 -6.753 12.469) 16.243 13.109 ( -2.788 3.725 6.492) 7.987 13.224 ( 3.091 9.105 0.226) 9.619 13.281 ( -3.683 5.737 -8.473) 10.875 13.638 ( -0.250 -2.658 -7.113) 7.598 13.695 ( 1.526 -5.756 -7.020) 9.205 13.890 ( -2.737 -7.617 -8.398) 11.663 14.238 ( -11.953 9.830 12.703) 20.022 14.562 ( -3.333 4.775 -4.028) 7.081 14.921 ( -0.256 -2.292 0.525) 2.365 14.995 ( -3.439 -2.802 8.474) 9.565 15.091 ( -17.399 -16.096 23.971) 33.710 15.254 ( -1.248 -6.775 -0.430) 6.903 15.571 ( 3.788 16.255 2.548) 16.884 15.873 ( 10.456 4.187 0.795) 11.291 16.083 ( -5.287 2.680 7.167) 9.301 16.218 ( 3.473 -10.187 -5.837) 12.243 16.457 ( -0.005 -5.122 9.108) 10.449 16.484 ( -17.060 0.917 -5.017) 17.806 17.009 ( 13.998 1.099 -4.765) 14.828 17.093 ( 14.268 -3.452 -1.539) 14.760 18.769 ( 2.653 6.303 2.936) 7.442 19.107 ( -6.798 -7.388 -8.289) 13.019 19.469 ( -1.656 -0.447 1.649) 2.380 19.523 ( 5.827 -3.647 3.134) 7.555 22.401 ( 1.979 2.810 -10.768) 11.304 22.498 ( 3.624 -1.885 -14.297) 14.869 22.645 ( 2.142 3.084 -11.334) 11.940 22.755 ( 3.440 -2.302 -13.385) 14.011 25.099 ( -1.493 1.189 7.118) 7.369 25.132 ( -2.146 -0.014 6.560) 6.902 25.531 ( -4.743 1.564 3.950) 6.367 25.559 ( -8.406 0.804 3.242) 9.045 25.727 ( 16.713 1.774 1.018) 16.838 25.873 ( 5.164 -5.892 -3.111) 8.430 27.651 ( 1.694 11.339 -10.139) 15.306 28.135 ( 2.684 -12.427 -16.722) 21.006 28.569 ( 0.331 8.773 0.128) 8.780 28.748 ( 0.634 -0.429 3.027) 3.122 29.071 ( -0.071 -0.201 -7.236) 7.239 29.164 ( -1.207 -4.460 -10.883) 11.823 29.448 ( 0.957 2.965 0.745) 3.204 29.537 ( 4.790 -2.136 2.650) 5.876 29.881 ( -5.727 2.516 17.722) 18.793 29.952 ( -4.632 -1.214 16.752) 17.423 30.194 ( -3.181 1.427 20.017) 20.319 30.295 ( -0.029 -2.308 15.505) 15.676 30.741 ( -1.051 8.048 9.091) 12.187 31.128 ( 1.530 -7.435 1.707) 7.781 31.448 ( -0.599 4.051 6.566) 7.738 31.683 ( -0.239 -9.475 0.095) 9.478 33.257 ( -0.182 11.016 -16.706) 20.012 33.570 ( -3.113 -2.463 -24.814) 25.129 ======================= Grid point 46 (24/104) ======================= q-point: ( 0.20 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.022 ( 11.429 32.640 13.585) 37.156 2.262 ( 16.934 24.395 30.978) 42.913 2.772 ( 3.288 9.191 17.859) 20.352 2.799 ( -4.784 6.795 33.238) 34.261 3.149 ( 14.662 29.094 16.478) 36.510 3.366 ( -12.576 -13.650 20.062) 27.331 3.431 ( -3.194 -8.180 20.087) 21.922 3.579 ( -7.851 3.445 19.383) 21.195 3.761 ( -2.515 -0.941 7.081) 7.573 3.905 ( -3.858 0.401 7.226) 8.202 3.982 ( -4.532 -7.708 18.400) 20.458 4.319 ( 4.629 -12.002 -0.459) 12.872 4.619 ( -13.127 14.069 3.616) 19.579 4.845 ( -6.975 5.632 15.271) 17.708 5.287 ( -1.065 8.433 5.157) 9.942 5.372 ( 7.220 8.322 4.336) 11.840 5.476 ( 3.821 9.280 1.217) 10.109 5.526 ( -0.565 -2.514 -3.934) 4.703 5.635 ( -2.109 2.839 3.024) 4.653 5.734 ( -6.800 -3.480 1.408) 7.767 5.997 ( -15.360 -7.668 3.032) 17.433 6.203 ( 2.088 -15.425 4.878) 16.312 6.427 ( 9.005 -5.055 6.704) 12.312 6.670 ( 3.918 -10.983 9.316) 14.925 6.917 ( -10.274 4.731 -6.335) 12.964 7.006 ( 6.567 -0.501 2.567) 7.069 7.106 ( 7.703 -8.722 3.364) 12.113 7.137 ( 4.380 0.309 2.293) 4.954 7.615 ( -6.313 0.840 0.158) 6.370 7.714 ( -5.664 -5.168 -4.363) 8.822 7.755 ( 0.106 2.843 -0.893) 2.982 7.875 ( -2.100 -4.789 -6.316) 8.200 8.159 ( 4.732 -4.244 -11.711) 13.324 8.211 ( 2.576 -4.548 -9.294) 10.663 8.303 ( -2.112 4.621 -2.353) 5.599 8.495 ( -0.933 11.053 -8.676) 14.082 8.595 ( 2.356 -1.566 -2.137) 3.545 8.674 ( -3.078 3.874 -0.147) 4.950 8.777 ( -1.225 1.225 -2.509) 3.049 8.826 ( -5.480 -4.520 -2.870) 7.661 9.053 ( 7.382 0.071 -9.876) 12.331 9.140 ( 5.588 -3.375 -7.508) 9.949 9.280 ( -2.597 0.373 1.157) 2.867 9.352 ( 3.852 0.341 -3.049) 4.924 9.388 ( 5.069 3.630 0.561) 6.260 9.435 ( -3.771 4.892 4.625) 7.716 9.577 ( 0.388 -2.848 6.298) 6.923 9.580 ( 6.299 -4.600 -2.357) 8.149 9.965 ( 5.561 -0.073 -4.414) 7.100 10.104 ( 10.274 -5.402 -1.794) 11.745 10.330 ( -2.174 1.117 2.774) 3.697 10.403 ( 2.126 -4.297 -2.168) 5.261 10.445 ( -5.278 -2.690 -5.273) 7.931 10.520 ( -4.983 -5.021 1.317) 7.196 10.615 ( 0.514 0.702 1.414) 1.660 10.749 ( 2.259 -2.708 -7.090) 7.919 10.873 ( 0.703 -3.313 -1.213) 3.598 10.988 ( -3.610 -3.304 -7.497) 8.952 11.308 ( -5.066 10.655 3.418) 12.283 11.410 ( -0.337 5.122 -3.902) 6.448 11.541 ( -3.324 5.469 -1.826) 6.655 11.726 ( -3.315 -0.891 2.377) 4.175 11.848 ( 1.929 0.571 0.494) 2.072 11.987 ( 0.736 -5.728 4.440) 7.285 12.091 ( 5.159 8.491 -4.019) 10.717 12.242 ( -3.025 -0.337 4.217) 5.201 12.546 ( -11.413 -4.775 9.199) 15.417 12.683 ( 2.460 -8.462 3.163) 9.363 13.090 ( -0.621 5.003 3.211) 5.977 13.163 ( -2.194 8.322 -1.860) 8.805 13.413 ( 11.543 8.691 -6.593) 15.882 13.538 ( -4.959 -1.990 -2.544) 5.918 13.740 ( 4.266 -6.193 -10.716) 13.091 13.810 ( 0.102 -7.513 -7.457) 10.586 14.052 ( -7.155 0.625 9.061) 11.563 14.318 ( -22.723 -10.434 16.443) 29.926 14.738 ( -5.353 3.793 8.300) 10.580 14.915 ( 0.182 -1.633 -2.414) 2.921 15.025 ( -3.110 3.570 3.465) 5.867 15.260 ( 0.262 -7.054 3.716) 7.978 15.632 ( -2.390 15.673 3.805) 16.304 15.906 ( -10.177 -1.935 2.146) 10.579 16.121 ( 7.829 3.587 4.626) 9.775 16.228 ( -2.027 4.906 3.798) 6.527 16.303 ( 3.682 -1.084 0.246) 3.846 16.492 ( -1.655 -2.349 4.674) 5.486 17.115 ( 3.176 5.237 -7.227) 9.474 17.266 ( -1.845 1.513 -7.406) 7.780 18.734 ( -3.244 -9.049 8.205) 12.639 18.826 ( -12.916 -7.195 -8.071) 16.844 19.571 ( 7.737 2.262 -0.114) 8.061 19.702 ( 8.164 -4.311 -1.392) 9.337 22.393 ( 2.145 2.993 -11.092) 11.687 22.484 ( 1.510 -1.463 -13.849) 14.008 22.651 ( 3.352 3.005 -12.040) 12.854 22.758 ( 2.308 -2.290 -12.709) 13.119 25.050 ( -4.231 1.248 5.485) 7.039 25.076 ( -3.387 -0.210 6.980) 7.761 25.479 ( -1.320 0.939 7.204) 7.384 25.501 ( -2.006 -0.086 4.833) 5.233 26.212 ( 24.517 1.496 -3.114) 24.760 26.468 ( 42.110 -14.660 -6.993) 45.134 27.563 ( -5.622 10.922 -11.580) 16.882 28.042 ( -4.107 -13.328 -17.373) 22.279 28.573 ( 0.115 6.154 -0.314) 6.163 28.731 ( -3.103 -0.924 1.107) 3.422 29.012 ( -1.733 -0.516 -5.207) 5.512 29.080 ( -0.968 -3.846 -8.673) 9.537 29.515 ( 4.065 5.396 0.069) 6.756 29.645 ( 0.867 -2.409 8.790) 9.156 29.854 ( -3.071 3.032 12.375) 13.106 29.945 ( -1.913 -1.470 11.327) 11.581 30.263 ( -0.473 1.443 24.459) 24.506 30.437 ( 3.653 -6.532 18.351) 19.819 30.792 ( 2.536 6.830 9.507) 11.978 31.158 ( -1.141 -8.269 4.252) 9.368 31.494 ( 2.382 5.116 6.651) 8.722 31.686 ( 0.580 -6.541 1.111) 6.660 33.039 ( -11.611 10.439 -20.211) 25.540 33.153 ( -18.012 6.941 -22.195) 29.414 ======================= Grid point 47 (25/104) ======================= q-point: ( 0.40 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.359 ( 11.056 18.403 16.558) 27.112 2.717 ( 1.886 15.642 16.611) 22.894 2.802 ( -7.211 10.153 26.551) 29.326 2.917 ( 6.288 17.756 22.372) 29.246 3.157 ( -13.323 -3.264 24.329) 27.930 3.322 ( -5.615 3.646 29.937) 30.677 3.460 ( 0.616 -6.436 -0.242) 6.470 3.721 ( -4.688 -6.554 10.260) 13.046 3.809 ( 15.685 9.849 13.810) 23.102 3.924 ( -0.227 2.483 12.155) 12.408 3.986 ( 1.217 -6.086 10.465) 12.167 4.375 ( -7.888 6.330 8.397) 13.145 4.429 ( 2.391 -6.608 -6.099) 9.304 4.766 ( -7.224 -2.797 12.374) 14.599 4.994 ( -14.781 13.654 3.922) 20.501 5.230 ( -20.141 -1.746 8.279) 21.847 5.427 ( -3.114 8.957 -3.157) 9.994 5.589 ( -0.339 4.105 4.564) 6.148 5.712 ( 5.206 -0.689 1.087) 5.363 5.814 ( 7.583 -3.504 6.192) 10.398 5.935 ( 1.483 14.119 11.153) 18.054 6.234 ( -1.356 0.459 11.323) 11.414 6.615 ( 2.647 -8.870 2.118) 9.495 6.696 ( 1.740 -3.681 -8.989) 9.868 6.768 ( 0.639 1.515 1.730) 2.387 7.102 ( 1.419 -1.444 -4.050) 4.528 7.165 ( -0.364 -9.131 2.416) 9.452 7.303 ( 1.507 -7.358 5.996) 9.610 7.442 ( -5.911 -1.696 -3.827) 7.243 7.626 ( 0.420 -7.601 5.821) 9.583 7.762 ( -1.077 -1.597 1.460) 2.417 7.866 ( 3.230 -8.399 2.840) 9.436 8.214 ( -0.065 -2.659 -4.107) 4.893 8.241 ( 5.485 0.517 -10.353) 11.727 8.303 ( 6.486 4.309 -11.160) 13.608 8.414 ( -0.747 1.683 -6.749) 6.995 8.568 ( -5.144 -0.668 -4.629) 6.952 8.601 ( -0.323 1.952 -4.962) 5.342 8.729 ( -0.811 0.338 0.145) 0.890 8.794 ( -0.293 -0.502 -0.764) 0.960 9.048 ( 2.361 3.406 -12.789) 13.444 9.204 ( -0.319 0.241 -4.002) 4.021 9.228 ( -3.384 0.501 0.829) 3.520 9.313 ( -5.770 7.412 3.528) 10.034 9.395 ( 0.327 -6.396 -3.984) 7.543 9.532 ( 2.006 -3.525 3.517) 5.368 9.560 ( 0.048 2.792 -0.651) 2.868 9.734 ( 7.199 -7.012 -5.098) 11.269 10.147 ( 1.623 1.821 -2.682) 3.626 10.175 ( -1.562 2.123 -8.400) 8.803 10.306 ( -5.154 -0.420 3.737) 6.380 10.319 ( 8.732 -2.313 1.803) 9.212 10.421 ( 1.713 -3.520 -0.321) 3.927 10.477 ( 2.507 -10.722 -8.126) 13.685 10.710 ( -4.092 0.091 -1.157) 4.253 10.732 ( 4.252 -1.599 3.234) 5.576 10.883 ( 1.710 0.950 -3.860) 4.327 10.913 ( 2.359 -1.009 -6.986) 7.442 11.204 ( -3.053 5.678 0.805) 6.497 11.352 ( -2.125 3.861 -0.461) 4.431 11.463 ( -3.767 4.147 0.876) 5.670 11.670 ( -1.360 -4.417 0.555) 4.655 11.836 ( -3.348 3.578 3.777) 6.187 12.002 ( -3.855 -3.870 1.361) 5.630 12.148 ( -0.835 1.104 3.849) 4.090 12.250 ( -0.683 -4.728 -4.082) 6.283 12.389 ( 2.457 5.640 4.209) 7.454 12.739 ( 0.686 -7.783 -3.392) 8.518 13.064 ( -1.989 7.981 -3.342) 8.879 13.167 ( 2.656 7.507 1.678) 8.138 13.441 ( -3.009 -4.840 1.759) 5.964 13.585 ( 2.689 -0.652 1.159) 3.000 13.803 ( 4.681 -3.056 -3.800) 6.760 13.853 ( 5.170 -6.357 4.852) 9.522 13.968 ( -7.256 -1.415 16.711) 18.273 14.085 ( -1.135 -6.369 9.234) 11.275 14.779 ( 4.871 6.229 -0.173) 7.909 14.915 ( 1.111 -0.360 -2.364) 2.637 14.970 ( -3.368 6.695 5.260) 9.156 15.310 ( 1.716 -6.753 6.182) 9.315 15.539 ( -4.124 3.483 2.097) 5.791 15.682 ( -9.522 -5.371 2.458) 11.205 16.281 ( 0.993 3.485 5.178) 6.320 16.310 ( 5.525 4.908 1.606) 7.563 16.358 ( -2.167 6.023 2.653) 6.929 16.390 ( -5.037 4.576 4.662) 8.249 17.059 ( -3.587 10.773 -12.038) 16.548 17.158 ( -0.565 2.826 -9.303) 9.739 18.547 ( -8.734 -5.539 -7.423) 12.730 18.768 ( 1.804 -16.520 9.198) 18.994 19.712 ( 4.959 1.688 -3.466) 6.282 19.811 ( 2.829 -3.237 -4.544) 6.255 22.397 ( 3.160 2.406 -11.914) 12.558 22.448 ( 1.077 -0.041 -13.063) 13.107 22.675 ( 4.150 1.475 -13.113) 13.833 22.739 ( 1.327 -1.653 -12.347) 12.527 25.008 ( -2.179 0.858 5.400) 5.886 25.048 ( -2.253 -1.134 7.345) 7.766 25.492 ( -0.980 0.217 6.398) 6.477 25.496 ( -0.993 0.090 7.677) 7.741 26.736 ( 22.239 7.486 -7.164) 24.534 27.153 ( 14.555 -10.076 -7.728) 19.315 27.341 ( 0.373 2.536 -18.874) 19.047 27.806 ( -8.913 -17.014 -18.887) 26.937 28.581 ( 0.968 2.924 -0.069) 3.081 28.657 ( -3.082 0.028 -0.549) 3.131 28.974 ( -0.233 -0.157 -2.233) 2.251 29.050 ( 0.835 -3.816 -4.707) 6.117 29.582 ( 1.342 3.858 1.477) 4.343 29.649 ( -3.560 -1.109 8.502) 9.284 29.865 ( -0.355 4.408 8.659) 9.723 29.960 ( -1.787 -0.774 11.094) 11.263 30.350 ( -2.767 2.572 22.663) 22.975 30.530 ( -3.076 -2.743 19.613) 20.041 30.937 ( 5.807 -2.414 8.340) 10.445 31.077 ( -8.574 -6.487 5.629) 12.136 31.589 ( 1.594 5.621 5.692) 8.156 31.703 ( -0.688 -2.137 2.724) 3.530 32.739 ( -1.479 11.489 -16.847) 20.446 32.831 ( -2.831 5.514 -17.959) 18.999 ======================= Grid point 48 (26/104) ======================= q-point: (-0.40 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.408 ( -18.132 19.958 19.781) 33.442 2.504 ( -13.691 28.048 2.439) 31.306 2.813 ( -1.724 7.274 29.344) 30.281 2.974 ( -12.996 9.360 22.044) 27.248 3.296 ( 8.605 4.909 31.497) 33.019 3.342 ( -6.624 0.822 20.514) 21.573 3.491 ( -0.764 -3.285 0.107) 3.374 3.630 ( -10.740 2.492 17.245) 20.468 3.851 ( -6.747 0.253 14.528) 16.020 3.956 ( -12.579 3.033 18.666) 22.712 4.071 ( -1.100 -1.733 12.538) 12.705 4.304 ( 4.115 4.420 -4.539) 7.554 4.411 ( -0.088 2.741 13.828) 14.098 4.600 ( -13.347 -5.015 0.926) 14.288 5.029 ( 14.321 1.964 2.433) 14.658 5.095 ( 9.810 2.731 3.140) 10.657 5.385 ( -3.031 8.160 2.642) 9.097 5.543 ( -4.169 3.959 -3.444) 6.701 5.762 ( -0.226 3.508 1.569) 3.849 5.858 ( -3.967 -5.554 5.554) 8.799 5.984 ( 0.191 -2.617 8.058) 8.475 6.355 ( 2.442 5.159 15.491) 16.509 6.558 ( -5.189 -3.675 1.376) 6.506 6.656 ( -7.338 -1.733 0.562) 7.561 6.844 ( 6.791 2.834 -6.003) 9.497 7.079 ( -1.503 -4.437 0.829) 4.757 7.157 ( -1.892 -14.528 3.765) 15.126 7.243 ( -4.493 -12.368 3.175) 13.537 7.439 ( 5.272 -0.811 -3.549) 6.407 7.660 ( -1.804 -3.367 3.803) 5.390 7.834 ( 6.023 -2.544 3.776) 7.551 7.951 ( 1.853 -8.352 6.702) 10.868 8.175 ( -0.779 0.248 -4.537) 4.610 8.276 ( 2.912 -0.003 -13.716) 14.022 8.360 ( 1.609 7.633 -13.401) 15.506 8.455 ( 2.285 2.572 -8.570) 9.235 8.502 ( 1.972 -0.358 -2.908) 3.532 8.596 ( 7.197 -2.135 -5.000) 9.020 8.709 ( -1.393 0.577 0.553) 1.606 8.778 ( -0.985 -7.206 -1.247) 7.379 9.052 ( 1.333 11.377 -12.794) 17.172 9.095 ( -4.815 1.602 0.698) 5.122 9.204 ( 0.100 2.731 -0.429) 2.766 9.244 ( 0.384 0.172 4.259) 4.279 9.357 ( -1.507 -3.889 -7.654) 8.717 9.506 ( -1.205 -3.576 -1.979) 4.261 9.634 ( 3.990 -0.368 -3.683) 5.442 9.742 ( -6.014 -1.617 -5.472) 8.290 9.905 ( -5.449 -0.696 -8.852) 10.418 10.099 ( -5.672 3.143 -0.784) 6.532 10.317 ( -5.887 3.220 -5.665) 8.782 10.447 ( 0.311 -2.865 1.020) 3.058 10.471 ( 3.584 1.909 2.161) 4.600 10.572 ( 10.136 -4.606 5.083) 12.240 10.681 ( 2.219 -2.617 -5.883) 6.810 10.855 ( 4.105 -4.399 0.808) 6.071 10.905 ( -0.952 -2.843 3.219) 4.399 10.947 ( 2.921 1.824 -0.068) 3.444 11.255 ( 7.343 -1.105 -3.253) 8.107 11.339 ( -0.402 -0.807 -0.468) 1.015 11.441 ( 3.748 5.480 -0.722) 6.679 11.665 ( 0.206 -3.873 2.186) 4.452 11.760 ( -3.229 2.512 1.123) 4.242 11.873 ( -5.228 -3.197 0.789) 6.179 12.108 ( -3.529 -0.331 0.039) 3.544 12.223 ( -1.099 -5.262 -1.325) 5.536 12.484 ( 0.523 8.209 1.405) 8.345 12.761 ( 5.032 -2.591 -3.882) 6.863 13.027 ( 0.392 7.788 -2.798) 8.284 13.213 ( -0.092 8.365 2.168) 8.641 13.443 ( 1.787 -10.048 3.938) 10.939 13.606 ( -0.147 -3.802 -1.445) 4.070 13.802 ( -2.289 -3.548 9.828) 10.697 13.928 ( 1.396 -1.664 -0.729) 2.291 14.141 ( 3.367 -2.044 14.352) 14.882 14.211 ( 12.929 -0.396 20.783) 24.480 14.884 ( 3.944 6.852 1.730) 8.094 14.898 ( -5.169 5.973 8.206) 11.390 14.994 ( 5.619 -1.593 0.031) 5.840 15.324 ( -2.033 -7.630 2.589) 8.310 15.527 ( 0.261 0.019 1.015) 1.048 15.643 ( 5.442 -2.087 5.592) 8.078 16.028 ( -13.146 12.425 -6.858) 19.345 16.347 ( -1.315 3.361 8.528) 9.260 16.408 ( 0.328 2.763 0.664) 2.860 16.434 ( 1.559 -0.179 7.402) 7.567 16.968 ( 0.838 4.608 -15.438) 16.132 17.109 ( -0.288 0.170 -13.066) 13.071 18.416 ( 0.114 2.891 -5.113) 5.875 18.888 ( 6.119 -15.968 6.488) 18.290 19.712 ( -3.852 1.001 -3.131) 5.064 19.779 ( -3.340 -2.570 -5.783) 7.156 22.418 ( 1.535 1.350 -12.173) 12.344 22.420 ( 4.331 1.381 -13.022) 13.793 22.701 ( 2.058 -0.133 -12.014) 12.190 22.709 ( 3.129 -0.591 -13.865) 14.226 25.007 ( -0.337 0.835 6.101) 6.167 25.046 ( -1.096 -1.144 7.509) 7.674 25.499 ( -1.100 0.851 6.893) 7.032 25.515 ( -0.618 0.065 7.505) 7.531 26.644 ( -22.327 5.665 -11.409) 25.705 27.084 ( -21.545 -17.715 -14.133) 31.269 27.369 ( 12.703 7.660 -15.457) 21.423 27.836 ( 17.124 -14.423 -16.987) 28.104 28.594 ( -1.412 2.964 0.818) 3.384 28.631 ( 2.074 0.934 0.002) 2.275 28.987 ( 2.621 0.045 -2.054) 3.330 29.071 ( 2.874 -3.740 -3.141) 5.667 29.580 ( -1.950 0.871 0.101) 2.138 29.586 ( -4.636 -0.077 3.987) 6.115 29.904 ( -0.795 4.209 11.540) 12.309 29.969 ( -2.608 -0.127 13.667) 13.915 30.313 ( -9.201 5.565 19.731) 22.471 30.509 ( -7.354 -3.557 18.126) 19.882 30.880 ( -10.768 -1.154 5.659) 12.219 31.059 ( 2.641 -7.188 3.814) 8.555 31.538 ( -5.923 5.254 2.713) 8.370 31.693 ( -1.001 -4.411 1.533) 4.775 32.887 ( 19.316 10.277 -9.406) 23.816 32.928 ( 16.235 6.850 -12.815) 21.788 ======================= Grid point 49 (27/104) ======================= q-point: (-0.20 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.057 ( -19.127 34.823 14.929) 42.442 2.190 ( -17.606 35.995 14.339) 42.558 2.790 ( -11.280 17.421 12.830) 24.400 2.839 ( -15.358 7.233 44.088) 47.243 2.997 ( -18.158 13.476 9.991) 24.721 3.450 ( -5.217 -5.567 25.969) 27.067 3.468 ( -4.313 -4.746 20.938) 21.898 3.657 ( 2.577 1.978 16.832) 17.143 3.747 ( -6.702 13.316 20.681) 25.494 3.899 ( -1.356 -4.009 10.900) 11.693 4.102 ( -4.174 -2.816 23.002) 23.547 4.321 ( -10.026 -4.925 1.686) 11.297 4.537 ( 16.152 4.012 -1.404) 16.702 4.620 ( 13.264 0.554 4.762) 14.104 5.147 ( -7.904 3.222 -2.398) 8.866 5.279 ( -7.827 2.923 3.321) 8.991 5.320 ( 6.388 3.048 0.565) 7.101 5.584 ( 9.545 2.442 -1.548) 9.974 5.762 ( 1.416 3.624 -4.639) 6.055 5.928 ( 8.676 -12.673 6.008) 16.492 5.994 ( -0.089 -13.643 3.666) 14.127 6.254 ( -12.211 -6.896 5.733) 15.151 6.477 ( -7.152 -0.175 6.013) 9.345 6.543 ( -2.616 -0.593 9.009) 9.399 6.867 ( -3.204 -5.107 -2.726) 6.617 7.040 ( -2.150 1.681 4.496) 5.259 7.060 ( -11.179 -12.097 8.102) 18.356 7.316 ( 8.041 -7.650 0.632) 11.117 7.540 ( 4.978 1.423 -1.337) 5.348 7.624 ( -0.780 4.519 -2.218) 5.094 7.928 ( 1.709 -5.722 -1.087) 6.070 7.982 ( -1.203 -8.355 0.624) 8.464 8.213 ( 6.574 3.812 -5.925) 9.636 8.245 ( 1.746 3.608 -19.344) 19.755 8.285 ( -1.725 3.763 -13.699) 14.310 8.442 ( 2.936 -2.568 -4.777) 6.167 8.549 ( 0.934 5.094 -1.193) 5.315 8.702 ( 0.788 0.126 1.464) 1.668 8.718 ( -0.577 -5.379 -2.567) 5.988 8.831 ( 9.975 -2.725 -1.028) 10.391 8.993 ( -0.308 8.627 -7.580) 11.488 9.089 ( 3.209 2.442 -6.803) 7.908 9.228 ( 1.714 7.134 3.278) 8.036 9.284 ( -0.952 -0.744 -11.326) 11.390 9.314 ( 1.591 -4.436 2.249) 5.222 9.478 ( -0.593 -0.076 -0.314) 0.675 9.569 ( -5.039 0.458 -1.450) 5.264 9.604 ( -5.564 -2.956 -5.916) 8.643 9.838 ( 1.986 -0.144 -3.435) 3.971 9.977 ( -2.050 -3.999 -6.115) 7.589 10.315 ( 2.977 7.176 3.844) 8.668 10.432 ( -2.067 -1.432 1.449) 2.902 10.482 ( -3.174 4.567 0.833) 5.624 10.647 ( -0.318 -5.239 -1.351) 5.419 10.732 ( 2.515 -2.585 -1.759) 4.013 10.836 ( -4.790 -2.985 1.058) 5.742 10.886 ( -1.394 -1.333 3.683) 4.158 11.039 ( 4.594 -5.271 -6.592) 9.609 11.339 ( 1.860 2.462 -2.048) 3.703 11.358 ( 1.058 -0.468 3.738) 3.913 11.555 ( 3.062 3.322 0.611) 4.559 11.689 ( 0.291 -1.635 2.846) 3.296 11.782 ( 5.409 1.937 -7.986) 9.838 11.867 ( 6.041 -6.083 -2.848) 9.033 12.036 ( -3.461 0.120 3.674) 5.049 12.189 ( 1.155 -4.809 -2.037) 5.349 12.464 ( -2.564 11.173 7.188) 13.530 12.839 ( 0.606 -5.177 1.964) 5.570 13.073 ( 4.541 10.208 -1.729) 11.306 13.194 ( -1.828 9.923 2.263) 10.341 13.454 ( -5.539 -8.689 0.049) 10.305 13.598 ( 3.367 -8.182 -4.892) 10.110 13.754 ( -3.437 1.382 -0.308) 3.718 13.964 ( -0.383 -5.363 -2.623) 5.982 14.269 ( 1.716 9.411 20.238) 22.385 14.569 ( 6.176 4.095 8.194) 11.048 14.882 ( 0.889 -3.849 15.638) 16.129 14.943 ( 0.661 7.460 0.253) 7.494 15.112 ( 1.947 -12.686 15.224) 19.912 15.318 ( 0.156 -10.031 1.576) 10.156 15.542 ( -0.710 11.740 -0.670) 11.781 15.707 ( 2.859 5.977 -3.461) 7.475 16.002 ( 8.797 -4.008 7.499) 12.235 16.285 ( -5.713 -8.887 -3.344) 11.081 16.412 ( -0.510 4.902 9.489) 10.692 16.550 ( 8.605 2.931 9.907) 13.445 16.915 ( -5.316 0.105 -18.289) 19.046 16.989 ( 0.955 -4.459 -14.924) 15.605 18.542 ( 12.351 12.944 -0.396) 17.896 19.074 ( 8.572 -12.705 0.721) 15.343 19.558 ( -7.979 0.888 0.315) 8.035 19.624 ( -8.553 -2.605 -3.926) 9.765 22.404 ( 2.195 2.348 -11.287) 11.736 22.462 ( 5.173 -0.068 -13.890) 14.822 22.666 ( 0.866 1.314 -11.529) 11.636 22.736 ( 4.193 -1.651 -13.974) 14.683 25.053 ( 1.991 1.041 7.089) 7.436 25.073 ( 0.491 0.039 7.336) 7.352 25.514 ( 0.028 1.946 6.971) 7.238 25.539 ( -0.151 0.813 6.564) 6.616 26.097 ( -20.543 -1.578 -8.363) 22.237 26.275 ( -40.200 -14.000 -14.950) 45.116 27.584 ( 9.187 11.687 -10.656) 18.290 28.070 ( 10.800 -12.294 -16.811) 23.461 28.569 ( -0.706 6.960 0.338) 7.004 28.695 ( 2.748 0.022 2.194) 3.517 29.053 ( 4.068 -0.093 -5.119) 6.539 29.144 ( 5.000 -3.885 -3.849) 7.410 29.489 ( -4.524 0.882 1.080) 4.734 29.522 ( -2.321 -0.854 -3.415) 4.216 29.917 ( -4.544 2.730 17.694) 18.471 29.970 ( -4.123 -0.450 17.661) 18.142 30.210 ( -6.849 4.573 18.110) 19.895 30.361 ( -10.981 -3.793 12.522) 17.081 30.750 ( -4.112 5.599 8.375) 10.881 31.099 ( 0.881 -7.761 0.710) 7.843 31.456 ( -2.841 4.521 4.692) 7.108 31.685 ( -0.168 -8.639 0.567) 8.659 33.187 ( 12.425 9.452 -12.899) 20.251 33.386 ( 24.942 3.248 -13.522) 28.557 ======================= Grid point 50 (28/104) ======================= q-point: ( 0.00 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.511 ( -4.725 -17.464 19.863) 26.867 2.511 ( -4.725 17.464 19.863) 26.867 2.608 ( -8.886 -20.627 28.381) 36.193 2.608 ( -8.886 20.627 28.381) 36.193 3.262 ( -1.403 -10.803 11.143) 15.583 3.262 ( -1.403 10.803 11.143) 15.583 3.537 ( -1.466 -20.738 9.631) 22.913 3.537 ( -1.466 20.738 9.631) 22.913 3.856 ( -9.728 -7.474 23.025) 26.089 3.856 ( -9.728 7.474 23.025) 26.089 4.079 ( -2.785 -7.865 6.274) 10.439 4.079 ( -2.785 7.865 6.274) 10.439 4.969 ( 9.066 -4.295 3.251) 10.545 4.969 ( 9.066 4.295 3.251) 10.545 5.115 ( 3.215 -10.919 2.416) 11.636 5.115 ( 3.215 10.919 2.416) 11.636 5.523 ( -5.303 -16.508 8.856) 19.469 5.523 ( -5.303 16.508 8.856) 19.469 5.750 ( -0.055 -6.492 -2.455) 6.941 5.750 ( -0.055 6.492 -2.455) 6.941 6.079 ( 1.214 -9.740 1.084) 9.875 6.079 ( 1.214 9.740 1.084) 9.875 6.372 ( -4.498 -8.169 9.943) 13.632 6.372 ( -4.498 8.169 9.943) 13.632 6.825 ( -1.287 -2.009 11.997) 12.232 6.825 ( -1.287 2.009 11.997) 12.232 7.183 ( -0.856 -9.873 -5.161) 11.173 7.183 ( -0.856 9.873 -5.161) 11.173 7.699 ( 1.422 -0.737 2.880) 3.295 7.699 ( 1.422 0.737 2.880) 3.295 7.837 ( -1.549 -4.335 -2.676) 5.325 7.837 ( -1.549 4.335 -2.676) 5.325 8.185 ( -2.022 -1.543 -14.901) 15.117 8.185 ( -2.022 1.543 -14.901) 15.117 8.433 ( 5.574 -5.862 -7.258) 10.868 8.433 ( 5.574 5.862 -7.258) 10.868 8.716 ( 1.303 -7.779 -2.145) 8.174 8.716 ( 1.303 7.779 -2.145) 8.174 8.789 ( 1.913 -5.205 1.825) 5.838 8.789 ( 1.913 5.205 1.825) 5.838 9.079 ( -0.570 -6.746 -9.061) 11.311 9.079 ( -0.570 6.746 -9.061) 11.311 9.290 ( 3.018 -1.107 -1.380) 3.498 9.290 ( 3.018 1.107 -1.380) 3.498 9.409 ( 0.840 -5.157 -4.014) 6.589 9.409 ( 0.840 5.157 -4.014) 6.589 9.508 ( 0.205 -1.702 -0.699) 1.852 9.508 ( 0.205 1.702 -0.699) 1.852 9.879 ( 3.426 -2.014 -4.872) 6.288 9.879 ( 3.426 2.014 -4.872) 6.288 10.418 ( 0.074 -4.188 1.043) 4.316 10.418 ( 0.074 4.188 1.043) 4.316 10.506 ( -5.066 -7.355 4.162) 9.853 10.506 ( -5.066 7.355 4.162) 9.853 10.683 ( -1.936 -2.699 -0.607) 3.377 10.683 ( -1.936 2.699 -0.607) 3.377 10.932 ( -0.415 -6.592 -4.082) 7.765 10.932 ( -0.415 6.592 -4.082) 7.765 11.411 ( 1.496 -1.214 0.834) 2.099 11.411 ( 1.496 1.214 0.834) 2.099 11.667 ( 3.370 -4.667 -1.665) 5.992 11.667 ( 3.370 4.667 -1.665) 5.992 11.885 ( -0.581 -4.608 4.360) 6.370 11.885 ( -0.581 4.608 4.360) 6.370 12.153 ( 6.450 -8.003 -5.196) 11.518 12.153 ( 6.450 8.003 -5.196) 11.518 12.632 ( -6.853 -9.957 11.888) 16.954 12.632 ( -6.853 9.957 11.888) 16.954 13.206 ( -3.986 -5.174 3.222) 7.283 13.206 ( -3.986 5.174 3.222) 7.283 13.489 ( 8.240 -11.094 -13.525) 19.337 13.489 ( 8.240 11.094 -13.525) 19.337 13.742 ( -4.163 -7.258 -7.117) 10.985 13.742 ( -4.163 7.258 -7.117) 10.985 14.489 ( -16.011 -14.188 9.355) 23.349 14.489 ( -16.011 14.188 9.355) 23.349 14.847 ( -4.145 -2.076 8.358) 9.557 14.847 ( -4.145 2.076 8.358) 9.557 15.130 ( 0.661 -6.422 2.075) 6.781 15.130 ( 0.661 6.422 2.075) 6.781 15.866 ( 5.479 -10.743 2.434) 12.303 15.866 ( 5.479 10.743 2.434) 12.303 16.072 ( 5.669 -2.490 -0.688) 6.230 16.072 ( 5.669 2.490 -0.688) 6.230 16.449 ( -9.231 -3.037 5.603) 11.217 16.449 ( -9.231 3.037 5.603) 11.217 17.043 ( 11.860 -2.241 -4.856) 13.010 17.043 ( 11.860 2.241 -4.856) 13.010 18.936 ( -3.253 -10.204 -5.749) 12.156 18.936 ( -3.253 10.204 -5.749) 12.156 19.477 ( 1.851 -1.352 2.926) 3.717 19.477 ( 1.851 1.352 2.926) 3.717 22.453 ( 2.630 -2.726 -12.069) 12.650 22.453 ( 2.630 2.726 -12.069) 12.650 22.704 ( 2.858 -3.116 -12.093) 12.811 22.704 ( 2.858 3.116 -12.093) 12.811 25.120 ( -1.714 -1.049 7.023) 7.305 25.120 ( -1.714 1.049 7.023) 7.305 25.556 ( -5.888 -0.924 3.864) 7.103 25.556 ( -5.888 0.924 3.864) 7.103 25.779 ( 9.298 -3.987 -0.686) 10.139 25.779 ( 9.298 3.987 -0.686) 10.139 27.889 ( 2.008 -13.607 -13.371) 19.183 27.889 ( 2.008 13.607 -13.371) 19.183 28.702 ( 0.158 -4.880 1.538) 5.119 28.702 ( 0.158 4.880 1.538) 5.119 29.092 ( -0.614 -2.687 -8.791) 9.213 29.092 ( -0.614 2.687 -8.791) 9.213 29.497 ( 3.286 -2.316 0.966) 4.135 29.497 ( 3.286 2.316 0.966) 4.135 29.923 ( -5.134 -1.941 16.753) 17.629 29.923 ( -5.134 1.941 16.753) 17.629 30.236 ( -2.722 -3.087 19.109) 19.547 30.236 ( -2.722 3.087 19.109) 19.547 30.942 ( 0.620 -11.760 4.055) 12.455 30.942 ( 0.620 11.760 4.055) 12.455 31.541 ( -0.079 -5.985 3.470) 6.919 31.541 ( -0.079 5.985 3.470) 6.919 33.450 ( -0.833 -9.250 -19.466) 21.568 33.450 ( -0.833 9.250 -19.466) 21.568 ======================= Grid point 52 (29/104) ======================= q-point: ( 0.20 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.607 ( -2.890 -18.963 31.903) 37.225 2.607 ( -2.890 18.963 31.903) 37.225 2.691 ( 11.895 -19.137 10.836) 25.003 2.691 ( 11.895 19.137 10.836) 25.003 3.249 ( -4.509 -9.404 12.135) 16.001 3.249 ( -4.509 9.404 12.135) 16.001 3.608 ( -1.761 -13.975 13.115) 19.246 3.608 ( -1.761 13.975 13.115) 19.246 3.744 ( -3.384 -11.270 18.183) 21.658 3.744 ( -3.384 11.270 18.183) 21.658 4.087 ( 0.315 -10.103 4.705) 11.149 4.087 ( 0.315 10.103 4.705) 11.149 4.859 ( -10.695 -8.636 3.144) 14.102 4.859 ( -10.695 8.636 3.144) 14.102 5.423 ( 5.852 -3.294 4.927) 8.329 5.423 ( 5.852 3.294 4.927) 8.329 5.519 ( 4.947 -7.147 6.067) 10.600 5.519 ( 4.947 7.147 6.067) 10.600 5.683 ( -11.737 -4.770 2.672) 12.948 5.683 ( -11.737 4.770 2.672) 12.948 5.971 ( 2.676 -7.310 5.690) 9.642 5.971 ( 2.676 7.310 5.690) 9.642 6.452 ( 3.057 -7.914 8.769) 12.201 6.452 ( 3.057 7.914 8.769) 12.201 6.991 ( 9.397 -1.369 9.412) 13.370 6.991 ( 9.397 1.369 9.412) 13.370 7.088 ( -4.562 -7.355 -7.844) 11.680 7.088 ( -4.562 7.355 -7.844) 11.680 7.678 ( -4.695 -6.349 4.537) 9.107 7.678 ( -4.695 6.349 4.537) 9.107 7.751 ( -5.731 -5.769 -3.189) 8.735 7.751 ( -5.731 5.769 -3.189) 8.735 8.146 ( 4.622 -2.125 -11.462) 12.540 8.146 ( 4.622 2.125 -11.462) 12.540 8.451 ( -1.876 -10.394 -5.708) 12.005 8.451 ( -1.876 10.394 -5.708) 12.005 8.681 ( -1.282 -6.780 -0.306) 6.907 8.681 ( -1.282 6.780 -0.306) 6.907 8.789 ( -3.560 -5.671 -2.738) 7.234 8.789 ( -3.560 5.671 -2.738) 7.234 9.073 ( 5.408 -2.467 -8.365) 10.262 9.073 ( 5.408 2.467 -8.365) 10.262 9.305 ( -0.341 -2.639 -3.951) 4.764 9.305 ( -0.341 2.639 -3.951) 4.764 9.472 ( 3.023 -4.349 1.656) 5.550 9.472 ( 3.023 4.349 1.656) 5.550 9.546 ( 3.825 -4.067 -1.697) 5.835 9.546 ( 3.825 4.067 -1.697) 5.835 10.000 ( 9.946 -4.218 -5.055) 11.927 10.000 ( 9.946 4.218 -5.055) 11.927 10.372 ( -3.961 -2.411 1.874) 5.002 10.372 ( -3.961 2.411 1.874) 5.002 10.416 ( -5.132 -3.821 0.150) 6.400 10.416 ( -5.132 3.821 0.150) 6.400 10.677 ( 2.465 -4.537 -2.917) 5.930 10.677 ( 2.465 4.537 -2.917) 5.930 10.899 ( -0.349 -4.865 -4.928) 6.934 10.899 ( -0.349 4.865 -4.928) 6.934 11.432 ( -1.426 -2.733 2.940) 4.260 11.432 ( -1.426 2.733 2.940) 4.260 11.667 ( -5.829 -6.199 1.383) 8.621 11.667 ( -5.829 6.199 1.383) 8.621 11.882 ( 2.039 -4.070 1.805) 4.897 11.882 ( 2.039 4.070 1.805) 4.897 12.227 ( 0.187 -4.508 -2.001) 4.936 12.227 ( 0.187 4.508 -2.001) 4.936 12.530 ( -4.475 -5.736 8.718) 11.355 12.530 ( -4.475 5.736 8.718) 11.355 13.189 ( 0.694 -4.240 0.655) 4.346 13.189 ( 0.694 4.240 0.655) 4.346 13.573 ( 1.763 -2.656 -14.337) 14.687 13.573 ( 1.763 2.656 -14.337) 14.687 13.660 ( 3.469 -4.739 -5.847) 8.287 13.660 ( 3.469 4.739 -5.847) 8.287 14.125 ( -17.726 -7.991 15.166) 24.659 14.125 ( -17.726 7.991 15.166) 24.659 14.832 ( 0.675 -5.673 -0.228) 5.717 14.832 ( 0.675 5.673 -0.228) 5.717 15.131 ( -1.200 -6.607 3.507) 7.576 15.131 ( -1.200 6.607 3.507) 7.576 15.839 ( -10.520 -6.371 1.936) 12.450 15.839 ( -10.520 6.371 1.936) 12.450 16.196 ( 6.836 -4.125 -0.383) 7.993 16.196 ( 6.836 4.125 -0.383) 7.993 16.405 ( 1.386 -6.941 9.326) 11.708 16.405 ( 1.386 6.941 9.326) 11.708 17.215 ( 4.521 -5.291 -5.577) 8.919 17.215 ( 4.521 5.291 -5.577) 8.919 18.706 ( -11.562 -4.341 -2.468) 12.594 18.706 ( -11.562 4.341 -2.468) 12.594 19.626 ( 8.289 -3.650 -0.608) 9.078 19.626 ( 8.289 3.650 -0.608) 9.078 22.446 ( 2.032 -2.577 -12.313) 12.743 22.446 ( 2.032 2.577 -12.313) 12.743 22.708 ( 2.550 -2.974 -11.802) 12.435 22.708 ( 2.550 2.974 -11.802) 12.435 25.068 ( -4.175 -0.678 6.240) 7.538 25.068 ( -4.175 0.678 6.240) 7.538 25.494 ( -1.857 -0.615 5.623) 5.954 25.494 ( -1.857 0.615 5.623) 5.954 26.280 ( 31.968 -6.296 -2.551) 32.682 26.280 ( 31.968 6.296 -2.551) 32.682 27.791 ( -5.540 -13.289 -14.306) 20.297 27.791 ( -5.540 13.289 -14.306) 20.297 28.678 ( -2.370 -4.623 -0.053) 5.195 28.678 ( -2.370 4.623 -0.053) 5.195 29.024 ( -1.430 -1.919 -5.688) 6.171 29.024 ( -1.430 1.919 -5.688) 6.171 29.594 ( 2.731 -3.248 4.843) 6.439 29.594 ( 2.731 3.248 4.843) 6.439 29.908 ( -1.984 -2.560 10.945) 11.414 29.908 ( -1.984 2.560 10.945) 11.414 30.324 ( 1.776 -5.081 19.959) 20.672 30.324 ( 1.776 5.081 19.959) 20.672 30.969 ( -0.653 -11.001 6.437) 12.762 30.969 ( -0.653 11.001 6.437) 12.762 31.586 ( 2.764 -4.792 4.552) 7.164 31.586 ( 2.764 4.792 4.552) 7.164 33.173 ( -13.372 -3.858 -21.383) 25.513 33.173 ( -13.372 3.858 -21.383) 25.513 ======================= Grid point 54 (30/104) ======================= q-point: ( 0.40 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.703 ( -0.423 -15.500 20.482) 25.689 2.703 ( -0.423 15.500 20.482) 25.689 3.008 ( 6.621 -11.158 18.253) 22.394 3.008 ( 6.621 11.158 18.253) 22.394 3.215 ( -3.580 -13.022 17.447) 22.063 3.215 ( -3.580 13.022 17.447) 22.063 3.515 ( -6.738 -11.352 14.399) 19.535 3.515 ( -6.738 11.352 14.399) 19.535 3.915 ( 4.090 -3.573 14.272) 15.271 3.915 ( 4.090 3.573 14.272) 15.271 4.163 ( 6.883 -17.022 1.712) 18.440 4.163 ( 6.883 17.022 1.712) 18.440 4.615 ( -11.870 -12.942 1.106) 17.596 4.615 ( -11.870 12.942 1.106) 17.596 5.201 ( -17.929 -5.070 6.692) 19.798 5.201 ( -17.929 5.070 6.692) 19.798 5.546 ( 1.939 -6.720 0.583) 7.018 5.546 ( 1.939 6.720 0.583) 7.018 5.711 ( 1.842 -1.706 4.246) 4.933 5.711 ( 1.842 1.706 4.246) 4.933 6.227 ( 9.957 -11.720 12.808) 20.014 6.227 ( 9.957 11.720 12.808) 20.014 6.535 ( 0.108 -7.561 9.877) 12.439 6.535 ( 0.108 7.561 9.877) 12.439 6.957 ( -2.746 -13.560 -7.561) 15.766 6.957 ( -2.746 13.560 -7.561) 15.766 7.132 ( -0.386 -5.409 -1.467) 5.618 7.132 ( -0.386 5.409 -1.467) 5.618 7.551 ( -6.118 -7.391 3.698) 10.282 7.551 ( -6.118 7.391 3.698) 10.282 7.700 ( 1.711 -9.137 8.263) 12.438 7.700 ( 1.711 9.137 8.263) 12.438 8.230 ( 5.247 -1.969 -9.560) 11.082 8.230 ( 5.247 1.969 -9.560) 11.082 8.376 ( 0.890 -5.984 -7.077) 9.310 8.376 ( 0.890 5.984 -7.077) 9.310 8.652 ( -2.298 -9.716 -5.678) 11.486 8.652 ( -2.298 9.716 -5.678) 11.486 8.707 ( -1.286 -4.335 -0.509) 4.550 8.707 ( -1.286 4.335 -0.509) 4.550 9.150 ( 3.570 -5.744 -7.922) 10.416 9.150 ( 3.570 5.744 -7.922) 10.416 9.255 ( -2.400 -3.761 -2.147) 4.951 9.255 ( -2.400 3.761 -2.147) 4.951 9.462 ( -4.686 -5.838 3.907) 8.444 9.462 ( -4.686 5.838 3.907) 8.444 9.641 ( 5.925 -4.417 -7.653) 10.638 9.641 ( 5.925 4.417 -7.653) 10.638 10.211 ( 5.647 -2.463 -8.482) 10.483 10.211 ( 5.647 2.463 -8.482) 10.484 10.291 ( -0.731 -5.533 -1.882) 5.890 10.291 ( -0.731 5.533 -1.882) 5.890 10.344 ( 0.942 -3.759 4.828) 6.191 10.344 ( 0.942 3.759 4.828) 6.191 10.714 ( 0.463 -0.670 0.501) 0.956 10.714 ( 0.463 0.670 0.501) 0.956 10.898 ( 3.367 -1.639 -8.088) 8.913 10.898 ( 3.367 1.639 -8.088) 8.913 11.328 ( -8.068 -5.597 8.440) 12.948 11.328 ( -8.068 5.597 8.440) 12.948 11.568 ( -1.823 -6.315 -1.123) 6.668 11.568 ( -1.823 6.315 -1.123) 6.668 11.917 ( -2.830 -4.895 3.145) 6.470 11.917 ( -2.830 4.895 3.145) 6.470 12.176 ( -2.278 -2.938 1.832) 4.144 12.176 ( -2.278 2.938 1.832) 4.144 12.560 ( 4.760 -10.686 -3.529) 12.219 12.560 ( 4.760 10.686 -3.529) 12.219 13.188 ( -0.804 -5.012 -0.503) 5.100 13.188 ( -0.804 5.012 -0.503) 5.100 13.497 ( -2.294 -8.527 -3.139) 9.371 13.497 ( -2.294 8.527 -3.139) 9.371 13.771 ( 3.999 -2.089 3.005) 5.421 13.771 ( 3.999 2.089 3.005) 5.421 13.992 ( 0.134 -3.550 11.014) 11.573 13.992 ( 0.134 3.550 11.014) 11.573 14.867 ( 3.516 -3.772 -3.560) 6.266 14.867 ( 3.516 3.772 -3.560) 6.266 15.139 ( -0.789 -9.876 7.141) 12.213 15.139 ( -0.789 9.876 7.141) 12.213 15.607 ( -8.682 -3.345 2.262) 9.575 15.607 ( -8.682 3.345 2.262) 9.575 16.313 ( 3.075 -1.481 1.916) 3.914 16.313 ( 3.075 1.481 1.916) 3.914 16.454 ( -1.833 -0.461 5.557) 5.869 16.454 ( -1.833 0.461 5.557) 5.869 17.183 ( -2.643 -1.851 -11.194) 11.649 17.183 ( -2.643 1.851 -11.194) 11.649 18.539 ( -2.985 -6.207 1.506) 7.050 18.539 ( -2.985 6.207 1.506) 7.050 19.754 ( 3.844 -2.732 -3.781) 6.044 19.754 ( 3.844 2.732 -3.781) 6.044 22.435 ( 2.341 -1.486 -12.731) 13.030 22.435 ( 2.341 1.486 -12.731) 13.030 22.706 ( 2.326 -1.797 -11.807) 12.167 22.706 ( 2.326 1.797 -11.807) 12.167 25.027 ( -2.404 -1.126 6.470) 6.994 25.027 ( -2.404 1.126 6.470) 6.994 25.496 ( -0.911 -0.115 6.729) 6.792 25.496 ( -0.911 0.115 6.729) 6.792 26.914 ( 24.624 -11.783 -8.229) 28.512 26.914 ( 24.624 11.783 -8.229) 28.512 27.523 ( -11.138 -13.232 -15.487) 23.216 27.523 ( -11.138 13.232 -15.487) 23.216 28.633 ( -1.130 -2.340 -0.585) 2.663 28.633 ( -1.130 2.340 -0.585) 2.663 28.992 ( 0.012 -2.162 -1.780) 2.801 28.992 ( 0.012 2.162 -1.780) 2.801 29.627 ( -1.741 -1.469 5.905) 6.329 29.627 ( -1.741 1.469 5.905) 6.329 29.931 ( -0.756 -2.455 10.060) 10.383 29.931 ( -0.756 2.455 10.060) 10.383 30.438 ( -0.134 -6.136 15.789) 16.940 30.438 ( -0.134 6.136 15.789) 16.940 30.963 ( -3.013 -4.978 8.110) 9.981 30.963 ( -3.013 4.978 8.110) 9.981 31.668 ( 0.863 -2.665 4.835) 5.588 31.668 ( 0.863 2.665 4.835) 5.588 32.865 ( -2.513 -2.239 -18.166) 18.475 32.865 ( -2.513 2.239 -18.166) 18.475 ======================= Grid point 56 (31/104) ======================= q-point: (-0.40 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.721 ( -8.195 -11.609 26.525) 30.092 2.721 ( -8.195 11.609 26.525) 30.092 3.014 ( -8.455 -16.180 5.429) 19.046 3.014 ( -8.455 16.180 5.429) 19.046 3.253 ( -3.956 -3.011 19.018) 19.658 3.253 ( -3.956 3.011 19.018) 19.658 3.558 ( 1.087 -9.218 23.583) 25.343 3.558 ( 1.087 9.218 23.583) 25.343 3.901 ( -10.307 -3.387 16.653) 19.875 3.901 ( -10.307 3.387 16.653) 19.875 4.282 ( 2.040 -13.448 -3.022) 13.933 4.282 ( 2.040 13.448 -3.022) 13.933 4.457 ( -3.003 -6.245 3.506) 7.766 4.457 ( -3.003 6.245 3.506) 7.766 5.117 ( 8.727 -2.402 3.964) 9.882 5.117 ( 8.727 2.402 3.964) 9.882 5.526 ( -3.348 -5.940 -0.963) 6.886 5.526 ( -3.348 5.940 -0.963) 6.886 5.720 ( -2.010 -2.843 5.251) 6.300 5.720 ( -2.010 2.843 5.251) 6.300 6.251 ( -12.591 -18.961 8.806) 24.405 6.251 ( -12.591 18.961 8.806) 24.405 6.554 ( -2.148 -3.022 10.109) 10.767 6.554 ( -2.148 3.022 10.109) 10.767 6.942 ( 2.237 -7.578 -6.008) 9.926 6.942 ( 2.237 7.578 -6.008) 9.926 7.102 ( 1.163 -3.098 0.468) 3.342 7.102 ( 1.163 3.098 0.468) 3.342 7.512 ( 0.593 -9.239 5.768) 10.908 7.512 ( 0.593 9.239 5.768) 10.908 7.828 ( 4.290 -5.060 6.871) 9.551 7.828 ( 4.290 5.060 6.871) 9.551 8.233 ( 0.797 -4.107 -6.887) 8.058 8.233 ( 0.797 4.107 -6.887) 8.058 8.458 ( 6.406 -2.880 -12.345) 14.203 8.458 ( 6.406 2.880 -12.345) 14.203 8.574 ( -0.210 -7.046 -6.284) 9.443 8.574 ( -0.210 7.046 -6.284) 9.443 8.687 ( -0.286 -3.599 -1.031) 3.754 8.687 ( -0.286 3.599 -1.031) 3.754 9.125 ( -3.862 -2.515 3.578) 5.834 9.125 ( -3.862 2.515 3.578) 5.834 9.217 ( 1.802 -5.517 -10.582) 12.069 9.217 ( 1.802 5.517 -10.582) 12.069 9.406 ( -0.018 -6.367 -0.035) 6.367 9.406 ( -0.018 6.367 -0.035) 6.367 9.686 ( 0.596 -3.658 -7.290) 8.178 9.686 ( 0.596 3.658 -7.290) 8.178 10.022 ( -8.687 -11.149 -9.669) 17.125 10.022 ( -8.687 11.149 -9.669) 17.125 10.355 ( 1.834 -5.867 1.079) 6.241 10.355 ( 1.834 5.867 1.079) 6.241 10.549 ( 10.107 -2.472 3.311) 10.919 10.549 ( 10.107 2.472 3.311) 10.919 10.697 ( -2.620 -6.905 3.107) 8.012 10.697 ( -2.620 6.905 3.107) 8.012 10.941 ( 2.593 -3.464 -5.741) 7.189 10.941 ( 2.593 3.464 -5.741) 7.189 11.286 ( 0.977 -4.040 4.835) 6.376 11.286 ( 0.977 4.040 4.835) 6.376 11.562 ( 2.194 -6.713 0.162) 7.064 11.562 ( 2.194 6.713 0.162) 7.064 11.816 ( -5.281 -3.185 1.612) 6.375 11.816 ( -5.281 3.185 1.612) 6.375 12.139 ( -2.410 -3.378 -0.679) 4.205 12.139 ( -2.410 3.378 -0.679) 4.205 12.650 ( 3.930 -8.529 -2.530) 9.726 12.650 ( 3.930 8.529 -2.530) 9.726 13.198 ( 3.354 -9.822 -3.188) 10.858 13.198 ( 3.354 9.822 -3.188) 10.858 13.450 ( -2.545 -10.424 1.730) 10.869 13.450 ( -2.545 10.424 1.730) 10.869 13.842 ( 1.276 -5.582 4.372) 7.204 13.842 ( 1.276 5.582 4.372) 7.204 14.172 ( 9.115 -3.359 18.123) 20.563 14.172 ( 9.115 3.359 18.123) 20.563 14.943 ( 3.047 -3.121 -0.578) 4.400 14.943 ( 3.047 3.121 -0.578) 4.400 15.107 ( -3.705 -12.475 4.875) 13.896 15.107 ( -3.705 12.475 4.875) 13.896 15.588 ( 5.294 -3.871 3.039) 7.228 15.588 ( 5.294 3.871 3.039) 7.228 16.263 ( -9.196 -10.527 -3.828) 14.492 16.263 ( -9.196 10.527 -3.828) 14.492 16.441 ( 0.933 -1.715 8.444) 8.667 16.441 ( 0.933 1.715 8.444) 8.667 17.056 ( -3.046 -4.950 -15.747) 16.785 17.056 ( -3.046 4.950 -15.747) 16.785 18.591 ( 6.586 -14.456 2.411) 16.067 18.591 ( 6.586 14.456 2.411) 16.067 19.738 ( -3.644 -1.821 -4.145) 5.812 19.738 ( -3.644 1.821 -4.145) 5.812 22.433 ( 2.988 -0.113 -12.853) 13.196 22.433 ( 2.988 0.113 -12.853) 13.196 22.701 ( 2.380 -0.207 -12.054) 12.288 22.701 ( 2.380 0.207 -12.054) 12.288 25.025 ( -0.570 -1.096 6.903) 7.012 25.025 ( -0.570 1.096 6.903) 7.012 25.512 ( -0.550 -0.447 7.052) 7.088 25.512 ( -0.550 0.447 7.052) 7.088 26.801 ( -25.736 -11.696 -13.341) 31.259 26.801 ( -25.736 11.696 -13.341) 31.259 27.578 ( 17.819 -13.131 -13.203) 25.773 27.578 ( 17.819 13.131 -13.203) 25.773 28.631 ( 0.919 -1.004 0.444) 1.432 28.631 ( 0.919 1.004 0.444) 1.432 29.010 ( 2.412 -2.445 -1.140) 3.619 29.010 ( 2.412 2.445 -1.140) 3.619 29.586 ( -3.504 -0.072 1.715) 3.902 29.586 ( -3.504 0.072 1.715) 3.902 29.954 ( -2.346 -1.536 13.903) 14.183 29.954 ( -2.346 1.536 13.903) 14.183 30.423 ( -7.891 -5.745 14.716) 17.659 30.423 ( -7.891 5.745 14.716) 17.659 30.928 ( -2.631 -5.973 5.581) 8.588 30.928 ( -2.631 5.973 5.581) 8.588 31.624 ( -4.833 -3.814 2.128) 6.514 31.624 ( -4.833 3.814 2.128) 6.514 32.986 ( 17.942 -1.058 -12.040) 21.633 32.986 ( 17.942 1.058 -12.040) 21.633 ======================= Grid point 58 (32/104) ======================= q-point: (-0.20 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.621 ( -11.823 -19.870 26.291) 35.012 2.621 ( -11.823 19.870 26.291) 35.012 2.773 ( -16.317 -19.221 17.571) 30.732 2.773 ( -16.317 19.221 17.571) 30.732 3.242 ( -2.003 -10.049 9.595) 14.038 3.242 ( -2.003 10.049 9.595) 14.038 3.581 ( -7.537 -13.816 19.320) 24.919 3.581 ( -7.537 13.816 19.320) 24.919 3.860 ( -1.987 -0.884 22.779) 22.883 3.860 ( -1.987 0.884 22.779) 22.883 4.189 ( -8.103 -7.100 2.805) 11.133 4.189 ( -8.103 7.100 2.805) 11.133 4.611 ( 14.608 -3.315 2.195) 15.140 4.611 ( 14.608 3.315 2.195) 15.140 5.218 ( -4.298 -3.568 -2.283) 6.035 5.218 ( -4.298 3.568 -2.283) 6.035 5.571 ( 2.437 -13.886 4.817) 14.898 5.571 ( 2.437 13.886 4.817) 14.898 5.715 ( 3.677 -3.562 3.044) 5.956 5.715 ( 3.677 3.562 3.044) 5.956 6.006 ( -7.292 -13.749 3.436) 15.938 6.006 ( -7.292 13.749 3.436) 15.938 6.504 ( -7.154 -3.130 9.230) 12.090 6.504 ( -7.154 3.130 9.230) 12.090 6.889 ( -5.946 -5.877 5.795) 10.172 6.889 ( -5.946 5.877 5.795) 10.172 7.171 ( 2.974 -9.599 -0.816) 10.082 7.171 ( 2.974 9.599 -0.816) 10.082 7.607 ( 4.982 -5.539 3.383) 8.182 7.607 ( 4.982 5.539 3.383) 8.182 7.873 ( -1.041 -2.503 0.132) 2.714 7.873 ( -1.041 2.503 0.132) 2.714 8.286 ( 6.471 -1.733 -14.745) 16.195 8.286 ( 6.471 1.733 -14.745) 16.195 8.361 ( -3.304 -4.567 -9.927) 11.416 8.361 ( -3.304 4.567 -9.927) 11.416 8.675 ( 2.386 -2.264 -0.542) 3.334 8.675 ( 2.386 2.264 -0.542) 3.334 8.708 ( 5.132 -9.195 1.149) 10.593 8.708 ( 5.132 9.195 1.149) 10.593 9.093 ( 1.338 -2.928 -4.887) 5.852 9.093 ( 1.338 2.928 -4.887) 5.852 9.232 ( 2.903 -1.093 -5.198) 6.053 9.232 ( 2.903 1.093 -5.198) 6.053 9.427 ( 0.713 -6.658 -0.218) 6.699 9.427 ( 0.713 6.658 -0.218) 6.699 9.581 ( -6.085 -0.657 -4.201) 7.423 9.581 ( -6.085 0.657 -4.201) 7.423 9.883 ( -0.455 -4.954 -9.681) 10.885 9.883 ( -0.455 4.954 -9.681) 10.885 10.391 ( 1.330 -1.543 0.889) 2.223 10.391 ( 1.330 1.543 0.889) 2.223 10.604 ( -5.006 -5.728 2.666) 8.060 10.604 ( -5.006 5.728 2.666) 8.060 10.704 ( 0.276 -6.334 5.523) 8.408 10.704 ( 0.276 6.334 5.523) 8.408 10.949 ( 0.743 -5.588 -4.865) 7.446 10.949 ( 0.743 5.588 -4.865) 7.446 11.356 ( 3.104 -0.575 2.152) 3.820 11.356 ( 3.104 0.575 2.152) 3.820 11.626 ( 1.120 -4.228 1.206) 4.537 11.626 ( 1.120 4.228 1.206) 4.537 11.805 ( 6.077 -1.302 -4.966) 7.955 11.805 ( 6.077 1.302 -4.966) 7.955 12.092 ( -0.906 -4.937 1.686) 5.295 12.092 ( -0.906 4.937 1.686) 5.295 12.680 ( -1.601 -11.063 5.332) 12.385 12.680 ( -1.601 11.063 5.332) 12.385 13.266 ( 1.721 -10.529 -4.145) 11.445 13.266 ( 1.721 10.529 -4.145) 11.445 13.408 ( 0.816 -11.501 -2.824) 11.871 13.408 ( 0.816 11.501 -2.824) 11.871 13.840 ( -2.206 -6.711 -2.345) 7.443 13.840 ( -2.206 6.711 -2.345) 7.443 14.489 ( 7.890 -11.471 23.998) 27.744 14.489 ( 7.890 11.471 23.998) 27.744 14.914 ( -4.744 -6.979 5.736) 10.204 14.914 ( -4.744 6.979 5.736) 10.204 15.116 ( 0.746 -10.095 1.067) 10.178 15.116 ( 0.746 10.095 1.067) 10.178 15.749 ( 6.355 -5.995 0.898) 8.782 15.749 ( 6.355 5.995 0.898) 8.782 16.036 ( -4.907 -12.026 -6.570) 14.556 16.036 ( -4.907 12.026 -6.570) 14.556 16.533 ( 0.264 -4.877 14.394) 15.200 16.533 ( 0.264 4.877 14.394) 15.200 16.930 ( 0.631 -2.005 -17.770) 17.894 16.930 ( 0.631 2.005 -17.770) 17.894 18.810 ( 11.912 -15.023 -0.391) 19.176 18.810 ( 11.912 15.023 -0.391) 19.176 19.583 ( -8.542 -1.800 -1.403) 8.842 19.583 ( -8.542 1.800 -1.403) 8.842 22.444 ( 3.332 -1.723 -12.469) 13.021 22.444 ( 3.332 1.723 -12.469) 13.021 22.700 ( 2.685 -2.065 -12.225) 12.685 22.700 ( 2.685 2.065 -12.225) 12.685 25.068 ( 1.573 -0.538 7.267) 7.455 25.068 ( 1.573 0.538 7.267) 7.455 25.541 ( 0.560 -0.735 6.863) 6.925 25.541 ( 0.560 0.735 6.863) 6.925 26.115 ( -28.838 -4.111 -9.555) 30.657 26.115 ( -28.838 4.111 -9.555) 30.657 27.825 ( 10.035 -13.605 -13.425) 21.588 27.825 ( 10.035 13.605 -13.425) 21.588 28.668 ( 1.837 -3.284 1.395) 4.013 28.668 ( 1.837 3.284 1.395) 4.013 29.077 ( 4.143 -2.737 -4.022) 6.390 29.077 ( 4.143 2.737 -4.022) 6.390 29.506 ( -3.171 -0.882 -1.960) 3.831 29.506 ( -3.171 0.882 -1.960) 3.831 29.953 ( -4.613 -1.363 17.872) 18.508 29.953 ( -4.613 1.363 17.872) 18.508 30.287 ( -9.366 -4.029 16.337) 19.257 30.287 ( -9.366 4.029 16.337) 19.257 30.918 ( -0.148 -10.744 3.115) 11.187 30.918 ( -0.148 10.744 3.115) 11.187 31.553 ( -2.409 -5.862 2.552) 6.833 31.553 ( -2.409 5.862 2.552) 6.833 33.342 ( 16.820 -6.433 -13.726) 22.643 33.342 ( 16.820 6.433 -13.726) 22.643 ======================= Grid point 70 (33/104) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.612 ( 6.120 0.000 43.267) 43.698 1.672 ( 19.095 0.000 48.832) 52.433 2.416 ( 1.734 0.000 5.827) 6.079 2.694 ( -9.053 0.000 60.099) 60.777 3.458 ( -10.057 0.000 26.344) 28.198 3.682 ( -3.548 0.000 4.091) 5.415 3.808 ( 1.766 0.000 9.941) 10.097 4.074 ( -4.790 0.000 19.546) 20.125 4.205 ( -5.114 0.000 30.194) 30.624 4.503 ( -4.168 0.000 23.034) 23.408 4.652 ( 17.881 0.000 3.042) 18.138 4.763 ( -9.049 0.000 36.700) 37.799 4.904 ( -11.209 0.000 1.950) 11.377 5.037 ( -6.695 0.000 23.299) 24.241 5.223 ( -12.712 0.000 30.174) 32.743 5.245 ( -14.455 0.000 -5.279) 15.389 5.384 ( -6.517 0.000 29.140) 29.860 5.602 ( 3.340 0.000 11.805) 12.268 5.690 ( -0.896 0.000 20.726) 20.745 5.816 ( -4.148 0.000 -9.970) 10.799 6.427 ( -3.778 0.000 -0.271) 3.787 6.488 ( 5.070 0.000 7.181) 8.790 6.587 ( -5.377 0.000 -12.558) 13.660 6.655 ( 8.565 0.000 1.588) 8.711 6.896 ( -1.432 0.000 -10.040) 10.142 7.047 ( 8.097 0.000 -10.761) 13.467 7.196 ( 6.124 0.000 -4.124) 7.383 7.208 ( -7.891 0.000 -0.619) 7.915 7.397 ( -13.474 0.000 -10.227) 16.916 7.582 ( 2.275 0.000 4.685) 5.208 7.634 ( -5.826 0.000 -4.835) 7.571 7.917 ( 2.737 0.000 -17.516) 17.729 8.030 ( 3.711 0.000 -9.577) 10.271 8.109 ( 3.166 0.000 -4.465) 5.474 8.158 ( 1.984 0.000 -0.236) 1.998 8.361 ( 0.595 0.000 -10.576) 10.593 8.383 ( 7.584 0.000 -10.238) 12.741 8.495 ( 3.385 0.000 -13.381) 13.803 8.646 ( -4.410 0.000 8.451) 9.532 8.835 ( -2.919 0.000 -2.272) 3.699 8.845 ( 8.084 0.000 0.270) 8.088 8.969 ( 8.388 0.000 -12.587) 15.126 9.132 ( 3.065 0.000 5.528) 6.320 9.165 ( -5.647 0.000 0.804) 5.704 9.447 ( 4.175 0.000 2.321) 4.777 9.624 ( 10.149 0.000 13.232) 16.676 9.675 ( 2.793 0.000 -3.052) 4.137 9.818 ( 1.330 0.000 -7.417) 7.535 9.942 ( 5.437 0.000 4.346) 6.960 10.101 ( -3.466 0.000 7.303) 8.083 10.195 ( 0.796 0.000 -5.849) 5.903 10.315 ( 0.796 0.000 -7.345) 7.388 10.376 ( 0.217 0.000 -18.621) 18.622 10.390 ( 1.552 0.000 0.586) 1.659 10.647 ( -2.011 0.000 -4.422) 4.858 10.812 ( 2.146 0.000 1.278) 2.498 11.030 ( -0.585 0.000 0.583) 0.826 11.040 ( -3.348 0.000 1.337) 3.605 11.082 ( -0.128 0.000 -3.969) 3.971 11.448 ( -6.874 0.000 8.372) 10.833 11.466 ( -5.775 0.000 0.341) 5.785 11.683 ( -0.083 0.000 3.633) 3.633 11.795 ( 0.092 0.000 3.098) 3.099 11.950 ( -6.473 0.000 5.763) 8.666 12.236 ( 9.775 0.000 -2.396) 10.064 12.263 ( -9.315 0.000 0.578) 9.333 12.511 ( 3.890 0.000 -4.079) 5.636 12.621 ( 14.574 0.000 -6.695) 16.038 13.130 ( -6.249 0.000 15.393) 16.614 13.131 ( 1.964 0.000 -7.044) 7.313 13.214 ( -10.951 0.000 -2.302) 11.190 13.828 ( 2.799 0.000 -12.478) 12.788 13.937 ( -4.320 0.000 0.669) 4.371 14.077 ( 4.662 0.000 5.646) 7.322 14.252 ( -1.087 0.000 -2.012) 2.287 14.475 ( -15.220 0.000 27.436) 31.375 14.734 ( 0.405 0.000 -7.188) 7.199 14.982 ( 1.792 0.000 0.283) 1.815 15.201 ( -1.324 0.000 -2.552) 2.875 15.547 ( 3.452 0.000 12.378) 12.851 15.859 ( 12.611 0.000 3.317) 13.040 15.947 ( 3.953 0.000 -8.654) 9.514 16.098 ( -10.568 0.000 -4.428) 11.458 16.147 ( -4.780 0.000 6.740) 8.263 16.451 ( 0.803 0.000 -8.362) 8.401 16.688 ( -12.463 0.000 4.454) 13.235 16.920 ( 4.313 0.000 -3.189) 5.364 17.209 ( -18.403 0.000 0.094) 18.403 19.040 ( -7.383 0.000 -13.131) 15.065 19.246 ( 6.509 0.000 4.205) 7.749 19.637 ( 4.704 0.000 12.127) 13.008 19.791 ( 1.660 0.000 9.798) 9.937 21.906 ( 5.898 0.000 -31.562) 32.108 22.086 ( 8.114 0.000 -25.736) 26.985 22.297 ( 0.678 0.000 -17.455) 17.468 22.450 ( 6.231 0.000 -20.117) 21.060 25.160 ( -4.162 0.000 7.075) 8.209 25.244 ( -1.406 0.000 8.911) 9.022 25.624 ( -1.894 0.000 10.017) 10.195 25.649 ( -0.949 0.000 11.610) 11.649 25.653 ( 17.051 0.000 -2.875) 17.292 25.882 ( 5.353 0.000 -8.718) 10.231 27.390 ( -2.321 0.000 -6.770) 7.157 27.918 ( 7.046 0.000 -27.548) 28.435 28.351 ( 0.630 0.000 1.262) 1.411 28.784 ( -1.901 0.000 4.274) 4.678 28.948 ( -2.388 0.000 -9.641) 9.932 29.032 ( 0.311 0.000 -8.645) 8.650 29.451 ( -9.299 0.000 5.465) 10.786 29.742 ( 6.324 0.000 6.122) 8.802 29.953 ( 19.085 0.000 -5.478) 19.856 30.213 ( -6.108 0.000 20.243) 21.145 30.418 ( -2.111 0.000 18.524) 18.644 30.666 ( 4.304 0.000 26.801) 27.145 31.107 ( -3.158 0.000 12.112) 12.517 31.242 ( 0.623 0.000 0.929) 1.119 31.695 ( -1.515 0.000 11.837) 11.934 31.877 ( -0.129 0.000 -4.302) 4.304 32.601 ( -3.697 0.000 -18.536) 18.901 32.982 ( -15.940 0.000 -6.427) 17.187 ======================= Grid point 71 (34/104) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( 18.203 0.000 36.563) 40.844 2.422 ( 23.294 0.000 40.623) 46.828 2.487 ( 0.447 0.000 7.960) 7.973 3.068 ( 15.539 0.000 51.444) 53.739 3.334 ( -13.152 0.000 30.734) 33.430 3.567 ( -8.446 0.000 0.453) 8.458 3.868 ( -0.578 0.000 11.901) 11.915 4.007 ( -5.675 0.000 9.839) 11.358 4.217 ( -2.657 0.000 19.913) 20.090 4.423 ( -17.687 0.000 33.773) 38.124 4.615 ( -11.168 0.000 25.893) 28.199 4.634 ( -14.780 0.000 -10.435) 18.092 4.863 ( -5.672 0.000 1.916) 5.987 4.969 ( -9.100 0.000 28.767) 30.172 5.166 ( 18.377 0.000 5.389) 19.151 5.284 ( 0.249 0.000 26.655) 26.656 5.458 ( -0.057 0.000 12.997) 12.997 5.551 ( -12.739 0.000 16.261) 20.657 5.638 ( -8.076 0.000 -9.045) 12.126 5.709 ( -5.054 0.000 40.429) 40.744 6.396 ( 2.218 0.000 -9.954) 10.199 6.414 ( -14.229 0.000 8.848) 16.756 6.458 ( 1.839 0.000 -7.418) 7.642 6.751 ( -7.034 0.000 -5.276) 8.792 6.942 ( 2.014 0.000 -8.964) 9.187 6.999 ( -2.484 0.000 0.603) 2.556 7.248 ( 11.541 0.000 -5.050) 12.597 7.364 ( 8.509 0.000 -2.543) 8.880 7.367 ( 16.297 0.000 1.978) 16.416 7.482 ( -2.989 0.000 -13.756) 14.077 7.650 ( 1.592 0.000 4.698) 4.960 7.836 ( -1.393 0.000 -13.771) 13.841 8.044 ( 1.830 0.000 -8.157) 8.360 8.155 ( -1.791 0.000 -0.819) 1.970 8.175 ( 2.383 0.000 -0.976) 2.576 8.340 ( 2.624 0.000 -8.366) 8.768 8.477 ( 1.582 0.000 -2.883) 3.288 8.538 ( 5.554 0.000 -12.213) 13.417 8.613 ( 0.309 0.000 0.302) 0.432 8.703 ( -6.896 0.000 -2.489) 7.331 9.049 ( 4.261 0.000 -8.729) 9.713 9.058 ( 3.606 0.000 -11.841) 12.378 9.089 ( -2.532 0.000 3.550) 4.361 9.243 ( 4.864 0.000 3.892) 6.230 9.596 ( 12.033 0.000 6.557) 13.704 9.687 ( -3.668 0.000 -0.210) 3.674 9.739 ( -4.187 0.000 -7.860) 8.905 9.913 ( 14.595 0.000 0.768) 14.616 10.075 ( 4.603 0.000 4.624) 6.524 10.094 ( -0.791 0.000 -0.007) 0.791 10.194 ( -6.993 0.000 -16.099) 17.553 10.219 ( 4.982 0.000 -9.749) 10.948 10.355 ( 3.314 0.000 -4.229) 5.373 10.400 ( 1.095 0.000 -3.406) 3.577 10.611 ( 0.407 0.000 -5.979) 5.993 10.771 ( -8.931 0.000 3.273) 9.511 10.929 ( -6.251 0.000 2.117) 6.600 11.019 ( 1.191 0.000 -4.517) 4.671 11.071 ( -0.002 0.000 -0.107) 0.107 11.300 ( -6.905 0.000 -0.068) 6.906 11.348 ( -6.590 0.000 10.884) 12.724 11.757 ( 3.873 0.000 0.991) 3.997 11.773 ( 0.816 0.000 1.021) 1.307 11.871 ( -5.759 0.000 4.138) 7.092 12.173 ( 3.964 0.000 -7.382) 8.379 12.348 ( -2.939 0.000 -0.311) 2.956 12.589 ( 4.146 0.000 1.774) 4.510 12.775 ( -0.037 0.000 -4.687) 4.687 13.080 ( -4.459 0.000 12.140) 12.933 13.103 ( 4.236 0.000 -3.980) 5.812 13.203 ( 8.546 0.000 -2.794) 8.991 13.816 ( 0.812 0.000 -9.156) 9.192 13.823 ( -4.682 0.000 -3.211) 5.677 14.042 ( -9.118 0.000 0.068) 9.118 14.271 ( 3.781 0.000 -2.531) 4.550 14.489 ( 5.430 0.000 33.962) 34.394 14.732 ( 2.915 0.000 -5.777) 6.471 15.018 ( -0.719 0.000 2.589) 2.687 15.116 ( -3.998 0.000 -2.824) 4.895 15.576 ( -28.640 0.000 24.861) 37.925 15.706 ( -1.426 0.000 19.411) 19.464 15.990 ( 1.545 0.000 -2.978) 3.355 16.085 ( -0.611 0.000 -3.398) 3.452 16.233 ( 11.222 0.000 5.444) 12.473 16.347 ( -14.097 0.000 3.519) 14.530 16.440 ( 1.419 0.000 -6.958) 7.102 16.739 ( -23.322 0.000 -0.575) 23.329 16.961 ( 0.425 0.000 -2.631) 2.665 18.787 ( -10.089 0.000 -8.869) 13.433 19.303 ( 2.867 0.000 -3.954) 4.884 19.689 ( -3.207 0.000 13.510) 13.886 19.810 ( -0.305 0.000 4.790) 4.800 21.903 ( 7.469 0.000 -32.662) 33.505 22.132 ( 5.864 0.000 -22.126) 22.889 22.234 ( 2.111 0.000 -20.731) 20.839 22.472 ( 4.186 0.000 -19.109) 19.562 25.107 ( -2.897 0.000 5.173) 5.929 25.248 ( -1.799 0.000 9.068) 9.244 25.629 ( -1.511 0.000 8.802) 8.931 25.704 ( -0.624 0.000 15.463) 15.475 26.055 ( 17.527 0.000 -9.649) 20.007 26.456 ( 43.464 0.000 -23.780) 49.544 27.215 ( -9.507 0.000 -9.600) 13.511 27.887 ( 1.777 0.000 -28.668) 28.723 28.410 ( 3.971 0.000 2.045) 4.467 28.727 ( -4.803 0.000 2.661) 5.491 28.843 ( -0.602 0.000 -12.002) 12.017 29.039 ( 1.304 0.000 -4.283) 4.477 29.323 ( -3.723 0.000 1.184) 3.907 29.872 ( 1.946 0.000 10.291) 10.473 30.099 ( -5.240 0.000 14.687) 15.594 30.183 ( -2.216 0.000 9.615) 9.867 30.817 ( 24.408 0.000 10.207) 26.456 30.925 ( 7.257 0.000 30.043) 30.907 31.091 ( -3.104 0.000 11.151) 11.575 31.260 ( 0.609 0.000 0.103) 0.618 31.716 ( -1.967 0.000 12.419) 12.574 31.843 ( -1.022 0.000 -3.207) 3.366 32.266 ( -22.143 0.000 -1.266) 22.179 32.504 ( -16.193 0.000 -17.374) 23.750 ======================= Grid point 72 (35/104) ======================= q-point: ( 0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.428 ( -11.685 0.000 9.695) 15.183 2.526 ( 5.670 0.000 17.537) 18.431 2.897 ( -27.612 0.000 20.845) 34.597 3.009 ( 14.955 0.000 35.225) 38.268 3.408 ( -3.872 0.000 6.429) 7.505 3.593 ( -1.267 0.000 26.069) 26.100 3.917 ( 0.092 0.000 11.837) 11.838 3.949 ( -7.942 0.000 20.742) 22.210 4.174 ( -9.932 0.000 33.857) 35.284 4.206 ( -14.226 0.000 -15.965) 21.384 4.516 ( 6.164 0.000 10.161) 11.884 4.526 ( 4.782 0.000 16.489) 17.168 4.947 ( -7.642 0.000 45.507) 46.144 4.953 ( 9.539 0.000 8.011) 12.456 5.223 ( -12.983 0.000 3.383) 13.417 5.326 ( -5.608 0.000 9.829) 11.316 5.351 ( -5.650 0.000 -4.979) 7.530 5.478 ( -14.464 0.000 51.698) 53.684 5.656 ( 14.222 0.000 2.949) 14.525 5.866 ( -10.278 0.000 39.395) 40.714 6.132 ( -5.032 0.000 17.504) 18.213 6.471 ( 9.216 0.000 -12.850) 15.814 6.542 ( -11.022 0.000 3.620) 11.601 6.553 ( 7.020 0.000 -3.262) 7.741 6.721 ( 0.968 0.000 -14.619) 14.652 7.247 ( -5.704 0.000 -8.334) 10.099 7.309 ( 11.212 0.000 -0.979) 11.255 7.348 ( -2.046 0.000 -10.283) 10.484 7.657 ( 7.300 0.000 1.366) 7.427 7.679 ( 14.100 0.000 -6.233) 15.416 7.695 ( 0.745 0.000 5.076) 5.131 7.838 ( 8.894 0.000 -9.098) 12.723 8.052 ( 0.972 0.000 -8.758) 8.812 8.126 ( 2.018 0.000 -0.559) 2.094 8.197 ( 0.597 0.000 1.600) 1.708 8.308 ( -2.849 0.000 -11.441) 11.790 8.370 ( -11.048 0.000 3.083) 11.470 8.615 ( 5.474 0.000 -7.691) 9.440 8.644 ( 4.568 0.000 -7.905) 9.130 8.656 ( 3.298 0.000 -1.722) 3.721 8.937 ( -5.762 0.000 -11.459) 12.826 9.049 ( 1.139 0.000 -10.006) 10.071 9.083 ( -0.013 0.000 5.347) 5.347 9.318 ( -1.342 0.000 5.295) 5.462 9.503 ( -10.396 0.000 6.777) 12.410 9.657 ( 0.379 0.000 -12.096) 12.102 9.766 ( -13.747 0.000 -19.795) 24.100 9.882 ( 6.131 0.000 -2.364) 6.571 10.049 ( -7.734 0.000 -0.939) 7.791 10.127 ( 1.022 0.000 1.452) 1.776 10.271 ( 2.101 0.000 -5.668) 6.045 10.279 ( 4.120 0.000 -9.031) 9.926 10.426 ( 6.315 0.000 -2.619) 6.837 10.439 ( -0.192 0.000 -5.853) 5.857 10.589 ( 1.189 0.000 9.013) 9.091 10.656 ( 9.381 0.000 -6.826) 11.602 10.854 ( -0.279 0.000 -0.901) 0.943 11.042 ( 1.470 0.000 -3.700) 3.981 11.089 ( 1.149 0.000 2.459) 2.714 11.205 ( -1.191 0.000 -2.321) 2.608 11.285 ( -2.185 0.000 10.049) 10.284 11.699 ( -4.761 0.000 -0.711) 4.814 11.840 ( 3.797 0.000 -0.116) 3.799 11.961 ( 10.837 0.000 -3.686) 11.447 12.124 ( -13.942 0.000 3.335) 14.335 12.270 ( 5.281 0.000 -4.357) 6.846 12.693 ( 2.253 0.000 9.510) 9.773 12.753 ( -1.995 0.000 -3.812) 4.302 13.050 ( -2.399 0.000 9.509) 9.807 13.057 ( -4.991 0.000 2.020) 5.384 13.523 ( 17.044 0.000 -3.689) 17.439 13.747 ( 0.715 0.000 -11.819) 11.841 13.776 ( -1.790 0.000 -4.196) 4.562 13.881 ( -3.595 0.000 -0.784) 3.679 14.359 ( 3.793 0.000 -1.004) 3.924 14.808 ( 5.437 0.000 -1.839) 5.740 14.867 ( 5.352 0.000 36.636) 37.025 14.926 ( -5.731 0.000 -1.905) 6.039 15.059 ( -18.030 0.000 36.656) 40.851 15.076 ( 0.312 0.000 -2.861) 2.878 15.867 ( 3.880 0.000 12.880) 13.452 15.963 ( -2.340 0.000 0.705) 2.444 16.016 ( -14.165 0.000 -4.033) 14.728 16.120 ( 3.429 0.000 0.064) 3.430 16.304 ( -12.278 0.000 6.063) 13.694 16.447 ( 2.568 0.000 -8.658) 9.031 16.529 ( 7.409 0.000 10.172) 12.584 16.917 ( -2.421 0.000 -5.626) 6.125 18.544 ( -9.328 0.000 -5.939) 11.058 19.324 ( 0.432 0.000 -4.111) 4.133 19.714 ( 0.098 0.000 10.596) 10.596 19.810 ( -1.523 0.000 -0.192) 1.535 21.925 ( 8.434 0.000 -32.381) 33.462 22.098 ( 0.660 0.000 -20.393) 20.403 22.241 ( 7.760 0.000 -24.537) 25.734 22.457 ( 2.479 0.000 -18.037) 18.206 25.094 ( -0.709 0.000 6.272) 6.312 25.253 ( -1.901 0.000 10.091) 10.269 25.637 ( -1.629 0.000 9.031) 9.177 25.736 ( -3.087 0.000 14.656) 14.978 26.404 ( 15.559 0.000 -12.118) 19.721 26.885 ( -4.413 0.000 -14.738) 15.385 27.134 ( 20.450 0.000 -25.916) 33.012 27.738 ( -2.123 0.000 -29.920) 29.995 28.525 ( 5.037 0.000 3.254) 5.997 28.616 ( -5.941 0.000 1.810) 6.211 28.819 ( 2.809 0.000 -10.093) 10.476 29.041 ( 0.791 0.000 -3.460) 3.550 29.310 ( 2.497 0.000 -1.651) 2.994 29.906 ( -3.893 0.000 12.696) 13.279 30.014 ( -7.295 0.000 11.487) 13.608 30.207 ( -0.899 0.000 13.682) 13.711 31.083 ( -2.239 0.000 10.577) 10.811 31.087 ( -9.275 0.000 30.249) 31.639 31.154 ( -5.874 0.000 18.584) 19.490 31.263 ( -0.180 0.000 -0.993) 1.010 31.714 ( -3.496 0.000 12.286) 12.774 31.825 ( 0.743 0.000 -1.898) 2.038 32.027 ( 8.919 0.000 -6.646) 11.123 32.218 ( 0.368 0.000 -17.601) 17.605 ======================= Grid point 73 (36/104) ======================= q-point: (-0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( -27.050 0.000 16.070) 31.464 2.252 ( -37.844 0.000 17.133) 41.541 2.508 ( -6.545 0.000 1.506) 6.716 3.374 ( -26.450 0.000 25.551) 36.776 3.432 ( 8.809 0.000 21.746) 23.462 3.511 ( 5.717 0.000 14.092) 15.207 3.851 ( -6.840 0.000 -2.864) 7.415 3.933 ( -4.016 0.000 31.726) 31.979 4.102 ( 6.235 0.000 1.081) 6.328 4.126 ( -7.489 0.000 19.790) 21.160 4.456 ( -5.580 0.000 25.628) 26.228 4.741 ( -5.634 0.000 26.268) 26.866 4.982 ( -5.710 0.000 37.803) 38.232 5.168 ( -10.639 0.000 17.214) 20.237 5.169 ( 1.195 0.000 -0.119) 1.201 5.308 ( 6.940 0.000 7.177) 9.984 5.315 ( 1.779 0.000 25.587) 25.649 5.457 ( 1.000 0.000 31.847) 31.863 5.713 ( -5.790 0.000 25.284) 25.939 5.888 ( 6.085 0.000 -2.653) 6.638 6.289 ( -14.618 0.000 12.579) 19.285 6.421 ( 12.854 0.000 6.838) 14.560 6.587 ( 4.313 0.000 -8.958) 9.943 6.653 ( 1.454 0.000 1.674) 2.217 6.763 ( 5.899 0.000 -4.535) 7.440 7.106 ( -2.329 0.000 -12.519) 12.733 7.253 ( -0.295 0.000 -14.733) 14.736 7.440 ( 2.250 0.000 -1.262) 2.580 7.680 ( -3.791 0.000 0.189) 3.795 7.718 ( -1.121 0.000 2.415) 2.662 7.782 ( 0.445 0.000 1.310) 1.384 8.014 ( 0.577 0.000 -8.400) 8.419 8.038 ( 4.891 0.000 -13.073) 13.958 8.143 ( -5.020 0.000 -8.438) 9.818 8.149 ( -3.987 0.000 -3.393) 5.235 8.171 ( -0.092 0.000 -3.635) 3.636 8.313 ( 9.095 0.000 -6.331) 11.081 8.625 ( -1.627 0.000 -10.857) 10.979 8.709 ( 2.408 0.000 -3.078) 3.908 8.751 ( 6.626 0.000 -1.707) 6.843 8.863 ( 3.912 0.000 -6.858) 7.896 8.996 ( -4.107 0.000 -6.037) 7.302 9.150 ( 2.758 0.000 11.853) 12.170 9.179 ( -9.732 0.000 6.396) 11.645 9.400 ( -8.798 0.000 -17.093) 19.225 9.481 ( 4.921 0.000 3.762) 6.194 9.665 ( 4.636 0.000 -8.910) 10.044 9.777 ( -16.306 0.000 -7.888) 18.114 9.860 ( -6.081 0.000 -4.160) 7.368 10.131 ( 3.323 0.000 1.140) 3.513 10.204 ( 1.715 0.000 -2.272) 2.847 10.303 ( 0.203 0.000 -9.606) 9.608 10.341 ( -3.034 0.000 -1.349) 3.321 10.486 ( 0.194 0.000 -1.430) 1.443 10.783 ( 0.578 0.000 -1.596) 1.697 10.841 ( 7.588 0.000 -0.095) 7.589 10.936 ( 9.401 0.000 -8.858) 12.917 10.998 ( -4.489 0.000 3.576) 5.740 11.103 ( -0.768 0.000 0.840) 1.138 11.263 ( 7.209 0.000 -2.644) 7.678 11.400 ( 7.881 0.000 6.165) 10.006 11.651 ( 1.334 0.000 -3.996) 4.212 11.891 ( -5.769 0.000 6.511) 8.700 11.942 ( 3.622 0.000 -4.787) 6.003 12.150 ( 5.236 0.000 -2.825) 5.950 12.329 ( 3.285 0.000 -1.944) 3.817 12.599 ( -11.069 0.000 3.516) 11.613 12.682 ( -9.887 0.000 16.424) 19.171 13.004 ( 1.137 0.000 -2.869) 3.085 13.121 ( 4.156 0.000 10.104) 10.925 13.689 ( -1.829 0.000 -15.201) 15.311 13.748 ( 2.265 0.000 -5.551) 5.995 13.819 ( 11.069 0.000 -2.115) 11.269 13.873 ( 1.680 0.000 1.180) 2.053 14.377 ( -2.045 0.000 1.725) 2.676 14.659 ( -15.048 0.000 33.670) 36.880 14.813 ( -3.785 0.000 -2.069) 4.313 14.930 ( 5.306 0.000 -0.916) 5.384 15.091 ( 4.115 0.000 -8.646) 9.575 15.485 ( 8.157 0.000 9.045) 12.180 15.766 ( 0.950 0.000 6.727) 6.794 15.886 ( -0.027 0.000 12.712) 12.712 15.926 ( -0.831 0.000 -1.353) 1.588 16.190 ( -0.522 0.000 13.819) 13.829 16.365 ( 10.566 0.000 9.949) 14.513 16.467 ( 3.525 0.000 -12.142) 12.643 16.764 ( 11.004 0.000 23.372) 25.833 16.838 ( -0.743 0.000 -9.249) 9.279 18.352 ( -6.241 0.000 -0.423) 6.255 19.297 ( -0.427 0.000 -6.689) 6.703 19.714 ( -5.153 0.000 2.442) 5.702 19.765 ( -2.231 0.000 7.152) 7.492 21.964 ( 8.293 0.000 -30.884) 31.979 22.017 ( 2.127 0.000 -24.658) 24.750 22.309 ( 8.495 0.000 -23.510) 24.998 22.419 ( 1.505 0.000 -16.968) 17.034 25.131 ( 0.639 0.000 8.959) 8.981 25.253 ( -2.584 0.000 10.358) 10.676 25.638 ( -2.309 0.000 9.473) 9.751 25.706 ( -4.924 0.000 11.285) 12.313 26.311 ( -13.524 0.000 -14.922) 20.139 26.875 ( -2.285 0.000 -24.121) 24.229 27.188 ( 1.133 0.000 -18.887) 18.921 27.707 ( 12.604 0.000 -27.300) 30.069 28.476 ( -5.939 0.000 0.692) 5.979 28.667 ( 4.610 0.000 5.586) 7.243 28.860 ( 4.598 0.000 -7.880) 9.123 29.060 ( 2.893 0.000 -3.670) 4.673 29.404 ( 6.747 0.000 -1.804) 6.984 29.821 ( -9.207 0.000 12.518) 15.539 29.892 ( -7.773 0.000 2.753) 8.247 30.263 ( -0.791 0.000 17.524) 17.542 30.818 ( -22.287 0.000 28.202) 35.946 30.862 ( -20.368 0.000 1.104) 20.397 31.092 ( -1.567 0.000 10.990) 11.101 31.247 ( -0.757 0.000 -0.478) 0.895 31.691 ( -3.460 0.000 11.637) 12.140 31.850 ( 2.130 0.000 -2.340) 3.164 32.395 ( 19.118 0.000 -18.278) 26.450 32.429 ( 21.566 0.000 13.461) 25.422 ======================= Grid point 74 (37/104) ======================= q-point: (-0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( -28.219 0.000 30.874) 41.827 1.598 ( -20.718 0.000 31.651) 37.829 2.404 ( -2.806 0.000 2.213) 3.574 2.880 ( -30.039 0.000 49.245) 57.684 3.541 ( -5.792 0.000 17.867) 18.783 3.673 ( 2.983 0.000 10.970) 11.368 3.752 ( -1.816 0.000 1.746) 2.519 4.031 ( -2.211 0.000 29.776) 29.858 4.126 ( -0.389 0.000 22.018) 22.021 4.312 ( 12.382 0.000 2.135) 12.565 4.480 ( -4.247 0.000 25.065) 25.423 4.722 ( -9.039 0.000 45.979) 46.860 5.028 ( -6.934 0.000 36.839) 37.486 5.100 ( -6.243 0.000 0.064) 6.244 5.266 ( 8.571 0.000 13.853) 16.290 5.362 ( -2.447 0.000 28.276) 28.381 5.442 ( -2.668 0.000 7.739) 8.186 5.581 ( -3.450 0.000 24.129) 24.375 5.633 ( -14.025 0.000 8.858) 16.588 5.910 ( 0.332 0.000 -12.590) 12.594 6.283 ( 11.274 0.000 7.482) 13.531 6.541 ( -2.632 0.000 8.586) 8.981 6.544 ( -5.254 0.000 -1.303) 5.413 6.661 ( 0.004 0.000 0.125) 0.125 6.919 ( 7.443 0.000 -9.373) 11.969 7.009 ( -0.149 0.000 -12.759) 12.760 7.206 ( 0.645 0.000 -15.366) 15.380 7.401 ( -5.379 0.000 2.680) 6.010 7.590 ( -5.550 0.000 0.773) 5.604 7.627 ( -5.597 0.000 -4.389) 7.112 7.757 ( -4.111 0.000 1.662) 4.435 7.923 ( -1.176 0.000 -10.876) 10.940 8.008 ( 1.581 0.000 -6.580) 6.767 8.097 ( 1.476 0.000 -8.240) 8.371 8.121 ( 0.312 0.000 -5.124) 5.134 8.209 ( 11.046 0.000 -17.181) 20.426 8.422 ( 2.892 0.000 -11.088) 11.459 8.537 ( -0.795 0.000 -13.166) 13.190 8.712 ( -4.116 0.000 6.861) 8.001 8.832 ( 0.320 0.000 -0.318) 0.451 8.849 ( -4.354 0.000 -4.020) 5.927 8.911 ( 3.590 0.000 -10.870) 11.448 9.079 ( -2.396 0.000 8.409) 8.744 9.245 ( 2.847 0.000 2.199) 3.597 9.379 ( 6.717 0.000 8.816) 11.084 9.422 ( -9.173 0.000 -5.147) 10.518 9.661 ( 3.476 0.000 -3.548) 4.967 9.692 ( 6.647 0.000 -0.286) 6.653 9.847 ( 4.705 0.000 -5.313) 7.097 10.159 ( -3.345 0.000 6.412) 7.232 10.216 ( -1.440 0.000 -4.877) 5.085 10.278 ( 5.734 0.000 -6.638) 8.772 10.351 ( 1.651 0.000 -0.840) 1.853 10.448 ( -0.700 0.000 -10.363) 10.387 10.730 ( -3.306 0.000 -3.479) 4.799 10.816 ( -4.382 0.000 1.691) 4.697 11.010 ( 1.754 0.000 2.900) 3.389 11.047 ( 2.171 0.000 -0.731) 2.290 11.095 ( 1.218 0.000 -5.098) 5.242 11.421 ( 7.182 0.000 -1.319) 7.303 11.518 ( -0.931 0.000 5.129) 5.213 11.714 ( 5.026 0.000 -1.065) 5.138 11.788 ( -6.992 0.000 4.715) 8.434 12.059 ( 8.026 0.000 -5.202) 9.564 12.103 ( -7.605 0.000 4.431) 8.801 12.433 ( 5.900 0.000 -5.144) 7.828 12.448 ( -0.413 0.000 1.391) 1.451 12.482 ( -12.965 0.000 10.762) 16.850 13.062 ( 5.172 0.000 -5.176) 7.317 13.187 ( -4.340 0.000 15.426) 16.025 13.499 ( -10.062 0.000 -10.334) 14.423 13.802 ( 4.857 0.000 -11.154) 12.165 13.948 ( 3.451 0.000 7.910) 8.630 13.962 ( 2.665 0.000 -0.581) 2.727 14.316 ( -3.678 0.000 0.292) 3.690 14.616 ( -7.308 0.000 29.780) 30.664 14.755 ( -0.313 0.000 -4.215) 4.226 14.972 ( 0.408 0.000 -3.279) 3.305 15.175 ( 5.070 0.000 -5.202) 7.264 15.422 ( 2.140 0.000 -6.782) 7.111 15.726 ( -3.199 0.000 9.013) 9.564 15.918 ( 1.543 0.000 -5.008) 5.240 16.198 ( 6.480 0.000 -8.349) 10.569 16.202 ( -4.459 0.000 14.464) 15.135 16.472 ( 1.661 0.000 -10.652) 10.781 16.661 ( 11.168 0.000 4.120) 11.904 16.839 ( 4.516 0.000 -7.833) 9.042 17.306 ( 15.216 0.000 18.295) 23.795 18.518 ( 28.894 0.000 27.849) 40.130 19.234 ( -2.390 0.000 -11.014) 11.271 19.591 ( -5.448 0.000 2.509) 5.998 19.747 ( -3.386 0.000 13.399) 13.821 21.940 ( 3.940 0.000 -29.135) 29.400 22.029 ( 8.594 0.000 -28.102) 29.387 22.353 ( 2.482 0.000 -18.788) 18.951 22.398 ( 6.378 0.000 -19.709) 20.715 25.184 ( -0.657 0.000 10.044) 10.066 25.237 ( -2.793 0.000 9.663) 10.059 25.626 ( -2.808 0.000 9.924) 10.313 25.655 ( -3.573 0.000 8.969) 9.655 25.965 ( -11.932 0.000 -13.003) 17.648 26.150 ( -38.985 0.000 -25.333) 46.492 27.345 ( 8.844 0.000 -5.070) 10.194 27.850 ( 10.945 0.000 -27.189) 29.309 28.376 ( -3.343 0.000 0.785) 3.434 28.764 ( 1.688 0.000 5.706) 5.951 28.930 ( 4.563 0.000 -6.342) 7.813 29.111 ( 1.756 0.000 -7.481) 7.684 29.566 ( 8.105 0.000 1.334) 8.214 29.645 ( -11.431 0.000 9.768) 15.036 29.733 ( -1.427 0.000 -7.279) 7.418 30.282 ( -6.931 0.000 17.662) 18.973 30.524 ( -10.943 0.000 23.110) 25.570 30.569 ( -9.988 0.000 15.890) 18.769 31.108 ( -2.057 0.000 11.996) 12.171 31.234 ( -0.343 0.000 0.661) 0.745 31.681 ( -2.291 0.000 11.440) 11.667 31.879 ( 1.627 0.000 -3.912) 4.237 32.621 ( 9.351 0.000 -18.310) 20.560 32.961 ( 17.772 0.000 4.173) 18.255 ======================= Grid point 75 (38/104) ======================= q-point: ( 0.00 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.652 ( 5.304 14.347 36.488) 39.564 1.980 ( 9.418 23.496 39.232) 46.689 2.520 ( 0.879 10.610 3.599) 11.238 2.985 ( -6.106 26.328 52.031) 58.631 3.454 ( -5.703 -1.401 18.313) 19.231 3.719 ( -3.249 1.951 3.689) 5.289 3.843 ( 1.455 3.036 9.862) 10.421 4.110 ( -4.640 3.421 16.517) 17.494 4.236 ( -8.362 -3.477 29.964) 31.303 4.434 ( -5.602 -2.394 17.646) 18.668 4.554 ( -8.274 -13.322 30.607) 34.390 4.716 ( 0.334 -2.629 13.417) 13.677 4.874 ( 3.687 2.154 9.967) 10.843 5.059 ( -22.044 -3.423 18.541) 29.008 5.177 ( -5.821 8.680 16.065) 19.166 5.305 ( 2.417 -4.614 23.614) 24.182 5.423 ( -2.364 6.389 11.896) 13.708 5.589 ( 1.680 -0.477 14.639) 14.742 5.715 ( -0.755 1.915 10.562) 10.761 5.882 ( -9.109 5.424 -1.692) 10.736 6.365 ( 1.309 -8.673 -1.454) 8.891 6.430 ( -3.483 -1.092 5.476) 6.581 6.524 ( 3.181 -8.456 0.928) 9.082 6.698 ( 2.719 2.770 -3.160) 5.005 6.858 ( 3.234 -1.362 -6.099) 7.036 7.076 ( 5.201 1.692 -1.787) 5.754 7.131 ( -3.643 -1.750 -3.356) 5.253 7.282 ( -13.720 -0.927 5.606) 14.850 7.456 ( 0.851 6.464 -9.467) 11.495 7.531 ( 1.770 3.043 -3.697) 5.105 7.701 ( -5.390 3.351 -4.988) 8.072 7.857 ( 4.427 -5.549 -15.662) 17.196 8.041 ( 1.060 1.543 -8.551) 8.754 8.115 ( 2.448 -2.440 -3.368) 4.826 8.181 ( 3.588 1.820 -2.894) 4.956 8.318 ( -0.703 -4.859 -6.478) 8.128 8.425 ( 6.843 3.504 -9.131) 11.936 8.465 ( 1.203 3.252 -11.880) 12.375 8.712 ( -2.886 4.144 4.595) 6.828 8.806 ( 7.173 -2.121 -0.347) 7.488 8.880 ( -1.852 1.770 -4.824) 5.461 9.040 ( 5.311 4.853 -9.649) 12.036 9.060 ( 1.980 -2.208 0.735) 3.056 9.226 ( 0.443 3.172 0.320) 3.218 9.406 ( 2.236 -4.810 1.446) 5.498 9.517 ( 7.100 -6.224 3.848) 10.196 9.662 ( 4.795 -4.364 1.006) 6.561 9.741 ( 1.998 -8.412 -0.419) 8.656 9.891 ( 0.327 -2.571 -1.293) 2.897 10.017 ( 3.763 -10.052 -7.978) 13.374 10.276 ( -1.614 6.722 -1.633) 7.104 10.339 ( -0.080 2.138 -4.330) 4.830 10.416 ( -1.427 5.538 -6.434) 8.608 10.539 ( 2.464 10.523 0.443) 10.817 10.631 ( -1.517 -1.282 -3.748) 4.242 10.804 ( -0.816 -1.103 0.522) 1.468 10.952 ( -2.019 -4.267 -0.764) 4.782 11.003 ( -2.033 -4.702 -3.539) 6.227 11.105 ( 0.130 2.849 -3.074) 4.194 11.397 ( -6.856 -0.968 2.488) 7.357 11.560 ( -2.572 3.762 4.128) 6.149 11.691 ( 0.435 0.228 1.075) 1.182 11.824 ( 2.131 2.278 4.308) 5.319 11.938 ( -3.606 0.218 3.150) 4.793 12.215 ( 6.086 -1.551 0.745) 6.324 12.233 ( -3.520 -4.234 -3.586) 6.571 12.502 ( 4.151 3.313 4.199) 6.770 12.737 ( 10.723 8.031 -11.685) 17.777 13.131 ( 1.721 0.275 -4.352) 4.688 13.149 ( -5.961 2.336 11.943) 13.551 13.249 ( -12.793 2.946 0.492) 13.137 13.768 ( 3.001 -6.039 -10.116) 12.158 13.838 ( -3.794 -8.798 -0.513) 9.595 13.950 ( 0.643 -14.684 12.322) 19.180 14.237 ( -8.783 1.633 1.549) 9.067 14.420 ( -4.858 0.527 0.614) 4.925 14.820 ( -1.617 5.244 -6.020) 8.145 15.080 ( -0.348 -1.007 3.633) 3.786 15.295 ( 3.412 15.995 6.310) 17.530 15.503 ( 0.660 -3.189 12.603) 13.017 15.861 ( 11.491 0.256 3.831) 12.115 15.946 ( 3.526 -3.986 -4.134) 6.739 16.050 ( -13.090 -3.898 8.389) 16.029 16.204 ( -3.899 1.925 -8.284) 9.356 16.350 ( -7.551 -5.428 -5.306) 10.707 16.695 ( -8.944 0.337 6.377) 10.990 16.891 ( 2.487 -2.434 -1.263) 3.701 17.148 ( -0.075 -5.139 -2.638) 5.777 18.996 ( -3.353 -4.936 -11.384) 12.853 19.112 ( 4.655 -11.649 12.235) 17.523 19.572 ( 1.875 -3.887 9.692) 10.610 19.726 ( -0.223 -4.316 10.449) 11.308 21.960 ( 5.636 4.524 -30.340) 31.189 22.110 ( 7.576 1.928 -24.857) 26.058 22.304 ( 1.483 0.828 -18.558) 18.635 22.445 ( 6.115 -0.627 -20.232) 21.145 25.207 ( -5.707 3.347 5.654) 8.703 25.251 ( -1.878 0.792 8.493) 8.735 25.617 ( 4.539 -0.933 4.633) 6.553 25.640 ( -2.934 1.195 8.106) 8.703 25.707 ( 10.475 3.222 3.966) 11.655 25.856 ( 6.159 -2.495 -7.035) 9.678 27.381 ( -0.825 0.521 -7.255) 7.320 27.872 ( 5.727 -4.686 -25.832) 26.871 28.415 ( 0.843 6.360 0.391) 6.427 28.810 ( -1.285 1.612 4.078) 4.569 28.940 ( -2.356 -0.762 -9.587) 9.901 29.008 ( 0.517 -2.275 -8.015) 8.347 29.470 ( -7.119 1.771 5.012) 8.884 29.673 ( 10.515 -4.254 4.267) 12.119 30.103 ( 3.226 9.955 -1.117) 10.524 30.229 ( -5.705 1.758 19.397) 20.295 30.447 ( 2.194 3.617 16.526) 17.059 30.647 ( 3.157 -1.540 25.975) 26.211 31.069 ( -3.895 -4.132 15.554) 16.558 31.226 ( 1.674 -1.308 1.098) 2.391 31.655 ( -1.585 -2.583 14.049) 14.372 31.810 ( -0.593 -6.051 -2.442) 6.552 32.686 ( -2.082 7.775 -21.419) 22.882 33.054 ( -12.010 5.104 -14.568) 19.558 ======================= Grid point 76 (39/104) ======================= q-point: ( 0.20 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.122 ( 17.741 4.756 33.609) 38.301 2.519 ( 14.044 8.280 24.082) 29.082 2.606 ( 9.961 13.899 18.027) 24.846 3.262 ( 6.705 17.477 37.539) 41.948 3.413 ( -8.444 5.501 26.497) 28.349 3.636 ( -4.634 4.727 5.054) 8.328 3.901 ( -1.647 4.135 14.427) 15.098 3.999 ( -8.067 -2.674 4.650) 9.688 4.097 ( -11.093 -18.790 7.465) 23.061 4.332 ( -9.339 0.052 28.246) 29.750 4.515 ( -5.858 -6.625 18.996) 20.954 4.625 ( -22.188 -1.338 13.086) 25.794 4.714 ( -2.825 -8.134 23.051) 24.607 5.104 ( -4.124 11.236 11.486) 16.589 5.175 ( 7.762 1.885 14.478) 16.535 5.466 ( -3.064 4.852 10.485) 11.953 5.531 ( 4.989 5.223 23.775) 24.848 5.587 ( -3.020 10.268 8.310) 13.551 5.703 ( -9.129 4.162 17.251) 19.956 5.713 ( -3.347 2.573 18.285) 18.766 6.210 ( -6.967 -10.295 -0.925) 12.465 6.415 ( 2.474 -0.403 0.418) 2.541 6.635 ( -8.648 10.045 -0.942) 13.288 6.702 ( 0.434 -7.768 -1.479) 7.919 6.879 ( -12.683 -5.848 -15.447) 20.825 6.958 ( 8.323 -0.094 3.673) 9.097 7.225 ( 9.029 -4.506 4.291) 10.965 7.311 ( 12.968 -3.123 0.965) 13.374 7.479 ( 5.616 10.691 -6.001) 13.485 7.497 ( -3.571 3.128 -12.891) 13.737 7.649 ( 1.380 -0.093 3.364) 3.637 7.851 ( 2.015 -0.271 -9.573) 9.786 8.010 ( 1.291 -1.548 -8.034) 8.283 8.155 ( -0.134 -2.575 -2.032) 3.283 8.231 ( 1.334 4.597 -0.897) 4.870 8.296 ( 2.158 -5.646 -4.682) 7.646 8.448 ( 2.037 2.806 -8.706) 9.372 8.547 ( 5.766 2.590 -5.672) 8.493 8.633 ( -3.236 1.034 -2.702) 4.341 8.775 ( -4.600 2.548 -4.594) 6.982 8.976 ( 3.736 -3.526 -7.263) 8.896 9.066 ( 1.070 -2.316 -1.449) 2.934 9.136 ( 1.382 4.517 -7.347) 8.734 9.265 ( 3.359 2.215 0.557) 4.063 9.531 ( 8.215 -5.978 5.637) 11.619 9.644 ( 0.972 -6.098 1.669) 6.397 9.698 ( 0.069 -5.145 -1.534) 5.369 9.801 ( 4.216 -10.822 0.230) 11.617 9.852 ( 1.187 -6.955 -5.722) 9.084 10.083 ( 4.624 -5.946 -11.938) 14.115 10.259 ( -0.471 1.591 -10.659) 10.788 10.298 ( -0.192 7.100 1.377) 7.235 10.344 ( -0.002 2.075 -6.030) 6.377 10.557 ( 0.460 6.881 -4.152) 8.050 10.623 ( -1.288 0.337 -2.219) 2.587 10.771 ( -2.230 -0.127 4.414) 4.947 10.876 ( -5.160 -2.775 1.471) 6.041 10.951 ( -1.161 -5.202 -3.402) 6.323 11.086 ( -0.312 2.476 -2.661) 3.648 11.267 ( -4.348 2.090 -0.111) 4.825 11.483 ( -6.222 6.219 6.931) 11.200 11.710 ( 1.602 -1.102 -2.459) 3.135 11.871 ( -4.697 -0.108 2.432) 5.291 11.904 ( 3.044 9.622 3.367) 10.639 12.144 ( 1.202 -3.219 -5.542) 6.521 12.306 ( -0.430 -3.105 1.723) 3.577 12.616 ( 2.637 1.935 1.733) 3.702 12.827 ( -2.961 5.559 -4.721) 7.872 13.041 ( -2.838 -3.000 8.006) 9.009 13.132 ( 0.762 1.812 0.325) 1.992 13.211 ( 8.314 0.917 -3.592) 9.103 13.718 ( -2.796 -8.482 -7.271) 11.516 13.781 ( 0.523 -4.501 -4.673) 6.509 13.992 ( -8.748 -11.037 12.313) 18.707 14.127 ( 4.772 -4.755 4.589) 8.151 14.442 ( 5.958 -0.739 2.452) 6.485 14.783 ( 1.240 1.758 -5.811) 6.197 15.011 ( -6.338 -5.007 0.245) 8.081 15.304 ( -8.736 16.545 14.187) 23.480 15.591 ( -19.484 -4.979 25.782) 32.697 15.625 ( -2.229 -1.354 18.594) 18.776 15.942 ( -2.930 -9.421 -3.575) 10.494 16.110 ( 0.383 7.398 -0.069) 7.408 16.195 ( 5.371 -2.015 -6.092) 8.368 16.266 ( 7.898 -0.581 -1.508) 8.062 16.527 ( -10.092 4.841 2.304) 11.427 16.838 ( -8.962 6.629 -4.020) 11.850 17.022 ( -4.368 5.155 -3.346) 7.540 18.760 ( -10.658 -2.627 -7.236) 13.147 19.182 ( 0.881 -12.676 2.488) 12.948 19.640 ( 0.055 -3.197 11.229) 11.675 19.775 ( 1.323 -3.056 3.842) 5.084 21.947 ( 6.542 4.095 -30.993) 31.940 22.139 ( 4.541 0.295 -21.291) 21.772 22.258 ( 3.410 2.652 -21.768) 22.193 22.465 ( 4.175 -0.816 -19.305) 19.768 25.123 ( -3.413 1.519 4.978) 6.224 25.242 ( -2.131 -0.704 8.523) 8.813 25.630 ( -1.724 0.213 8.778) 8.948 25.697 ( -0.689 -0.678 14.773) 14.804 26.068 ( 18.715 1.384 -8.691) 20.681 26.398 ( 40.173 -5.679 -18.941) 44.776 27.234 ( -8.684 2.679 -10.053) 13.551 27.812 ( -0.442 -7.126 -26.004) 26.966 28.465 ( 3.247 4.986 0.932) 6.022 28.740 ( -4.923 0.258 -0.365) 4.943 28.859 ( -0.167 1.916 -8.632) 8.843 29.010 ( 0.811 -2.468 -3.776) 4.583 29.394 ( -1.121 6.621 0.806) 6.764 29.856 ( 2.789 -1.902 9.072) 9.679 30.107 ( -5.457 0.747 14.323) 15.345 30.177 ( -2.880 -0.602 9.831) 10.262 30.798 ( 17.171 -2.911 8.967) 19.589 30.850 ( 3.170 -4.264 28.648) 29.137 31.077 ( -1.347 -2.608 17.320) 17.567 31.289 ( 3.739 2.161 2.027) 4.771 31.669 ( -3.969 -2.508 14.606) 15.342 31.786 ( -0.049 -4.123 -1.346) 4.337 32.419 ( -14.304 11.408 -14.702) 23.471 32.587 ( -17.827 7.501 -17.656) 26.188 ======================= Grid point 77 (40/104) ======================= q-point: ( 0.40 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.477 ( -5.854 4.827 10.512) 12.964 2.598 ( 3.797 9.433 17.669) 20.386 3.068 ( -24.845 14.764 16.703) 33.380 3.141 ( 13.967 13.284 28.682) 34.557 3.376 ( -3.663 -0.135 6.465) 7.432 3.699 ( -5.182 2.905 21.390) 22.200 3.833 ( -5.008 -5.835 15.674) 17.459 3.981 ( -1.147 -0.871 4.229) 4.467 4.032 ( -2.625 -6.049 7.291) 9.831 4.326 ( -9.135 7.342 27.699) 30.076 4.413 ( 11.236 -4.632 5.072) 13.169 4.466 ( -4.441 -5.873 15.656) 17.301 4.864 ( 2.053 -5.324 38.596) 39.016 5.078 ( -4.423 7.602 20.598) 22.398 5.157 ( -12.179 -6.370 11.640) 18.011 5.373 ( -6.433 3.677 11.504) 13.684 5.463 ( -11.552 10.706 5.620) 16.723 5.554 ( -6.875 6.512 19.435) 21.619 5.802 ( -0.434 10.686 20.425) 23.056 5.869 ( 2.519 2.292 24.450) 24.686 6.128 ( -5.267 0.448 19.572) 20.273 6.426 ( 2.267 -4.685 -6.184) 8.083 6.517 ( 5.366 -0.169 1.780) 5.656 6.623 ( -2.846 0.053 -6.421) 7.024 6.668 ( -0.657 2.150 -10.510) 10.748 7.221 ( 4.922 -7.096 0.914) 8.684 7.282 ( -0.844 2.174 -6.287) 6.706 7.448 ( 1.213 2.213 -6.895) 7.343 7.475 ( 3.871 -5.100 -1.839) 6.662 7.614 ( 3.581 -4.804 3.800) 7.095 7.747 ( 10.790 2.055 -2.899) 11.360 7.903 ( 4.571 1.713 -6.912) 8.462 8.041 ( 3.971 -1.006 -7.300) 8.371 8.119 ( -0.922 -0.031 -3.014) 3.152 8.229 ( -0.978 2.462 2.736) 3.808 8.283 ( -3.649 -4.092 -1.465) 5.675 8.465 ( 2.512 11.109 -9.123) 14.593 8.560 ( 2.778 -4.938 -5.979) 8.237 8.625 ( -2.018 -4.135 -4.690) 6.571 8.694 ( 1.988 2.508 -3.687) 4.883 8.925 ( -2.107 2.103 -10.951) 11.349 9.033 ( -2.924 -5.373 3.132) 6.872 9.097 ( -0.172 3.783 -7.613) 8.503 9.321 ( -0.033 -0.104 0.396) 0.411 9.494 ( -5.736 -1.131 3.629) 6.881 9.650 ( -5.872 -3.046 -8.819) 11.024 9.664 ( -6.532 -8.191 -6.889) 12.539 9.782 ( 5.449 -11.425 -1.455) 12.741 9.933 ( -5.633 -0.067 -6.301) 8.452 10.137 ( 4.846 -6.291 -5.803) 9.835 10.262 ( 2.397 -0.120 -16.622) 16.794 10.295 ( 3.066 1.354 -7.758) 8.451 10.397 ( 5.259 -0.450 3.295) 6.222 10.517 ( -0.620 -2.896 7.881) 8.420 10.607 ( -4.506 9.339 -2.756) 10.730 10.689 ( 7.627 2.027 -6.499) 10.224 10.914 ( 1.880 2.821 0.633) 3.449 10.950 ( 5.601 -7.302 0.773) 9.235 11.076 ( -0.021 -0.188 0.176) 0.258 11.220 ( -0.241 3.626 -1.462) 3.917 11.388 ( -4.647 7.460 6.308) 10.818 11.668 ( -3.513 -2.814 -3.620) 5.776 11.837 ( 2.822 0.919 -0.241) 2.977 12.030 ( 5.853 5.682 -1.098) 8.231 12.126 ( -9.581 -0.477 3.589) 10.242 12.240 ( 3.017 -2.575 -3.298) 5.159 12.634 ( -2.705 -4.856 10.878) 12.216 12.768 ( -2.483 1.351 -3.836) 4.765 13.023 ( -0.717 -2.189 6.599) 6.990 13.105 ( -2.436 3.939 2.421) 5.226 13.467 ( 12.348 -5.304 -4.355) 14.128 13.671 ( 1.743 -6.164 -10.111) 11.969 13.778 ( 1.876 -0.526 -5.111) 5.470 13.881 ( -2.502 -0.560 1.643) 3.045 14.290 ( 4.792 -5.654 7.228) 10.352 14.687 ( 12.005 -9.924 11.723) 19.494 14.769 ( -4.794 -7.228 4.938) 9.981 14.906 ( 0.593 -1.259 0.079) 1.394 15.075 ( -14.098 9.543 25.690) 30.819 15.377 ( -7.186 13.900 9.818) 18.473 15.769 ( 3.131 -7.552 14.484) 16.632 15.819 ( -5.977 -10.664 -2.178) 12.418 16.115 ( -5.498 9.535 -1.362) 11.091 16.231 ( -5.239 8.830 -4.028) 11.029 16.287 ( 3.370 1.968 0.590) 3.947 16.484 ( 7.190 -3.147 6.862) 10.425 16.656 ( -5.037 14.245 -0.527) 15.118 16.939 ( -2.819 1.390 -5.523) 6.355 18.513 ( -9.731 -2.590 -3.355) 10.614 19.200 ( 0.287 -12.595 -0.402) 12.605 19.703 ( 1.217 -0.777 8.006) 8.135 19.792 ( -0.963 -1.752 -0.288) 2.020 21.960 ( 7.725 3.307 -30.716) 31.844 22.100 ( 1.321 0.159 -20.725) 20.768 22.269 ( 7.027 2.718 -24.116) 25.265 22.450 ( 2.586 -0.824 -18.472) 18.670 25.105 ( -0.865 1.092 6.474) 6.622 25.242 ( -1.841 -1.150 9.815) 10.052 25.638 ( -1.527 0.163 9.101) 9.230 25.725 ( -2.965 -1.106 13.981) 14.335 26.437 ( 15.841 3.487 -12.409) 20.423 26.916 ( 0.131 2.323 -18.245) 18.393 27.057 ( 15.027 -6.492 -19.383) 25.370 27.627 ( -4.128 -10.296 -26.204) 28.455 28.553 ( 4.156 2.282 2.342) 5.288 28.636 ( -4.884 1.385 0.661) 5.120 28.836 ( 1.818 1.979 -8.702) 9.107 29.012 ( 1.109 -2.133 -3.073) 3.902 29.419 ( 3.180 9.595 -1.769) 10.262 29.884 ( -4.246 -2.286 11.702) 12.656 30.028 ( -6.259 1.546 11.322) 13.029 30.206 ( -0.425 -0.263 13.406) 13.415 30.921 ( -5.657 -8.218 22.574) 24.681 31.013 ( -3.058 -9.381 11.148) 14.887 31.193 ( -1.483 2.219 16.284) 16.501 31.335 ( -5.799 0.724 12.408) 13.715 31.638 ( -2.431 -1.289 7.287) 7.789 31.788 ( -0.827 -1.769 1.811) 2.663 32.196 ( 6.096 12.283 -10.435) 17.231 32.304 ( 2.174 7.098 -19.667) 21.021 ======================= Grid point 78 (41/104) ======================= q-point: (-0.40 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.183 ( -21.326 14.385 11.898) 28.343 2.418 ( -32.030 15.898 17.419) 39.776 2.675 ( -8.321 16.796 1.450) 18.800 3.375 ( -1.882 0.101 18.397) 18.494 3.533 ( -1.329 12.214 13.054) 17.926 3.587 ( -6.990 0.724 18.195) 19.505 3.765 ( -1.080 -3.377 10.480) 11.063 3.963 ( -2.013 2.194 11.834) 12.203 4.047 ( 2.599 -1.070 11.583) 11.919 4.325 ( -6.379 8.777 22.245) 24.750 4.456 ( -0.855 1.687 18.487) 18.584 4.691 ( -1.263 -3.096 24.229) 24.458 4.953 ( -7.076 -3.000 39.513) 40.253 5.039 ( -6.166 -10.702 27.659) 30.291 5.196 ( -6.586 -0.837 16.005) 17.327 5.288 ( -2.994 2.385 3.944) 5.496 5.326 ( 7.768 0.837 16.483) 18.241 5.525 ( -4.086 7.427 16.797) 18.815 5.648 ( -8.225 -1.033 16.185) 18.184 6.056 ( 3.733 4.887 9.371) 11.209 6.287 ( 2.260 -5.290 8.764) 10.483 6.394 ( -5.118 9.045 7.099) 12.585 6.590 ( 1.413 -8.213 -6.088) 10.321 6.657 ( 0.114 1.514 4.306) 4.566 6.722 ( 12.404 4.073 -5.411) 14.132 7.155 ( 0.138 0.356 -7.886) 7.895 7.317 ( -4.032 4.090 -9.183) 10.831 7.352 ( -0.096 -4.462 -4.032) 6.015 7.557 ( 0.150 -6.775 4.199) 7.972 7.645 ( -1.140 -5.665 3.852) 6.945 7.864 ( 0.589 1.740 0.676) 1.957 7.921 ( 0.836 -6.208 -16.360) 17.518 8.039 ( -2.874 -2.257 -7.006) 7.901 8.084 ( -1.732 4.034 -5.482) 7.023 8.203 ( 0.922 4.535 -3.752) 5.958 8.316 ( 7.124 -1.298 -1.148) 7.332 8.438 ( -0.109 12.702 -12.933) 18.128 8.525 ( -2.234 -5.476 -6.590) 8.855 8.672 ( 6.817 -4.345 -2.146) 8.364 8.746 ( 3.143 1.755 0.846) 3.698 8.852 ( -2.522 -2.915 -6.417) 7.485 8.987 ( -1.390 -3.184 0.352) 3.492 9.079 ( 0.991 2.997 -3.400) 4.639 9.297 ( -1.940 3.887 5.578) 7.071 9.359 ( -6.808 -4.995 -11.230) 14.050 9.485 ( 1.532 -0.019 0.821) 1.738 9.622 ( -0.231 -2.475 -5.648) 6.171 9.765 ( -4.240 -8.871 -2.493) 10.144 9.788 ( -7.494 -2.303 -9.990) 12.699 10.026 ( -3.314 -4.308 -5.751) 7.913 10.142 ( 0.401 0.280 -4.539) 4.565 10.353 ( 4.471 2.208 -9.968) 11.146 10.476 ( 0.723 -0.168 -0.192) 0.766 10.540 ( -1.066 11.658 0.017) 11.707 10.713 ( 5.532 -4.623 0.174) 7.212 10.860 ( 7.089 -1.587 -5.140) 8.899 10.938 ( 0.954 -1.877 3.084) 3.735 11.044 ( -0.569 5.270 -3.160) 6.171 11.112 ( 2.025 1.992 -0.797) 2.950 11.247 ( 5.671 -1.369 -2.840) 6.488 11.426 ( 6.821 2.462 6.682) 9.861 11.631 ( 1.885 -2.161 -4.296) 5.165 11.890 ( -6.635 0.208 7.097) 9.717 11.908 ( 1.567 -1.821 -2.652) 3.579 12.156 ( 1.588 -0.860 -2.542) 3.118 12.289 ( 0.327 -3.715 1.703) 4.100 12.530 ( -7.322 -3.052 6.938) 10.538 12.716 ( -3.951 1.307 3.741) 5.596 13.009 ( -1.000 0.175 3.934) 4.062 13.161 ( 4.633 4.035 2.711) 6.715 13.615 ( 3.269 -8.890 -3.015) 9.940 13.662 ( 1.135 -4.144 -8.052) 9.127 13.859 ( 7.259 0.341 -6.166) 9.531 13.871 ( -0.094 -0.073 -0.535) 0.548 14.365 ( -0.017 -0.031 8.752) 8.752 14.655 ( -8.520 -0.010 18.726) 20.574 14.854 ( -1.315 2.102 2.106) 3.253 14.944 ( 4.772 1.557 -1.265) 5.177 15.177 ( 3.825 8.226 0.964) 9.122 15.365 ( 5.906 -7.879 7.280) 12.246 15.681 ( -1.164 -8.283 0.743) 8.397 15.805 ( -8.788 -2.533 10.305) 13.779 16.031 ( 8.480 1.815 12.754) 15.423 16.241 ( 1.560 8.835 1.595) 9.113 16.436 ( 6.112 2.684 1.087) 6.763 16.566 ( -2.852 7.623 5.556) 9.854 16.662 ( 6.152 -4.364 3.624) 8.368 16.882 ( 1.604 0.679 -4.181) 4.529 18.348 ( -4.172 0.718 3.343) 5.394 19.197 ( 0.558 -10.290 -4.671) 11.314 19.710 ( -4.812 -0.372 2.594) 5.479 19.750 ( -2.205 -1.361 5.602) 6.173 21.993 ( 7.817 2.783 -29.346) 30.496 22.034 ( 2.805 1.598 -24.257) 24.471 22.322 ( 7.797 1.246 -23.455) 24.749 22.413 ( 1.794 -0.638 -17.687) 17.789 25.139 ( 0.570 0.911 9.125) 9.188 25.246 ( -2.257 -0.789 10.435) 10.705 25.643 ( -2.026 0.548 9.320) 9.553 25.702 ( -4.190 -0.435 10.896) 11.682 26.324 ( -15.094 1.534 -14.998) 21.334 26.859 ( -12.554 -4.347 -29.795) 32.623 27.105 ( 7.785 -4.321 -8.899) 12.589 27.629 ( 14.420 -7.214 -24.452) 29.289 28.524 ( -5.009 4.462 0.249) 6.713 28.669 ( 4.324 0.068 4.794) 6.456 28.863 ( 4.043 0.471 -7.585) 8.608 29.039 ( 3.023 -1.827 -3.710) 5.123 29.483 ( 2.735 5.998 -2.366) 7.004 29.794 ( -8.864 -2.759 11.539) 14.810 29.965 ( -2.677 7.426 5.058) 9.375 30.267 ( -0.602 0.398 17.534) 17.549 30.782 ( -17.871 -3.071 24.918) 30.818 30.833 ( -16.237 -2.610 4.436) 17.033 31.102 ( -5.575 0.221 11.778) 13.033 31.247 ( -4.116 -1.528 2.715) 5.162 31.617 ( -2.829 -3.829 12.415) 13.297 31.797 ( 1.202 -4.332 -0.579) 4.533 32.468 ( 18.015 6.697 -18.773) 26.867 32.554 ( 22.512 9.708 2.769) 24.672 ======================= Grid point 79 (42/104) ======================= q-point: (-0.20 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( -24.974 22.991 20.051) 39.424 1.894 ( -17.051 25.203 29.864) 42.635 2.542 ( -4.151 13.540 0.972) 14.195 3.103 ( -24.375 20.339 43.978) 54.239 3.497 ( -3.482 -3.458 11.047) 12.088 3.721 ( 3.366 0.228 5.322) 6.302 3.773 ( -1.327 5.022 7.598) 9.203 4.045 ( 0.367 -0.072 25.865) 25.868 4.192 ( 2.181 6.143 13.087) 14.620 4.377 ( 1.889 0.214 28.578) 28.641 4.495 ( -0.831 6.140 7.976) 10.100 4.670 ( -11.125 -4.373 43.172) 44.796 4.942 ( -10.616 -7.458 26.281) 29.309 5.082 ( -2.658 -9.853 36.113) 37.527 5.241 ( 2.079 1.649 11.043) 11.357 5.304 ( 5.172 -0.271 3.457) 6.227 5.418 ( -10.241 -0.164 17.016) 19.861 5.555 ( -3.682 -1.011 8.925) 9.707 5.630 ( 1.365 0.871 8.460) 8.613 6.097 ( -6.416 7.398 -2.852) 10.200 6.218 ( 4.353 -2.493 7.025) 8.632 6.429 ( -0.102 -9.133 6.966) 11.487 6.544 ( -3.931 0.862 1.860) 4.434 6.687 ( 0.312 1.925 2.826) 3.433 6.877 ( 2.313 -4.763 -7.910) 9.518 7.100 ( -4.737 6.782 -5.852) 10.133 7.219 ( 1.769 2.627 -12.672) 13.062 7.356 ( 1.825 -4.613 3.405) 6.017 7.508 ( -8.082 -4.452 7.164) 11.682 7.598 ( -1.926 -1.690 -3.089) 4.014 7.827 ( -3.933 3.388 -5.126) 7.296 7.854 ( 1.096 -5.085 -15.273) 16.135 7.990 ( 3.394 0.262 -5.753) 6.685 8.096 ( 5.180 -0.511 -5.267) 7.405 8.178 ( -1.942 3.302 -9.615) 10.350 8.301 ( 1.970 2.103 -8.505) 8.980 8.438 ( -2.379 -2.421 -7.044) 7.819 8.498 ( 3.521 6.910 -13.871) 15.892 8.720 ( -3.397 -2.090 3.862) 5.552 8.760 ( 0.929 -1.037 -0.502) 1.480 8.874 ( 5.069 -0.235 -2.988) 5.888 8.977 ( 1.206 3.836 -5.563) 6.864 9.073 ( -1.042 1.025 0.527) 1.554 9.248 ( 0.107 -0.728 -1.756) 1.903 9.360 ( 3.662 -2.770 4.054) 6.125 9.449 ( -8.753 2.410 -3.643) 9.782 9.600 ( 1.421 -5.056 -2.529) 5.828 9.625 ( 6.568 -6.331 0.462) 9.134 9.816 ( 5.999 -2.627 -4.776) 8.105 10.008 ( 1.595 -11.916 -7.331) 14.081 10.235 ( 6.782 4.810 -1.154) 8.394 10.365 ( -0.079 4.908 -5.491) 7.365 10.452 ( -1.722 1.266 -1.976) 2.910 10.524 ( -0.217 10.510 -1.962) 10.694 10.710 ( -3.139 -0.072 -1.132) 3.338 10.855 ( -4.829 1.694 1.788) 5.421 10.972 ( 0.133 -2.726 1.954) 3.357 11.034 ( 1.684 -2.957 -6.779) 7.585 11.106 ( 0.714 2.903 -3.923) 4.933 11.405 ( 6.745 -0.915 -1.223) 6.916 11.551 ( 0.663 2.474 3.745) 4.538 11.699 ( 2.754 -1.657 0.521) 3.256 11.800 ( -3.771 1.122 4.151) 5.719 11.962 ( 2.149 -6.948 -1.219) 7.374 12.124 ( 0.545 -2.542 -0.278) 2.615 12.266 ( -2.367 -5.117 4.469) 7.194 12.483 ( -2.786 3.234 6.975) 8.178 12.644 ( 0.802 7.691 -5.321) 9.386 13.063 ( 4.480 0.661 -1.830) 4.884 13.209 ( -3.113 2.438 9.249) 10.059 13.520 ( -8.991 0.386 -4.752) 10.176 13.719 ( 4.842 -7.637 -5.876) 10.784 13.856 ( -1.040 -6.399 4.320) 7.790 13.944 ( 1.356 -5.175 -3.374) 6.325 14.363 ( -4.525 6.298 5.384) 9.441 14.573 ( -7.482 -0.151 8.886) 11.618 14.848 ( 0.682 6.303 1.660) 6.554 15.027 ( 2.093 2.112 2.297) 3.757 15.179 ( 4.293 2.842 -5.220) 7.332 15.441 ( 2.352 2.965 0.313) 3.798 15.691 ( -0.843 -1.712 7.988) 8.213 15.852 ( 6.137 -9.654 1.029) 11.486 16.217 ( -4.212 5.976 1.603) 7.485 16.279 ( 2.112 1.831 -3.478) 4.462 16.474 ( -0.762 1.474 -8.700) 8.857 16.670 ( 9.313 -0.211 3.518) 9.957 16.844 ( 8.398 0.041 -0.986) 8.456 17.001 ( 4.991 -26.116 18.636) 32.469 18.537 ( 21.113 2.726 21.447) 30.219 19.169 ( -0.853 -6.790 -9.979) 12.100 19.590 ( -5.891 0.071 3.145) 6.678 19.720 ( -4.030 -2.467 12.187) 13.071 21.978 ( 4.759 3.500 -28.107) 28.721 22.054 ( 8.387 2.317 -26.960) 28.329 22.352 ( 2.533 -0.071 -19.141) 19.308 22.397 ( 6.374 -0.090 -20.317) 21.294 25.201 ( 0.805 1.479 10.079) 10.219 25.241 ( -2.277 0.404 9.772) 10.042 25.636 ( -2.467 0.993 9.126) 9.505 25.667 ( -2.905 1.210 8.811) 9.357 25.945 ( -12.844 -1.931 -12.070) 17.731 26.100 ( -35.151 -4.854 -20.081) 40.773 27.321 ( 9.074 -0.392 -5.634) 10.688 27.805 ( 11.448 -4.557 -25.506) 28.326 28.436 ( -2.892 6.001 0.157) 6.663 28.770 ( 2.548 0.246 5.419) 5.993 28.926 ( 4.305 -0.369 -6.235) 7.586 29.082 ( 1.354 -2.909 -8.089) 8.702 29.503 ( 2.276 -1.874 -0.995) 3.112 29.631 ( -10.220 -1.511 9.108) 13.772 29.991 ( 4.749 18.528 -1.401) 19.178 30.294 ( -6.714 1.267 17.239) 18.544 30.513 ( -10.865 -0.787 20.693) 23.385 30.577 ( -10.156 0.761 16.545) 19.429 31.081 ( -3.435 -3.125 14.588) 15.310 31.207 ( -0.519 -2.877 0.944) 3.072 31.627 ( -1.848 -3.454 13.331) 13.894 31.817 ( 0.870 -5.738 -1.926) 6.115 32.694 ( 9.974 6.977 -19.658) 23.121 33.034 ( 17.543 5.191 -5.731) 19.171 ======================= Grid point 80 (43/104) ======================= q-point: ( 0.00 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.128 ( -3.177 33.702 18.102) 38.387 2.472 ( 2.920 27.518 25.767) 37.812 2.764 ( 0.875 13.737 2.164) 13.934 3.327 ( -1.867 -10.268 7.543) 12.877 3.454 ( -1.695 13.119 27.858) 30.839 3.665 ( -3.882 -17.433 -2.392) 18.019 3.841 ( -5.327 -1.854 17.171) 18.074 3.922 ( -3.776 -6.620 10.987) 13.372 4.303 ( -8.098 12.333 19.917) 24.786 4.393 ( -12.343 -4.036 41.780) 43.752 4.474 ( -7.177 -1.540 35.110) 35.869 4.591 ( -12.423 -6.108 20.851) 25.028 4.967 ( 12.086 4.528 5.141) 13.892 5.026 ( -14.918 -1.028 4.832) 15.714 5.272 ( 8.269 1.320 33.448) 34.480 5.364 ( -1.440 11.457 18.195) 21.550 5.462 ( 3.034 -2.140 4.190) 5.598 5.634 ( -2.964 4.626 14.133) 15.163 5.763 ( -0.448 3.682 4.709) 5.995 5.955 ( -6.733 1.800 4.582) 8.340 6.171 ( 1.524 -12.115 4.038) 12.861 6.286 ( 1.922 -11.405 2.453) 11.823 6.467 ( -7.815 3.669 9.049) 12.507 6.710 ( 2.404 -2.992 4.055) 5.583 6.908 ( 5.262 6.340 -5.394) 9.848 7.089 ( -2.267 -0.420 6.830) 7.209 7.106 ( -3.794 -0.863 0.735) 3.959 7.222 ( -12.570 -4.478 11.134) 17.379 7.554 ( 6.713 5.948 -6.155) 10.878 7.686 ( 0.937 7.015 -4.391) 8.329 7.739 ( 2.395 -4.000 -7.955) 9.221 7.771 ( -2.609 1.812 -9.588) 10.100 7.994 ( -0.417 -5.914 -3.626) 6.949 8.046 ( 0.632 -2.208 -5.940) 6.368 8.226 ( 5.066 2.137 -4.953) 7.401 8.341 ( 3.796 5.790 -8.867) 11.250 8.441 ( 1.893 1.473 -6.362) 6.799 8.593 ( 0.986 7.342 -13.268) 15.196 8.754 ( 1.853 -2.721 -3.013) 4.463 8.793 ( 3.279 2.998 1.491) 4.686 8.890 ( -3.437 0.017 -3.184) 4.685 8.988 ( -0.105 -4.617 -4.482) 6.436 9.166 ( 5.983 5.333 -7.122) 10.721 9.251 ( 2.744 -2.558 -3.975) 5.466 9.310 ( 1.493 -1.978 -2.485) 3.509 9.408 ( 3.356 -6.092 -3.964) 8.005 9.536 ( 3.703 -7.073 -2.433) 8.347 9.571 ( 2.830 -8.134 -0.825) 8.652 9.835 ( 1.424 -3.364 -4.009) 5.424 9.866 ( 4.709 -4.323 -2.959) 7.044 10.384 ( -1.102 2.927 0.373) 3.149 10.412 ( -4.548 7.534 -1.265) 8.891 10.507 ( 1.232 2.923 -1.818) 3.656 10.584 ( 1.537 -1.138 6.100) 6.393 10.643 ( -4.329 -0.510 -2.704) 5.129 10.770 ( -8.549 -3.062 0.676) 9.106 10.890 ( -0.105 -5.612 -3.981) 6.881 10.914 ( -0.028 -1.781 -2.079) 2.737 11.237 ( 3.181 10.233 -10.078) 14.711 11.395 ( -2.773 0.507 -0.420) 2.850 11.586 ( -2.490 -0.229 3.540) 4.334 11.689 ( 2.808 -1.431 -4.619) 5.592 11.822 ( 2.165 0.183 2.998) 3.703 11.982 ( 6.238 0.066 -0.863) 6.298 12.138 ( -1.571 -1.915 2.448) 3.483 12.205 ( 2.878 -0.735 1.618) 3.382 12.629 ( 0.769 9.196 7.225) 11.721 12.848 ( 9.179 2.597 -10.795) 14.406 13.145 ( 0.664 1.373 -3.442) 3.765 13.201 ( -9.816 1.362 10.075) 14.132 13.315 ( -7.541 5.263 0.731) 9.225 13.623 ( 1.752 -8.981 3.000) 9.629 13.662 ( -1.362 -9.160 -2.226) 9.525 13.688 ( -4.913 -10.291 -1.484) 11.500 14.324 ( -11.837 7.644 -3.367) 14.487 14.474 ( -4.585 3.245 -4.321) 7.087 14.915 ( -4.659 4.413 -4.851) 8.045 15.013 ( -1.985 -3.499 -1.362) 4.247 15.378 ( 2.219 -4.214 15.129) 15.861 15.604 ( -12.127 -11.560 21.198) 27.019 15.719 ( 1.227 5.987 12.581) 13.987 15.892 ( 9.250 2.106 0.748) 9.516 16.030 ( 2.601 -0.230 -7.490) 7.932 16.168 ( -4.891 -0.838 -3.265) 5.940 16.395 ( -5.716 5.027 -5.378) 9.320 16.657 ( -1.331 -6.152 10.986) 12.661 16.880 ( 7.678 2.757 -5.189) 9.669 17.057 ( 9.065 -4.569 -3.328) 10.682 18.880 ( 2.435 -4.579 3.654) 6.344 18.952 ( -5.355 -6.058 0.296) 8.091 19.545 ( -0.491 0.610 7.498) 7.539 19.649 ( -0.583 -4.064 9.792) 10.618 22.043 ( 5.273 4.126 -26.944) 27.764 22.132 ( 5.979 -0.032 -23.030) 23.794 22.333 ( 3.596 2.325 -20.636) 21.076 22.424 ( 5.747 -1.678 -20.579) 21.433 25.248 ( -4.721 1.302 6.644) 8.254 25.268 ( -4.115 0.606 6.934) 8.086 25.614 ( 2.199 0.530 3.413) 4.095 25.652 ( -3.747 -0.209 5.336) 6.524 25.757 ( 9.240 1.947 3.791) 10.176 25.809 ( 7.783 -2.063 -2.112) 8.324 27.444 ( 1.202 6.273 -11.237) 12.925 27.753 ( 3.845 -7.874 -21.833) 23.526 28.561 ( 0.186 8.594 -0.988) 8.652 28.807 ( -1.491 -2.617 1.664) 3.441 28.927 ( -1.165 -0.260 -8.049) 8.137 28.963 ( 1.168 -2.170 -6.205) 6.677 29.509 ( -2.151 2.353 4.245) 5.309 29.607 ( 8.452 -3.052 3.606) 9.682 30.213 ( -8.461 2.920 12.117) 15.064 30.264 ( -8.530 0.843 15.937) 18.096 30.550 ( 5.592 5.636 12.578) 14.875 30.629 ( 1.763 -0.123 23.385) 23.452 31.001 ( -2.851 -1.127 15.777) 16.072 31.179 ( 2.822 -4.511 3.634) 6.443 31.630 ( -0.826 -0.159 11.983) 12.012 31.700 ( -0.458 -4.738 2.085) 5.197 32.850 ( -1.576 9.211 -23.554) 25.340 33.094 ( -6.262 -1.483 -22.207) 23.121 ======================= Grid point 81 (44/104) ======================= q-point: ( 0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.350 ( 12.014 19.817 21.279) 31.462 2.720 ( 7.334 13.144 9.666) 17.888 2.944 ( 14.413 19.337 19.007) 30.707 3.336 ( -2.229 -13.830 9.208) 16.764 3.498 ( -5.900 -17.216 2.655) 18.391 3.629 ( 2.318 2.980 14.026) 14.525 3.738 ( -7.887 1.059 11.576) 14.048 3.949 ( 1.383 1.194 13.962) 14.081 4.128 ( -16.502 11.079 20.949) 28.877 4.336 ( -8.942 -1.796 37.213) 38.315 4.443 ( -7.396 -2.384 14.635) 16.570 4.563 ( -3.683 -7.812 34.608) 35.669 4.665 ( -14.602 7.573 7.871) 18.235 5.139 ( -3.096 -6.998 9.804) 12.437 5.369 ( -2.211 13.594 3.438) 14.195 5.504 ( -3.510 5.659 17.038) 18.293 5.633 ( 6.133 3.694 15.813) 17.358 5.705 ( 1.895 -1.420 24.956) 25.068 5.761 ( -2.985 5.293 8.818) 10.709 5.836 ( -3.849 4.572 10.680) 12.238 6.083 ( -5.110 -1.825 4.466) 7.028 6.352 ( 4.115 -10.379 9.886) 14.913 6.552 ( 7.324 -0.378 4.868) 8.803 6.779 ( -15.149 5.046 -5.014) 16.735 6.794 ( 0.026 -2.228 -0.043) 2.229 7.000 ( 3.928 1.416 -2.900) 5.084 7.158 ( -1.146 -0.833 6.121) 6.283 7.249 ( 9.183 -3.998 6.961) 12.197 7.565 ( -5.478 5.783 -6.497) 10.279 7.652 ( 1.413 1.024 0.366) 1.783 7.724 ( 2.280 10.580 -3.992) 11.536 7.787 ( 4.637 -5.414 -3.257) 7.837 7.967 ( 0.469 -4.742 -5.661) 7.400 8.030 ( -0.256 -7.175 -6.585) 9.742 8.293 ( 0.998 4.668 -0.764) 4.834 8.346 ( 2.163 8.690 -6.449) 11.036 8.514 ( 4.374 -1.018 -6.435) 7.847 8.592 ( 4.561 4.817 -12.227) 13.911 8.667 ( -6.156 2.239 -1.769) 6.785 8.759 ( -5.738 -2.094 -2.297) 6.526 8.908 ( 1.532 -5.627 -4.930) 7.637 8.983 ( 3.678 -6.018 -7.070) 9.987 9.212 ( 1.399 1.567 -7.478) 7.768 9.295 ( 0.546 -1.821 -2.993) 3.546 9.390 ( 7.343 -5.867 -0.453) 9.410 9.500 ( 5.910 -6.644 -4.882) 10.144 9.582 ( -2.835 -3.329 4.370) 6.182 9.637 ( 5.288 -4.834 -0.853) 7.215 9.841 ( 3.916 1.583 -8.287) 9.301 9.968 ( 7.351 -5.849 -7.823) 12.225 10.299 ( -3.641 3.564 -5.910) 7.803 10.377 ( -0.240 2.546 -0.649) 2.638 10.416 ( -6.703 3.746 1.808) 7.889 10.520 ( -10.516 -6.192 -3.258) 12.631 10.640 ( 3.613 0.502 -1.622) 3.992 10.684 ( 3.367 -6.200 4.068) 8.144 10.857 ( -1.522 -2.788 -0.786) 3.272 10.891 ( -2.659 -2.141 -2.466) 4.211 11.244 ( 0.644 12.702 -8.903) 15.525 11.347 ( -0.550 5.586 -2.500) 6.145 11.541 ( -2.887 1.144 2.528) 4.005 11.700 ( -0.190 -1.297 -5.314) 5.474 11.866 ( -0.237 0.338 1.038) 1.117 12.047 ( -1.329 -4.577 -1.109) 4.894 12.097 ( 1.596 7.292 3.423) 8.212 12.262 ( -0.013 -1.914 2.142) 2.872 12.661 ( -1.959 4.034 7.794) 8.992 12.933 ( -14.899 -1.744 12.375) 19.446 12.992 ( 5.065 3.588 -8.401) 10.446 13.143 ( 0.744 -0.800 -1.778) 2.087 13.263 ( 4.085 5.138 -7.379) 9.876 13.550 ( -0.728 -8.913 -8.897) 12.615 13.689 ( 3.425 -4.570 -1.372) 5.874 13.749 ( 2.361 -10.348 16.234) 19.396 14.144 ( -3.255 3.926 0.486) 5.123 14.412 ( -0.257 -4.479 -0.752) 4.549 14.789 ( -4.507 -0.307 -5.479) 7.101 14.910 ( -5.262 -5.392 -1.089) 7.612 15.360 ( -14.421 -4.102 28.479) 32.184 15.478 ( -0.032 -6.781 19.100) 20.268 15.736 ( -6.510 9.940 5.749) 13.200 15.873 ( -7.820 -0.137 -5.037) 9.302 16.158 ( 8.549 -0.591 -0.766) 8.604 16.170 ( 6.231 -1.460 -8.244) 10.437 16.396 ( 4.885 12.786 6.269) 15.055 16.628 ( -6.566 4.541 7.156) 10.721 16.928 ( 0.646 3.768 -10.626) 11.292 17.079 ( -3.326 -0.297 -8.051) 8.716 18.712 ( -11.140 -1.666 -1.714) 11.394 18.911 ( -3.339 -13.718 9.897) 17.243 19.615 ( 2.973 0.473 6.147) 6.844 19.711 ( 2.471 -3.655 3.702) 5.759 22.029 ( 5.306 4.248 -27.451) 28.280 22.132 ( 3.650 -1.144 -21.633) 21.969 22.323 ( 4.561 3.890 -21.902) 22.708 22.439 ( 4.266 -1.965 -19.875) 20.423 25.156 ( -3.853 1.909 5.019) 6.609 25.222 ( -2.903 -1.401 7.187) 7.876 25.639 ( -1.830 0.735 9.325) 9.531 25.680 ( -0.997 -1.150 13.005) 13.094 26.107 ( 21.834 2.880 -7.226) 23.179 26.279 ( 32.970 -6.323 -11.367) 35.443 27.327 ( -7.059 7.081 -12.996) 16.397 27.655 ( -3.771 -9.190 -21.710) 23.874 28.564 ( 0.544 5.236 -0.479) 5.286 28.717 ( -4.105 -2.557 -3.480) 5.958 28.903 ( 0.436 2.292 -3.673) 4.351 28.967 ( 0.942 -1.894 -3.050) 3.712 29.536 ( 2.835 8.108 1.414) 8.705 29.794 ( 4.660 -4.854 6.422) 9.301 30.125 ( -5.867 1.140 13.362) 14.638 30.163 ( -4.653 -0.830 10.717) 11.712 30.732 ( 2.661 -2.371 18.078) 18.426 30.789 ( 2.088 -3.629 20.795) 21.213 31.060 ( 2.199 2.239 16.904) 17.193 31.270 ( 2.439 -4.721 7.640) 9.306 31.663 ( -0.233 1.741 9.270) 9.435 31.736 ( 2.425 -1.493 5.205) 5.933 32.600 ( -9.919 7.885 -23.680) 26.857 32.706 ( -16.354 3.725 -21.933) 27.611 ======================= Grid point 82 (45/104) ======================= q-point: ( 0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.650 ( 3.401 13.766 10.956) 17.919 2.831 ( 1.512 14.953 10.801) 18.508 3.217 ( -7.711 -6.577 9.975) 14.220 3.385 ( 5.228 3.713 5.132) 8.213 3.499 ( 4.452 16.683 16.456) 23.852 3.570 ( -5.927 -5.236 16.321) 18.136 3.759 ( -6.986 -4.146 11.451) 14.040 3.887 ( -0.814 -2.447 3.085) 4.021 4.061 ( 0.367 3.044 4.231) 5.225 4.290 ( -7.333 -10.341 16.636) 20.916 4.437 ( -0.534 3.524 36.246) 36.421 4.523 ( 2.236 12.725 11.399) 17.230 4.745 ( 0.736 -6.734 37.486) 38.093 5.017 ( -10.918 -9.280 14.920) 20.686 5.240 ( -13.726 9.643 22.054) 27.709 5.442 ( -9.995 3.669 18.237) 21.118 5.612 ( -13.335 2.162 12.607) 18.478 5.639 ( -5.481 3.450 11.242) 12.974 5.809 ( 0.165 -3.051 8.901) 9.411 5.950 ( 5.248 -6.684 8.529) 12.040 6.238 ( 3.700 12.976 16.335) 21.188 6.443 ( -2.590 8.633 -3.490) 9.665 6.527 ( -0.064 5.052 14.727) 15.569 6.680 ( 4.441 4.950 -1.941) 6.928 6.736 ( -1.808 4.665 -5.575) 7.491 7.091 ( 3.979 -5.087 5.401) 8.419 7.253 ( 5.250 -12.158 5.809) 14.461 7.343 ( -6.961 -11.126 0.854) 13.152 7.422 ( -2.049 7.608 -0.559) 7.899 7.719 ( 0.220 6.262 -4.723) 7.847 7.750 ( 7.339 -0.287 2.173) 7.660 7.895 ( 1.110 -1.170 -16.325) 16.405 7.977 ( 4.646 -8.778 6.324) 11.774 8.033 ( 4.592 -4.247 -6.830) 9.261 8.277 ( -1.521 7.066 -0.499) 7.245 8.361 ( 0.814 4.895 -3.129) 5.866 8.471 ( -4.790 -2.313 -2.771) 5.998 8.521 ( -5.574 -2.604 -3.302) 6.983 8.646 ( 5.452 6.893 -7.867) 11.795 8.735 ( 2.769 -1.589 -3.882) 5.026 8.849 ( -2.513 -6.457 -6.548) 9.534 9.019 ( 3.419 -0.406 -10.445) 10.998 9.182 ( -1.687 3.700 -4.751) 6.254 9.261 ( -0.537 -6.681 -7.133) 9.788 9.460 ( -8.537 -1.767 3.880) 9.542 9.490 ( 1.525 -3.157 -3.892) 5.238 9.577 ( 2.533 -7.344 -5.278) 9.392 9.652 ( -2.837 -1.533 -1.272) 3.466 9.948 ( -4.286 -0.104 -11.556) 12.325 10.072 ( 9.884 -3.463 -8.590) 13.545 10.197 ( -2.241 -0.522 -7.873) 8.203 10.299 ( 2.347 -1.074 -5.919) 6.457 10.381 ( 5.345 0.680 2.495) 5.937 10.519 ( 3.764 -0.376 3.722) 5.307 10.703 ( 1.331 1.032 -7.994) 8.169 10.739 ( 0.030 0.523 0.894) 1.037 10.767 ( 1.334 -5.419 -0.513) 5.604 10.898 ( 2.543 -5.520 3.589) 7.058 11.189 ( -1.187 10.343 -4.046) 11.169 11.320 ( -1.398 5.659 -4.006) 7.073 11.499 ( -2.591 3.727 2.711) 5.287 11.608 ( -3.637 -3.522 -4.441) 6.735 11.884 ( 2.874 3.822 0.181) 4.786 12.068 ( -1.488 -4.690 3.561) 6.073 12.143 ( 0.552 4.784 -0.290) 4.825 12.207 ( -3.187 -0.795 0.855) 3.394 12.573 ( -8.008 -0.436 11.766) 14.239 12.760 ( -5.071 -3.928 2.610) 6.925 13.011 ( 0.791 2.779 -0.823) 3.004 13.171 ( 2.624 1.569 -2.211) 3.773 13.372 ( 6.396 -2.701 -4.976) 8.542 13.552 ( 3.155 -6.598 -8.293) 11.057 13.764 ( 4.567 -0.360 -3.918) 6.029 13.846 ( 1.194 -3.222 4.434) 5.609 14.222 ( 6.340 -0.525 11.369) 13.028 14.458 ( 2.389 -12.099 18.256) 22.031 14.741 ( 4.302 1.375 -4.937) 6.691 14.859 ( 1.515 -3.488 -2.908) 4.787 15.235 ( -9.068 7.947 20.607) 23.876 15.522 ( -7.212 -2.224 10.592) 13.006 15.617 ( -3.881 -1.357 6.657) 7.824 15.725 ( -1.296 -2.957 6.027) 6.838 16.223 ( -1.532 2.868 -5.904) 6.740 16.325 ( 6.983 -1.939 -3.566) 8.077 16.406 ( -9.015 10.860 -2.310) 14.302 16.551 ( 2.493 9.470 10.278) 14.196 16.864 ( -2.973 7.114 -3.871) 8.627 16.939 ( -4.377 -1.285 -10.531) 11.476 18.495 ( -8.512 2.000 3.394) 9.380 18.907 ( -0.285 -17.204 5.512) 18.068 19.697 ( 1.958 0.311 3.944) 4.414 19.753 ( 0.182 -2.244 0.167) 2.258 22.028 ( 6.264 3.504 -27.273) 28.201 22.099 ( 2.821 -0.434 -21.910) 22.095 22.329 ( 5.498 3.378 -22.847) 23.741 22.426 ( 3.044 -1.703 -19.617) 19.925 25.133 ( -1.169 1.874 7.088) 7.424 25.212 ( -1.678 -2.003 9.049) 9.419 25.646 ( -1.540 0.814 9.545) 9.703 25.699 ( -2.557 -1.660 12.360) 12.731 26.529 ( 16.937 6.318 -13.548) 22.591 26.840 ( 21.344 -9.290 -21.700) 31.824 27.062 ( -8.492 6.583 -11.527) 15.759 27.415 ( -6.999 -11.474 -20.350) 24.388 28.592 ( 2.184 1.819 1.065) 3.035 28.644 ( -1.897 -0.561 -0.869) 2.160 28.889 ( 0.259 3.235 -5.130) 6.070 28.977 ( 1.174 -1.703 -2.552) 3.285 29.601 ( 1.667 8.939 0.212) 9.095 29.825 ( -4.326 -3.945 8.775) 10.549 30.073 ( -2.903 3.308 10.862) 11.720 30.191 ( 0.777 -1.612 12.399) 12.528 30.803 ( -4.079 -4.098 21.075) 21.854 30.857 ( -2.653 -6.798 12.483) 14.460 31.188 ( -0.542 -1.049 16.259) 16.302 31.272 ( -8.342 -5.036 15.974) 18.711 31.703 ( -1.924 5.449 4.271) 7.185 31.788 ( -2.558 0.838 6.014) 6.589 32.384 ( 4.551 7.202 -17.501) 19.464 32.419 ( 4.043 4.488 -22.274) 23.078 ======================= Grid point 83 (46/104) ======================= q-point: (-0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.563 ( -9.809 24.861 4.442) 27.092 2.765 ( -17.440 20.065 18.344) 32.300 3.069 ( -12.944 23.576 3.140) 27.078 3.329 ( 0.479 -10.110 7.986) 12.893 3.519 ( -3.858 -4.622 4.169) 7.323 3.639 ( -2.126 -8.215 21.908) 23.494 3.798 ( 4.572 6.880 0.089) 8.261 3.988 ( -5.543 -1.888 1.426) 6.027 4.035 ( 7.707 2.764 20.756) 22.313 4.301 ( 0.988 -3.057 11.982) 12.406 4.600 ( -0.803 7.765 29.915) 30.917 4.708 ( -2.177 3.559 26.553) 26.879 4.844 ( -11.635 -7.735 46.907) 48.944 4.886 ( -8.416 -4.872 28.127) 29.761 5.199 ( 1.785 2.375 19.535) 19.759 5.305 ( -4.140 -0.373 20.522) 20.939 5.434 ( -4.622 7.692 0.677) 8.999 5.557 ( -7.441 -2.578 8.265) 11.416 5.749 ( -5.552 7.616 2.391) 9.723 6.012 ( -3.636 -6.947 10.571) 13.162 6.186 ( -5.953 -0.684 13.936) 15.170 6.534 ( 3.431 5.400 0.102) 6.398 6.597 ( -1.627 5.576 2.678) 6.396 6.728 ( -1.727 5.367 8.297) 10.031 6.780 ( 5.187 1.393 -3.301) 6.304 7.114 ( -3.965 -11.733 0.356) 12.390 7.196 ( 0.930 -3.617 8.515) 9.298 7.366 ( -0.636 0.089 4.546) 4.591 7.445 ( 3.276 -3.708 3.045) 5.810 7.676 ( -3.458 7.803 -3.709) 9.306 7.808 ( 0.552 -5.544 -18.871) 19.677 7.853 ( 2.944 -2.240 -1.751) 4.093 8.028 ( -1.563 0.150 -8.342) 8.488 8.120 ( 0.075 -8.405 3.849) 9.244 8.221 ( -2.510 4.944 -3.586) 6.603 8.309 ( -1.891 6.314 -7.138) 9.715 8.470 ( 8.168 0.457 -4.573) 9.373 8.533 ( 6.130 -5.427 -1.616) 8.345 8.668 ( -0.493 -0.271 -5.515) 5.543 8.723 ( -1.285 -5.659 -1.401) 5.970 8.830 ( 2.786 6.817 -5.991) 9.494 9.040 ( 0.932 5.869 -4.967) 7.745 9.122 ( -0.709 -3.348 -7.155) 7.932 9.224 ( 0.196 -4.846 -8.486) 9.774 9.317 ( -3.358 0.428 1.712) 3.793 9.466 ( -1.614 -2.429 -2.676) 3.958 9.572 ( 1.013 -5.703 -2.722) 6.400 9.599 ( -2.330 -2.826 -8.153) 8.937 9.745 ( -3.168 -0.699 -7.531) 8.200 9.970 ( -10.792 -6.191 -13.721) 18.522 10.219 ( 4.935 8.046 0.470) 9.451 10.385 ( 5.031 0.758 -5.856) 7.757 10.501 ( 2.924 3.445 -0.970) 4.622 10.648 ( 4.604 -0.042 2.081) 5.053 10.689 ( -0.445 3.113 1.673) 3.562 10.785 ( 4.170 -4.502 -5.741) 8.403 10.876 ( 5.423 -5.005 -2.836) 7.906 10.994 ( 3.131 -9.178 2.885) 10.118 11.229 ( 6.160 6.173 -2.481) 9.066 11.258 ( -0.587 3.189 -7.056) 7.766 11.484 ( 2.532 3.560 4.668) 6.394 11.585 ( 2.037 -2.308 -3.125) 4.387 11.898 ( -9.576 1.086 3.774) 10.350 11.917 ( -2.925 1.810 5.699) 6.656 12.120 ( -4.424 -1.357 0.876) 4.709 12.219 ( 1.618 -4.049 2.535) 5.044 12.526 ( 1.039 2.485 1.721) 3.197 12.705 ( -0.554 -3.088 -1.105) 3.327 13.040 ( 1.426 4.198 3.575) 5.696 13.232 ( 3.298 1.757 -2.128) 4.300 13.459 ( 3.012 -6.005 -0.146) 6.720 13.568 ( 0.519 -5.545 -3.308) 6.477 13.834 ( 2.274 -2.894 -7.181) 8.069 13.835 ( -1.017 -2.984 -2.650) 4.118 14.426 ( 7.508 6.942 15.968) 18.962 14.657 ( 3.082 -0.703 15.278) 15.602 14.867 ( 6.036 0.523 -2.509) 6.558 14.973 ( 6.947 -0.525 -0.820) 7.015 15.189 ( 3.494 -2.865 15.203) 15.860 15.343 ( -8.824 -2.295 -2.703) 9.509 15.593 ( -0.009 4.171 7.786) 8.833 15.835 ( -4.890 1.536 10.874) 12.021 16.018 ( -0.960 1.758 9.195) 9.410 16.353 ( -1.048 -0.719 -3.804) 4.011 16.435 ( 4.462 -0.275 -4.483) 6.331 16.614 ( 1.749 -2.009 3.591) 4.471 16.712 ( -8.155 6.436 -1.424) 10.486 16.872 ( 0.094 -0.587 -6.978) 7.003 18.428 ( 1.048 8.536 7.788) 11.602 18.946 ( 2.620 -15.654 0.053) 15.872 19.704 ( -3.953 -0.185 2.512) 4.688 19.724 ( -2.420 -1.302 3.315) 4.306 22.048 ( 6.739 2.578 -26.217) 27.192 22.065 ( 4.166 1.378 -23.671) 24.074 22.349 ( 6.065 1.518 -22.935) 23.772 22.397 ( 2.723 -1.019 -19.551) 19.766 25.163 ( 0.247 1.542 9.565) 9.692 25.225 ( -1.418 -1.471 10.428) 10.626 25.657 ( -1.555 0.910 9.124) 9.301 25.691 ( -2.675 -0.756 10.043) 10.421 26.376 ( -18.568 4.264 -15.607) 24.628 26.680 ( -22.360 -11.727 -23.701) 34.630 27.144 ( 15.280 6.723 -9.801) 19.358 27.473 ( 16.453 -9.135 -19.754) 27.284 28.607 ( -1.804 3.749 0.585) 4.202 28.667 ( 3.655 -0.288 3.163) 4.842 28.886 ( 2.364 2.216 -6.709) 7.450 28.997 ( 2.196 -2.662 -4.055) 5.324 29.576 ( -3.641 4.125 -0.546) 5.529 29.727 ( -7.922 -4.125 8.646) 12.431 30.125 ( 2.994 8.317 9.814) 13.208 30.272 ( 0.257 -0.252 17.054) 17.058 30.734 ( -11.888 -1.468 19.698) 23.054 30.781 ( -10.095 -2.753 10.350) 14.717 31.088 ( -9.708 -1.115 13.331) 16.529 31.172 ( -6.042 -5.261 8.497) 11.679 31.620 ( -4.355 2.976 6.191) 8.134 31.729 ( -2.474 -2.816 2.056) 4.275 32.600 ( 18.311 6.618 -18.730) 27.017 32.689 ( 22.312 3.790 -9.539) 24.560 ======================= Grid point 84 (47/104) ======================= q-point: (-0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.336 ( -17.365 34.520 8.186) 39.499 2.445 ( -11.999 32.198 23.398) 41.571 2.833 ( -7.535 15.366 -0.350) 17.118 3.350 ( -3.195 -11.005 8.847) 14.477 3.450 ( -6.892 8.998 19.260) 22.347 3.747 ( -2.349 -2.830 7.164) 8.053 3.783 ( 0.267 -7.531 12.465) 14.566 3.928 ( -0.697 -6.333 7.037) 9.493 4.305 ( -0.632 6.599 22.428) 23.388 4.395 ( 2.156 4.920 17.856) 18.647 4.582 ( -14.820 -1.879 38.374) 41.179 4.652 ( -2.970 -0.490 27.990) 28.151 4.789 ( -10.255 0.174 19.684) 22.195 4.968 ( 0.792 -3.440 45.289) 45.427 5.270 ( -5.231 -0.557 20.710) 21.368 5.312 ( -0.026 -1.919 0.511) 1.986 5.424 ( -3.034 6.466 5.207) 8.839 5.604 ( 3.857 3.592 9.923) 11.236 5.701 ( 2.173 7.712 2.910) 8.525 5.979 ( 0.249 -9.286 4.624) 10.377 6.170 ( -2.906 -11.736 11.491) 16.679 6.331 ( -11.985 -2.384 1.434) 12.304 6.613 ( -3.986 4.910 6.448) 9.031 6.699 ( -3.235 -1.126 4.434) 5.603 6.824 ( 2.241 2.032 -0.769) 3.122 7.141 ( 1.397 -7.828 -0.675) 7.980 7.215 ( -8.299 2.276 10.739) 13.762 7.375 ( 1.245 1.692 1.616) 2.651 7.454 ( -1.393 2.518 -0.580) 2.935 7.612 ( 2.188 4.833 -1.530) 5.521 7.756 ( 1.655 -5.418 -15.734) 16.723 7.875 ( -0.985 -0.681 -8.329) 8.415 7.983 ( 1.757 -0.608 -5.087) 5.416 8.083 ( -0.750 -4.768 -3.522) 5.975 8.165 ( 1.011 2.930 -5.346) 6.180 8.286 ( 2.698 0.335 -6.460) 7.008 8.513 ( -3.701 3.979 -6.375) 8.377 8.625 ( 3.916 4.918 -14.518) 15.821 8.672 ( 2.658 -1.641 -0.189) 3.129 8.754 ( 3.384 -1.053 1.611) 3.893 8.897 ( 4.120 2.913 -2.173) 5.494 9.010 ( -0.708 -2.048 -4.106) 4.643 9.092 ( 2.362 1.643 -6.767) 7.354 9.222 ( 2.499 -0.813 -4.638) 5.331 9.307 ( 0.491 -1.741 -3.815) 4.222 9.472 ( -6.388 -0.421 -5.572) 8.487 9.487 ( 3.798 -7.042 -1.775) 8.195 9.521 ( -1.451 -3.452 -4.070) 5.531 9.766 ( 5.425 -2.604 -4.130) 7.299 9.814 ( 1.802 -7.086 -7.260) 10.304 10.346 ( 5.076 5.132 1.867) 7.456 10.443 ( 2.713 0.293 -2.267) 3.547 10.496 ( -1.790 7.750 -3.644) 8.750 10.612 ( -4.054 1.464 1.141) 4.459 10.727 ( -0.651 -1.114 0.849) 1.545 10.836 ( 1.519 -1.628 -2.512) 3.356 10.912 ( -0.244 -7.766 -3.692) 8.602 10.972 ( -4.756 -0.818 3.724) 6.096 11.219 ( 2.257 7.879 -10.011) 12.938 11.382 ( 5.593 -1.560 -2.255) 6.229 11.596 ( 1.137 1.767 2.032) 2.923 11.659 ( 3.646 -2.490 0.705) 4.471 11.810 ( -4.282 -0.695 5.107) 6.701 11.832 ( 3.709 -4.757 -0.967) 6.108 12.093 ( 1.395 1.374 2.456) 3.141 12.218 ( -2.981 -2.621 4.717) 6.165 12.577 ( 1.884 6.595 2.587) 7.330 12.734 ( 5.413 1.616 -8.301) 10.041 13.106 ( 3.034 4.143 1.627) 5.386 13.263 ( -1.124 2.059 4.475) 5.052 13.470 ( -3.934 -4.588 0.747) 6.090 13.570 ( 1.455 -7.342 1.132) 7.570 13.734 ( -5.316 -5.161 -0.374) 7.418 13.821 ( -1.862 -6.904 -10.035) 12.322 14.557 ( -5.774 12.819 7.043) 15.725 14.631 ( -7.107 5.082 0.145) 8.739 14.962 ( 2.878 5.270 -1.255) 6.135 15.018 ( 0.584 0.324 3.233) 3.301 15.229 ( 3.367 -0.428 -1.060) 3.556 15.517 ( 10.566 -6.193 10.567) 16.176 15.654 ( -0.744 0.367 10.850) 10.881 15.722 ( 2.843 6.045 6.977) 9.659 16.174 ( -8.833 -11.973 -2.992) 15.176 16.258 ( -0.611 -9.332 9.555) 13.370 16.534 ( 10.075 -2.864 -5.917) 12.030 16.548 ( -2.116 1.109 -8.136) 8.479 16.736 ( 2.738 1.323 6.125) 6.838 16.857 ( 3.343 -1.018 4.600) 5.777 18.631 ( 12.523 7.251 11.104) 18.240 19.000 ( 2.627 -10.682 -5.784) 12.428 19.599 ( -6.100 0.900 4.572) 7.676 19.670 ( -4.849 -2.719 9.321) 10.853 22.046 ( 5.378 3.360 -25.617) 26.390 22.093 ( 7.417 1.328 -24.627) 25.754 22.355 ( 3.331 0.545 -20.486) 20.762 22.391 ( 5.911 -0.670 -21.242) 22.059 25.227 ( 1.574 1.235 10.262) 10.455 25.248 ( -0.721 0.174 10.058) 10.085 25.660 ( -1.974 1.502 7.694) 8.084 25.689 ( -1.246 0.761 8.395) 8.521 25.911 ( -16.278 -1.109 -10.467) 19.385 25.999 ( -27.330 -5.267 -12.359) 30.453 27.378 ( 9.652 6.338 -10.617) 15.686 27.689 ( 11.470 -7.761 -21.586) 25.647 28.573 ( -1.200 7.911 -0.232) 8.005 28.761 ( 3.135 -1.478 4.084) 5.356 28.923 ( 3.320 0.310 -6.318) 7.144 29.013 ( 0.769 -4.115 -8.571) 9.539 29.503 ( -0.804 1.366 0.580) 1.688 29.592 ( -7.409 -2.559 7.071) 10.557 30.256 ( 2.719 7.760 14.538) 16.702 30.328 ( -4.410 1.995 16.712) 17.398 30.526 ( -9.899 3.285 11.419) 15.465 30.595 ( -9.468 0.957 16.606) 19.139 31.012 ( -4.961 -2.749 16.275) 17.235 31.130 ( 0.041 -5.384 2.688) 6.018 31.602 ( -1.521 0.560 10.225) 10.353 31.708 ( -0.902 -5.231 2.090) 5.705 32.846 ( 11.255 8.721 -20.586) 25.031 33.076 ( 15.610 -1.251 -15.997) 22.386 ======================= Grid point 85 (48/104) ======================= q-point: ( 0.00 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.728 ( -3.882 -19.859 8.878) 22.097 2.728 ( -3.882 19.859 8.878) 22.097 2.992 ( -1.681 -19.164 10.298) 21.820 2.992 ( -1.681 19.164 10.298) 21.820 3.407 ( -2.460 -3.994 1.684) 4.984 3.407 ( -2.460 3.994 1.684) 4.984 3.928 ( -0.539 -4.748 14.101) 14.889 3.928 ( -0.539 4.748 14.101) 14.889 4.363 ( -12.659 -2.320 44.787) 46.599 4.363 ( -12.659 2.320 44.787) 46.599 4.516 ( -10.602 -6.360 24.364) 27.322 4.516 ( -10.602 6.360 24.364) 27.322 5.009 ( -0.253 -2.696 -0.660) 2.788 5.009 ( -0.253 2.696 -0.660) 2.788 5.344 ( 7.155 -6.142 24.842) 26.571 5.344 ( 7.155 6.142 24.842) 26.571 5.620 ( -1.661 -9.121 4.276) 10.209 5.620 ( -1.661 9.121 4.276) 10.209 5.858 ( -1.819 -8.562 13.433) 16.033 5.858 ( -1.819 8.562 13.433) 16.033 6.122 ( -0.643 -6.988 3.717) 7.941 6.122 ( -0.643 6.988 3.717) 7.941 6.586 ( -2.326 -8.387 10.899) 13.948 6.586 ( -2.326 8.387 10.899) 13.948 7.034 ( -1.016 -5.521 -6.463) 8.561 7.034 ( -1.016 5.521 -6.463) 8.561 7.134 ( -6.027 -3.782 14.845) 16.462 7.134 ( -6.027 3.782 14.845) 16.462 7.679 ( 4.222 -5.788 -10.313) 12.557 7.679 ( 4.222 5.788 -10.313) 12.557 7.739 ( 0.295 -1.181 0.089) 1.220 7.739 ( 0.295 1.181 0.089) 1.220 7.990 ( -1.316 -2.712 -5.812) 6.547 7.990 ( -1.316 2.712 -5.812) 6.547 8.302 ( 5.655 -5.857 -6.048) 10.143 8.302 ( 5.655 5.857 -6.048) 10.143 8.615 ( 2.121 -10.520 -8.284) 13.557 8.615 ( 2.121 10.520 -8.284) 13.557 8.748 ( 1.619 -7.345 -6.127) 9.701 8.748 ( 1.619 7.345 -6.127) 9.701 8.914 ( -2.108 -3.166 -4.361) 5.786 8.914 ( -2.108 3.166 -4.361) 5.786 9.214 ( 0.161 -0.436 -6.794) 6.810 9.214 ( 0.161 0.436 -6.794) 6.810 9.317 ( 4.691 -2.344 -5.133) 7.338 9.317 ( 4.691 2.344 -5.133) 7.338 9.480 ( 4.000 -1.444 -2.443) 4.904 9.480 ( 4.000 1.444 -2.443) 4.904 9.816 ( 3.097 -1.278 -1.858) 3.832 9.816 ( 3.097 1.278 -1.858) 3.832 10.450 ( 0.478 -3.357 1.622) 3.759 10.450 ( 0.478 3.357 1.622) 3.759 10.582 ( -3.714 -2.477 1.094) 4.596 10.582 ( -3.714 2.477 1.094) 4.596 10.645 ( -5.172 -7.441 -0.920) 9.109 10.645 ( -5.172 7.441 -0.920) 9.109 10.875 ( -1.361 -2.133 -1.721) 3.060 10.875 ( -1.361 2.133 -1.721) 3.060 11.379 ( 2.204 -3.799 -5.715) 7.207 11.379 ( 2.204 3.799 -5.715) 7.207 11.617 ( 0.609 -4.375 -1.877) 4.800 11.617 ( 0.609 4.375 -1.877) 4.800 11.893 ( 5.160 -6.267 -1.301) 8.221 11.893 ( 5.160 6.267 -1.301) 8.221 12.174 ( 0.637 -2.749 4.505) 5.316 12.174 ( 0.637 2.749 4.505) 5.316 12.799 ( 3.524 -7.476 0.974) 8.322 12.799 ( 3.524 7.476 0.974) 8.322 13.182 ( -4.612 -2.266 0.157) 5.141 13.182 ( -4.612 2.266 0.157) 5.141 13.455 ( -2.329 -8.846 4.159) 10.049 13.455 ( -2.329 8.846 4.159) 10.049 13.578 ( -2.163 -1.289 -5.492) 6.042 13.578 ( -2.163 1.289 -5.492) 6.042 14.468 ( -10.555 -5.185 -6.349) 13.364 14.468 ( -10.555 5.185 -6.349) 13.364 14.970 ( -6.363 -2.339 -3.154) 7.477 14.970 ( -6.363 2.339 -3.154) 7.477 15.358 ( -5.717 -5.266 23.623) 24.869 15.358 ( -5.717 5.266 23.623) 24.869 15.867 ( 9.300 -4.829 -3.260) 10.974 15.867 ( 9.300 4.829 -3.260) 10.974 16.120 ( -2.201 -6.219 3.363) 7.405 16.120 ( -2.201 6.219 3.363) 7.405 16.505 ( 1.994 -7.772 1.556) 8.173 16.505 ( 1.994 7.772 1.556) 8.173 16.967 ( 7.203 -5.282 -3.240) 9.502 16.967 ( 7.203 5.282 -3.240) 9.502 18.867 ( -2.711 -2.591 1.075) 3.901 18.867 ( -2.711 2.591 1.075) 3.901 19.581 ( -0.785 -3.001 8.459) 9.010 19.581 ( -0.785 3.001 8.459) 9.010 22.107 ( 5.144 -2.521 -23.891) 24.569 22.107 ( 5.144 2.521 -23.891) 24.569 22.383 ( 5.087 -2.672 -21.031) 21.802 22.383 ( 5.087 2.672 -21.031) 21.802 25.266 ( -4.470 -0.689 6.810) 8.175 25.266 ( -4.470 0.689 6.810) 8.175 25.634 ( -1.033 -1.395 3.009) 3.474 25.634 ( -1.033 1.395 3.009) 3.474 25.783 ( 8.188 -1.078 2.606) 8.660 25.783 ( 8.188 1.078 2.606) 8.660 27.593 ( 2.500 -8.953 -16.687) 19.101 27.593 ( 2.500 8.953 -16.687) 19.101 28.712 ( -1.207 -7.132 -1.332) 7.356 28.712 ( -1.207 7.132 -1.332) 7.356 28.934 ( 0.656 -0.946 -5.607) 5.724 28.934 ( 0.656 0.946 -5.607) 5.724 29.555 ( 3.551 -2.596 3.687) 5.740 29.555 ( 3.551 2.596 3.687) 5.740 30.253 ( -9.400 -1.581 15.690) 18.358 30.253 ( -9.400 1.581 15.690) 18.358 30.616 ( 1.389 -1.978 18.550) 18.706 30.616 ( 1.389 1.978 18.550) 18.706 31.064 ( 1.318 -6.660 8.652) 10.998 31.064 ( 1.318 6.660 8.652) 10.998 31.644 ( -0.129 -1.638 7.289) 7.472 31.644 ( -0.129 1.638 7.289) 7.472 33.008 ( -2.920 -7.166 -24.044) 25.259 33.008 ( -2.920 7.166 -24.044) 25.259 ======================= Grid point 87 (49/104) ======================= q-point: ( 0.20 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.795 ( 4.988 -22.341 8.645) 24.469 2.795 ( 4.988 22.341 8.645) 24.469 3.056 ( 3.394 -6.529 6.461) 9.793 3.056 ( 3.394 6.529 6.461) 9.793 3.452 ( 5.723 -14.827 10.220) 18.896 3.452 ( 5.723 14.827 10.220) 18.896 3.906 ( -7.024 -7.895 10.521) 14.911 3.906 ( -7.024 7.895 10.521) 14.911 4.340 ( -11.897 -7.363 15.990) 21.247 4.340 ( -11.897 7.364 15.990) 21.247 4.387 ( -6.632 -6.629 46.182) 47.124 4.387 ( -6.632 6.629 46.182) 47.124 4.911 ( -7.132 -15.545 3.646) 17.487 4.911 ( -7.132 15.545 3.646) 17.487 5.563 ( 1.480 -5.807 7.964) 9.967 5.563 ( 1.480 5.807 7.964) 9.967 5.676 ( 1.627 -0.459 16.583) 16.669 5.676 ( 1.627 0.459 16.583) 16.669 5.822 ( -11.627 -3.588 11.708) 16.886 5.822 ( -11.627 3.588 11.708) 16.886 6.148 ( 8.499 -7.890 10.230) 15.464 6.148 ( 8.499 7.890 10.230) 15.464 6.671 ( 2.823 -9.087 11.982) 15.300 6.671 ( 2.823 9.087 11.982) 15.300 6.926 ( -1.488 -8.135 -7.289) 11.023 6.926 ( -1.488 8.135 -7.289) 11.023 7.190 ( -0.435 -2.277 10.940) 11.183 7.190 ( -0.435 2.277 10.940) 11.183 7.643 ( -2.154 -3.904 -4.319) 6.208 7.643 ( -2.154 3.904 -4.319) 6.208 7.776 ( 1.921 -5.443 1.147) 5.885 7.776 ( 1.921 5.443 1.147) 5.885 7.935 ( -0.201 -2.978 -8.517) 9.025 7.935 ( -0.201 2.978 -8.517) 9.025 8.396 ( 3.183 -7.751 -0.492) 8.393 8.396 ( 3.183 7.751 -0.492) 8.393 8.589 ( -0.868 -13.058 -9.088) 15.933 8.589 ( -0.868 13.058 -9.088) 15.933 8.712 ( -2.042 -3.737 -6.348) 7.644 8.712 ( -2.042 3.737 -6.348) 7.644 8.864 ( 1.527 -5.424 -7.715) 9.553 8.864 ( 1.527 5.424 -7.715) 9.553 9.206 ( 1.213 -1.595 -5.817) 6.152 9.206 ( 1.213 1.595 -5.817) 6.152 9.421 ( 5.752 -3.799 -3.873) 7.907 9.421 ( 5.752 3.799 -3.873) 7.907 9.578 ( 4.095 -1.723 0.208) 4.447 9.578 ( 4.095 1.723 0.208) 4.447 9.883 ( 6.033 -3.179 -7.056) 9.812 9.883 ( 6.033 3.179 -7.056) 9.812 10.396 ( -9.675 -5.979 -3.692) 11.958 10.396 ( -9.675 5.979 -3.692) 11.958 10.427 ( -3.625 -2.462 4.212) 6.078 10.427 ( -3.625 2.462 4.212) 6.078 10.630 ( 2.840 -0.749 -0.960) 3.090 10.630 ( 2.840 0.749 -0.960) 3.090 10.845 ( -1.160 -1.614 -1.467) 2.470 10.845 ( -1.160 1.614 -1.467) 2.470 11.396 ( 1.763 -2.904 -5.944) 6.846 11.396 ( 1.763 2.904 -5.944) 6.846 11.615 ( -1.083 -7.084 -4.923) 8.695 11.615 ( -1.083 7.084 -4.923) 8.695 11.927 ( -0.583 -6.081 0.535) 6.132 11.927 ( -0.583 6.081 0.535) 6.132 12.211 ( 0.907 -4.068 3.029) 5.152 12.211 ( 0.907 4.068 3.029) 5.152 12.791 ( -8.482 -9.175 13.943) 18.722 12.791 ( -8.482 9.175 13.943) 18.722 13.100 ( 0.368 -4.261 -8.082) 9.144 13.100 ( 0.368 4.261 -8.082) 9.144 13.391 ( 1.130 -8.149 -9.298) 12.415 13.391 ( 1.130 8.149 -9.298) 12.415 13.647 ( 5.231 -1.048 7.589) 9.276 13.647 ( 5.231 1.048 7.589) 9.276 14.267 ( -6.024 -8.970 0.956) 10.847 14.267 ( -6.024 8.970 0.956) 10.847 14.820 ( -4.525 -3.801 -2.812) 6.544 14.820 ( -4.525 3.801 -2.812) 6.544 15.366 ( -2.884 -4.274 21.511) 22.120 15.366 ( -2.884 4.274 21.511) 22.120 15.853 ( -9.689 -2.940 -1.215) 10.198 15.853 ( -9.689 2.940 -1.215) 10.198 16.152 ( 7.456 -0.266 -4.091) 8.508 16.152 ( 7.456 0.266 -4.091) 8.508 16.610 ( 1.881 -7.504 10.762) 13.254 16.610 ( 1.881 7.504 10.762) 13.254 17.014 ( 0.665 -5.398 -13.546) 14.597 17.014 ( 0.665 5.398 -13.546) 14.597 18.734 ( -8.871 -4.916 6.490) 12.041 18.734 ( -8.871 4.916 6.490) 12.041 19.648 ( 3.170 -2.808 4.186) 5.954 19.648 ( 3.170 2.808 4.186) 5.954 22.096 ( 4.259 -2.780 -24.016) 24.549 22.096 ( 4.259 2.780 -24.016) 24.549 22.391 ( 4.525 -3.233 -20.826) 21.556 22.391 ( 4.525 3.233 -20.826) 21.556 25.191 ( -3.597 -1.826 5.808) 7.071 25.191 ( -3.597 1.826 5.808) 7.071 25.657 ( -1.481 -1.199 10.902) 11.068 25.657 ( -1.481 1.199 10.902) 11.068 26.177 ( 26.501 -4.614 -7.554) 27.940 26.177 ( 26.501 4.614 -7.554) 27.940 27.482 ( -5.752 -9.197 -17.221) 20.353 27.482 ( -5.752 9.197 -17.221) 20.353 28.653 ( -2.362 -4.194 -2.424) 5.389 28.653 ( -2.362 4.194 -2.424) 5.389 28.938 ( 1.000 -1.514 -2.526) 3.110 28.938 ( 1.000 1.514 -2.526) 3.110 29.681 ( 5.050 -7.150 3.539) 9.441 29.681 ( 5.050 7.150 3.539) 9.441 30.146 ( -5.825 -1.055 12.047) 13.423 30.146 ( -5.825 1.055 12.047) 13.423 30.730 ( -0.082 -1.992 20.007) 20.106 30.730 ( -0.082 1.992 20.007) 20.106 31.152 ( 1.771 -6.707 12.463) 14.263 31.152 ( 1.771 6.707 12.463) 14.263 31.705 ( 2.999 -2.142 7.444) 8.306 31.705 ( 2.999 2.142 7.444) 8.306 32.707 ( -12.141 -3.309 -24.702) 27.722 32.707 ( -12.141 3.309 -24.702) 27.722 ======================= Grid point 89 (50/104) ======================= q-point: ( 0.40 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.951 ( 4.332 -17.336 9.379) 20.181 2.951 ( 4.332 17.336 9.379) 20.181 3.149 ( 3.010 -18.547 3.694) 19.149 3.149 ( 3.010 18.547 3.694) 19.149 3.652 ( -4.108 -7.384 11.286) 14.098 3.652 ( -4.108 7.384 11.286) 14.098 3.835 ( 3.740 -12.243 17.629) 21.787 3.835 ( 3.740 12.243 17.629) 21.787 4.103 ( -9.119 -7.627 -1.335) 11.963 4.103 ( -9.119 7.627 -1.336) 11.963 4.562 ( 1.262 -9.163 43.268) 44.246 4.562 ( 1.262 9.163 43.268) 44.246 4.806 ( -5.424 -12.769 13.149) 19.114 4.806 ( -5.424 12.769 13.149) 19.114 5.415 ( -18.598 -7.895 20.900) 29.070 5.415 ( -18.598 7.895 20.900) 29.070 5.648 ( -4.632 -3.489 10.101) 11.647 5.648 ( -4.632 3.489 10.101) 11.647 5.800 ( 1.049 -4.638 6.807) 8.304 5.800 ( 1.049 4.638 6.807) 8.304 6.438 ( 10.632 -8.007 4.472) 14.041 6.438 ( 10.632 8.007 4.472) 14.041 6.738 ( -0.921 -5.398 9.346) 10.832 6.738 ( -0.921 5.398 9.346) 10.832 6.923 ( -5.252 -17.225 5.822) 18.925 6.923 ( -5.252 17.225 5.822) 18.925 7.122 ( -1.243 -6.007 3.532) 7.078 7.122 ( -1.243 6.007 3.532) 7.078 7.605 ( -1.478 -9.864 0.710) 10.000 7.605 ( -1.478 9.864 0.710) 10.000 7.850 ( 0.434 -5.668 2.461) 6.195 7.850 ( 0.434 5.668 2.461) 6.195 7.940 ( 8.136 -4.672 -10.620) 14.171 7.940 ( 8.136 4.672 -10.620) 14.171 8.388 ( -2.838 -4.523 3.294) 6.274 8.388 ( -2.838 4.523 3.294) 6.274 8.494 ( -3.940 -11.472 -9.314) 15.293 8.494 ( -3.940 11.472 -9.314) 15.293 8.684 ( 0.152 -3.382 -2.431) 4.168 8.684 ( 0.152 3.382 -2.431) 4.168 8.897 ( 5.983 -8.918 -12.356) 16.371 8.897 ( 5.983 8.918 -12.356) 16.371 9.185 ( -0.489 -1.282 -6.339) 6.486 9.185 ( -0.489 1.282 -6.339) 6.486 9.481 ( -0.178 -0.549 -4.367) 4.405 9.481 ( -0.178 0.549 -4.367) 4.405 9.570 ( -3.453 -6.455 0.807) 7.364 9.570 ( -3.453 6.455 0.807) 7.364 9.977 ( 2.031 -4.291 -13.842) 14.634 9.977 ( 2.031 4.291 -13.842) 14.634 10.255 ( 1.730 -3.630 -2.993) 5.012 10.255 ( 1.730 3.630 -2.993) 5.012 10.454 ( 4.633 -6.019 5.821) 9.570 10.454 ( 4.633 6.019 5.821) 9.570 10.685 ( 3.997 -1.742 -6.659) 7.959 10.685 ( 3.997 1.742 -6.659) 7.959 10.811 ( -1.842 -3.391 1.953) 4.325 10.811 ( -1.842 3.391 1.953) 4.325 11.347 ( -3.438 -4.541 -6.530) 8.665 11.347 ( -3.438 4.541 -6.530) 8.665 11.547 ( -1.792 -2.814 -0.470) 3.369 11.547 ( -1.792 2.814 -0.470) 3.369 11.969 ( 3.249 -5.232 1.134) 6.262 11.969 ( 3.249 5.232 1.134) 6.262 12.196 ( -4.297 -1.104 1.963) 4.851 12.196 ( -4.297 1.104 1.963) 4.851 12.640 ( -7.704 -6.902 9.693) 14.175 12.640 ( -7.704 6.902 9.693) 14.175 13.112 ( 3.076 -6.303 -5.934) 9.187 13.112 ( 3.076 6.303 -5.934) 9.187 13.425 ( 3.813 -6.543 -5.944) 9.627 13.425 ( 3.813 6.543 -5.944) 9.627 13.783 ( 3.702 -2.605 0.893) 4.614 13.783 ( 3.702 2.605 0.893) 4.614 14.280 ( 5.200 -6.565 15.256) 17.404 14.280 ( 5.200 6.565 15.256) 17.404 14.790 ( 3.404 -3.536 -4.657) 6.766 14.790 ( 3.404 3.536 -4.657) 6.766 15.385 ( -6.171 -8.330 16.334) 19.346 15.385 ( -6.171 8.330 16.334) 19.346 15.670 ( -4.556 -3.283 5.426) 7.809 15.670 ( -4.556 3.283 5.426) 7.809 16.271 ( 4.812 -2.775 -5.675) 7.941 16.271 ( 4.812 2.775 -5.675) 7.941 16.596 ( -7.426 -6.283 5.872) 11.362 16.596 ( -7.426 6.283 5.872) 11.362 16.923 ( -1.986 -0.836 -11.796) 11.992 16.923 ( -1.986 0.836 -11.796) 11.992 18.623 ( -3.808 -11.918 7.922) 14.808 18.623 ( -3.808 11.918 7.922) 14.808 19.716 ( 1.373 -1.610 1.404) 2.539 19.716 ( 1.373 1.610 1.404) 2.539 22.079 ( 4.573 -1.885 -24.101) 24.603 22.079 ( 4.573 1.885 -24.101) 24.603 22.386 ( 4.036 -2.674 -21.178) 21.724 22.386 ( 4.036 2.674 -21.178) 21.724 25.172 ( -1.449 -2.232 8.029) 8.459 25.172 ( -1.449 2.232 8.029) 8.459 25.668 ( -1.961 -1.492 10.665) 10.946 25.668 ( -1.961 1.492 10.665) 10.946 26.668 ( 19.049 -8.560 -16.231) 26.449 26.668 ( 19.049 8.560 -16.231) 26.449 27.217 ( -8.490 -9.683 -15.583) 20.215 27.217 ( -8.490 9.683 -15.583) 20.215 28.623 ( 0.333 -1.494 -0.367) 1.574 28.623 ( 0.333 1.494 -0.367) 1.574 28.941 ( 0.498 -2.288 -2.810) 3.657 28.941 ( 0.498 2.288 -2.810) 3.657 29.736 ( -2.261 -5.767 4.444) 7.623 29.736 ( -2.261 5.767 4.444) 7.623 30.141 ( 0.620 -3.551 11.012) 11.587 30.141 ( 0.620 3.551 11.012) 11.587 30.778 ( -3.256 -1.484 17.086) 17.457 30.778 ( -3.256 1.484 17.086) 17.457 31.198 ( -4.797 -2.415 16.140) 17.010 31.198 ( -4.797 2.415 16.140) 17.010 31.780 ( -2.461 -2.284 5.792) 6.695 31.780 ( -2.461 2.284 5.792) 6.695 32.457 ( 4.413 -0.731 -21.807) 22.261 32.457 ( 4.413 0.731 -21.807) 22.261 ======================= Grid point 91 (51/104) ======================= q-point: (-0.40 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.014 ( -1.125 -19.289 2.615) 19.498 3.014 ( -1.125 19.289 2.615) 19.498 3.175 ( -8.776 -20.961 14.602) 27.011 3.175 ( -8.776 20.961 14.602) 27.011 3.482 ( -6.480 -15.296 10.682) 19.750 3.482 ( -6.480 15.296 10.682) 19.750 3.883 ( -2.503 -5.461 -6.369) 8.755 3.883 ( -2.503 5.461 -6.369) 8.755 4.200 ( 9.747 -9.552 16.049) 21.067 4.200 ( 9.747 9.552 16.049) 21.067 4.725 ( -9.452 -5.484 40.563) 42.009 4.725 ( -9.452 5.484 40.563) 42.009 4.788 ( -4.661 -3.964 31.081) 31.677 4.788 ( -4.661 3.964 31.081) 31.677 5.270 ( -0.690 -3.968 17.559) 18.015 5.270 ( -0.690 3.968 17.559) 18.015 5.519 ( -6.550 -1.840 0.778) 6.848 5.519 ( -6.550 1.840 0.778) 6.848 5.850 ( -0.318 -6.986 7.936) 10.578 5.850 ( -0.318 6.986 7.936) 10.578 6.428 ( -17.394 -18.923 10.495) 27.763 6.428 ( -17.394 18.923 10.495) 27.763 6.728 ( -0.690 -8.026 6.579) 10.401 6.728 ( -0.690 8.026 6.579) 10.401 6.844 ( 3.404 -7.693 -2.774) 8.858 6.844 ( 3.404 7.693 -2.774) 8.858 7.258 ( 3.937 -6.726 13.655) 15.723 7.258 ( 3.937 6.726 13.655) 15.723 7.594 ( 0.512 -12.432 0.284) 12.445 7.594 ( 0.512 12.432 0.284) 12.445 7.823 ( -0.216 -3.593 -9.409) 10.074 7.823 ( -0.216 3.593 -9.409) 10.074 8.022 ( 0.158 -1.640 -4.895) 5.165 8.022 ( 0.158 1.640 -4.895) 5.165 8.340 ( -5.402 -4.651 -5.651) 9.096 8.340 ( -5.402 4.651 -5.651) 9.096 8.473 ( 10.401 -1.668 -2.446) 10.814 8.473 ( 10.401 1.668 -2.446) 10.814 8.658 ( -1.120 -4.568 -2.019) 5.119 8.658 ( -1.120 4.568 -2.019) 5.119 8.958 ( 2.852 -7.905 -10.057) 13.107 8.958 ( 2.852 7.905 -10.057) 13.107 9.142 ( -0.563 -4.986 -4.626) 6.825 9.142 ( -0.563 4.986 -4.626) 6.825 9.399 ( -1.617 -4.925 -3.307) 6.149 9.399 ( -1.617 4.925 -3.307) 6.149 9.557 ( 0.992 -2.952 -5.277) 6.127 9.557 ( 0.992 2.952 -5.277) 6.127 9.808 ( -7.590 -8.040 -10.937) 15.552 9.808 ( -7.590 8.040 -10.937) 15.552 10.352 ( 4.332 -4.566 -0.831) 6.348 10.352 ( 4.332 4.566 -0.831) 6.348 10.606 ( 5.140 -6.047 -0.330) 7.944 10.606 ( 5.140 6.047 -0.330) 7.944 10.756 ( 0.063 -4.207 0.345) 4.222 10.756 ( 0.063 4.207 0.345) 4.222 10.814 ( 5.826 -6.223 -2.531) 8.892 10.814 ( 5.826 6.223 -2.531) 8.892 11.294 ( 1.897 -0.897 -5.908) 6.269 11.294 ( 1.897 0.897 -5.908) 6.269 11.544 ( 1.668 -2.554 0.743) 3.140 11.544 ( 1.668 2.554 0.743) 3.140 11.926 ( -9.331 -1.185 5.903) 11.105 11.926 ( -9.331 1.185 5.903) 11.105 12.142 ( 0.069 -3.520 2.304) 4.208 12.142 ( 0.069 3.520 2.304) 4.208 12.611 ( 2.591 -5.933 -1.251) 6.594 12.611 ( 2.591 5.933 -1.251) 6.594 13.161 ( 2.650 -7.562 -0.389) 8.022 13.161 ( 2.650 7.562 -0.389) 8.022 13.464 ( 1.007 -4.930 -0.787) 5.093 13.464 ( 1.007 4.930 -0.787) 5.093 13.799 ( -0.425 -0.418 -5.880) 5.910 13.799 ( -0.425 0.418 -5.880) 5.910 14.581 ( 11.706 -7.723 19.176) 23.757 14.581 ( 11.706 7.723 19.176) 23.757 14.907 ( 8.753 -3.976 -3.153) 10.118 14.907 ( 8.753 3.976 -3.153) 10.118 15.235 ( -9.193 -6.194 5.863) 12.540 15.235 ( -9.193 6.194 5.863) 12.540 15.740 ( 4.134 -8.634 13.924) 16.897 15.740 ( 4.134 8.634 13.924) 16.897 16.198 ( -11.914 -12.702 -1.356) 17.468 16.198 ( -11.914 12.702 -1.356) 17.468 16.508 ( 4.142 -6.126 -8.006) 10.898 16.508 ( 4.142 6.126 -8.006) 10.898 16.833 ( -4.175 -4.559 -0.848) 6.240 16.833 ( -4.175 4.559 -0.848) 6.240 18.653 ( 3.620 -14.868 5.461) 16.248 18.653 ( 3.620 14.868 5.461) 16.248 19.706 ( -3.041 -0.519 2.396) 3.906 19.706 ( -3.041 0.519 2.396) 3.906 22.076 ( 5.502 -0.375 -24.037) 24.662 22.076 ( 5.502 0.375 -24.037) 24.662 22.375 ( 4.205 -1.312 -21.597) 22.041 22.375 ( 4.205 1.312 -21.597) 22.041 25.194 ( -0.456 -1.749 10.092) 10.252 25.194 ( -0.456 1.749 10.092) 10.252 25.675 ( -1.633 -0.957 9.331) 9.521 25.675 ( -1.633 0.957 9.331) 9.521 26.491 ( -21.625 -8.221 -17.814) 29.199 26.491 ( -21.625 8.221 -17.814) 29.199 27.299 ( 16.481 -9.268 -14.980) 24.122 27.299 ( 16.481 9.268 -14.980) 24.122 28.654 ( 1.871 -1.373 1.646) 2.845 28.654 ( 1.871 1.373 1.646) 2.845 28.941 ( 1.317 -3.300 -5.172) 6.275 28.941 ( 1.317 3.300 -5.172) 6.275 29.650 ( -6.535 -4.039 3.917) 8.623 29.650 ( -6.535 4.039 3.917) 8.623 30.239 ( 2.132 -3.753 14.639) 15.263 30.239 ( 2.132 3.753 14.639) 15.263 30.737 ( -8.094 -1.639 15.154) 17.258 30.737 ( -8.094 1.639 15.154) 17.258 31.095 ( -8.698 -2.391 11.626) 14.715 31.095 ( -8.698 2.391 11.626) 14.715 31.680 ( -5.056 -2.912 3.435) 6.771 31.680 ( -5.056 2.912 3.435) 6.771 32.693 ( 20.265 -2.912 -16.124) 26.060 32.693 ( 20.265 2.912 -16.124) 26.060 ======================= Grid point 93 (52/104) ======================= q-point: (-0.20 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.885 ( -12.690 -14.703 7.528) 20.830 2.885 ( -12.690 14.703 7.528) 20.830 3.022 ( -4.809 -22.391 7.807) 24.196 3.022 ( -4.809 22.391 7.807) 24.196 3.468 ( -3.740 -10.003 9.236) 14.119 3.468 ( -3.740 10.003 9.236) 14.119 3.858 ( 1.528 -8.850 3.448) 9.620 3.858 ( 1.528 8.850 3.448) 9.620 4.411 ( -2.697 -4.169 28.229) 28.663 4.411 ( -2.697 4.169 28.229) 28.663 4.599 ( -12.033 -4.938 33.694) 36.118 4.599 ( -12.033 4.938 33.694) 36.118 4.891 ( 1.095 -5.839 26.341) 27.003 4.891 ( 1.095 5.839 26.341) 27.003 5.264 ( -5.825 -2.089 13.802) 15.125 5.264 ( -5.825 2.089 13.802) 15.125 5.586 ( 6.720 -7.381 0.289) 9.986 5.586 ( 6.720 7.381 0.289) 9.986 5.856 ( -1.931 -7.726 9.154) 12.133 5.856 ( -1.931 7.726 9.154) 12.133 6.132 ( -9.743 -13.282 10.955) 19.782 6.132 ( -9.743 13.282 10.955) 19.782 6.670 ( -6.898 -1.710 6.657) 9.738 6.670 ( -6.898 1.710 6.657) 9.738 6.959 ( 5.766 -9.849 1.057) 11.461 6.959 ( 5.766 9.849 1.057) 11.461 7.296 ( -7.856 -5.642 12.837) 16.072 7.296 ( -7.856 5.642 12.837) 16.072 7.612 ( 3.959 -9.592 -9.525) 14.086 7.612 ( 3.959 9.592 -9.525) 14.086 7.763 ( -1.108 -9.106 -5.155) 10.523 7.763 ( -1.108 9.106 -5.155) 10.523 8.016 ( 1.658 -3.291 -6.695) 7.642 8.016 ( 1.658 3.291 -6.695) 7.642 8.248 ( 0.567 -4.139 -5.300) 6.748 8.248 ( 0.567 4.139 -5.300) 6.748 8.607 ( 1.333 -4.689 -6.108) 7.815 8.607 ( 1.333 4.689 -6.108) 7.815 8.702 ( 6.120 -3.756 -3.574) 8.021 8.702 ( 6.120 3.756 -3.574) 8.021 8.942 ( 0.330 -2.626 -4.918) 5.585 8.942 ( 0.330 2.626 -4.918) 5.585 9.161 ( 4.489 -4.622 -4.204) 7.693 9.161 ( 4.489 4.622 -4.204) 7.693 9.372 ( -1.531 -6.610 -8.091) 10.559 9.372 ( -1.531 6.610 -8.091) 10.559 9.468 ( -3.265 -1.444 -6.302) 7.243 9.468 ( -3.265 1.444 -6.302) 7.243 9.747 ( 3.754 -1.175 -3.011) 4.954 9.747 ( 3.754 1.175 -3.011) 4.954 10.412 ( 1.710 -2.540 1.585) 3.448 10.412 ( 1.710 2.540 1.585) 3.448 10.647 ( -0.905 -4.985 -2.498) 5.649 10.647 ( -0.905 4.985 -2.498) 5.649 10.713 ( -1.657 -11.292 -1.533) 11.516 10.713 ( -1.657 11.292 -1.533) 11.516 10.905 ( 0.422 -5.869 0.716) 5.927 10.905 ( 0.422 5.869 0.716) 5.927 11.337 ( 3.775 -4.059 -5.560) 7.851 11.337 ( 3.775 4.059 -5.560) 7.851 11.618 ( 2.225 -1.535 0.564) 2.762 11.618 ( 2.225 1.535 0.564) 2.762 11.799 ( -0.808 -0.928 2.376) 2.676 11.799 ( -0.808 0.928 2.376) 2.676 12.152 ( -0.512 -4.027 4.296) 5.911 12.152 ( -0.512 4.027 4.296) 5.911 12.697 ( 5.942 -5.200 -4.371) 9.025 12.697 ( 5.942 5.200 -4.371) 9.025 13.212 ( 1.066 -6.508 2.504) 7.054 13.212 ( 1.066 6.508 2.504) 7.054 13.461 ( -1.603 -4.036 4.332) 6.135 13.461 ( -1.603 4.036 4.332) 6.135 13.716 ( -4.193 -3.316 -9.173) 10.617 13.716 ( -4.193 3.316 -9.173) 10.617 14.699 ( -6.698 -0.207 0.867) 6.757 14.699 ( -6.698 0.207 0.867) 6.757 15.046 ( 0.969 -3.369 -2.781) 4.475 15.046 ( 0.969 3.369 -2.781) 4.475 15.258 ( 7.760 -10.140 17.149) 21.381 15.258 ( 7.760 10.140 17.149) 21.381 15.809 ( -5.414 -6.906 3.826) 9.573 15.809 ( -5.414 6.906 3.826) 9.573 16.032 ( 2.447 -8.005 9.165) 12.412 16.032 ( 2.447 8.005 9.165) 12.412 16.557 ( 1.216 -1.924 -17.157) 17.307 16.557 ( 1.216 1.924 -17.157) 17.307 16.806 ( 3.008 -4.279 9.789) 11.099 16.806 ( 3.008 4.279 9.789) 11.099 18.798 ( 6.932 -10.408 1.626) 12.610 18.798 ( 6.932 10.408 1.626) 12.610 19.625 ( -5.605 -1.960 6.562) 8.849 19.625 ( -5.605 1.960 6.562) 8.849 22.093 ( 6.107 -1.418 -23.859) 24.669 22.093 ( 6.107 1.418 -23.859) 24.669 22.373 ( 4.799 -1.175 -21.516) 22.076 22.373 ( 4.799 1.175 -21.516) 22.076 25.244 ( 0.800 -0.574 10.286) 10.333 25.244 ( 0.800 0.574 10.286) 10.333 25.686 ( -0.984 -1.052 7.441) 7.579 25.686 ( -0.984 1.052 7.441) 7.579 25.923 ( -21.155 -2.564 -9.509) 23.336 25.923 ( -21.155 2.564 -9.509) 23.336 27.529 ( 10.613 -9.025 -16.479) 21.579 27.529 ( 10.613 9.025 -16.479) 21.579 28.701 ( 1.568 -5.277 1.517) 5.710 28.701 ( 1.568 5.277 1.517) 5.710 28.947 ( 1.579 -2.522 -7.528) 8.094 28.947 ( 1.579 2.522 -7.528) 8.094 29.542 ( -3.971 -2.603 3.834) 6.103 29.542 ( -3.971 2.603 3.834) 6.103 30.328 ( -2.867 -1.877 20.040) 20.331 30.328 ( -2.867 1.877 20.040) 20.331 30.594 ( -7.949 -1.873 12.305) 14.769 30.594 ( -7.949 1.873 12.305) 14.769 31.027 ( -1.941 -4.405 8.743) 9.980 31.027 ( -1.941 4.405 8.743) 9.980 31.634 ( -1.800 -2.773 6.019) 6.867 31.634 ( -1.800 2.773 6.019) 6.867 32.996 ( 13.161 -6.802 -19.825) 24.748 32.996 ( 13.161 6.802 -19.825) 24.748 ======================= Grid point 105 (53/104) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( 6.386 0.000 41.381) 41.871 2.594 ( 16.593 0.000 46.755) 49.612 2.603 ( 2.615 0.000 14.027) 14.269 3.559 ( 0.314 0.000 26.289) 26.291 3.721 ( -4.531 0.000 0.659) 4.579 3.784 ( -1.717 0.000 9.013) 9.175 4.004 ( 2.640 0.000 10.059) 10.400 4.155 ( -4.404 0.000 -7.619) 8.801 4.417 ( -0.345 0.000 10.281) 10.287 4.692 ( 7.662 0.000 2.676) 8.116 4.920 ( -11.172 0.000 16.819) 20.192 5.036 ( -2.543 0.000 6.708) 7.174 5.064 ( -16.319 0.000 -8.538) 18.417 5.288 ( 7.110 0.000 3.912) 8.115 5.422 ( -13.209 0.000 14.804) 19.840 5.728 ( -7.069 0.000 -2.768) 7.591 5.765 ( -7.563 0.000 25.018) 26.136 5.968 ( -9.923 0.000 38.107) 39.378 6.190 ( -5.344 0.000 33.875) 34.294 6.332 ( -7.686 0.000 -11.060) 13.468 6.375 ( -1.917 0.000 -7.027) 7.284 6.454 ( -5.320 0.000 43.514) 43.838 6.546 ( 0.434 0.000 7.581) 7.594 6.632 ( 3.317 0.000 -1.915) 3.830 6.855 ( -6.672 0.000 -7.447) 9.999 6.871 ( 5.802 0.000 -4.883) 7.583 7.024 ( -1.820 0.000 8.042) 8.246 7.126 ( 7.253 0.000 -3.916) 8.243 7.479 ( -2.397 0.000 11.052) 11.309 7.545 ( 4.026 0.000 -19.079) 19.499 7.572 ( -8.151 0.000 -2.410) 8.500 7.715 ( -3.574 0.000 8.827) 9.523 7.944 ( 0.490 0.000 0.467) 0.677 7.966 ( 9.859 0.000 -13.274) 16.535 8.125 ( 11.563 0.000 -11.709) 16.456 8.212 ( 5.044 0.000 4.768) 6.941 8.249 ( -1.375 0.000 -3.520) 3.779 8.341 ( -1.014 0.000 0.790) 1.286 8.600 ( -4.309 0.000 -10.146) 11.023 8.828 ( 3.539 0.000 -3.489) 4.969 8.866 ( 4.809 0.000 1.301) 4.982 8.884 ( -2.376 0.000 4.957) 5.497 9.179 ( -0.264 0.000 -1.575) 1.597 9.185 ( 2.632 0.000 -0.939) 2.795 9.441 ( 7.843 0.000 -2.753) 8.312 9.462 ( 1.244 0.000 -17.527) 17.571 9.668 ( 5.489 0.000 -8.219) 9.883 9.772 ( 4.407 0.000 2.140) 4.899 9.889 ( 6.454 0.000 -10.733) 12.524 9.957 ( -3.853 0.000 -6.923) 7.923 10.113 ( 1.692 0.000 -2.948) 3.399 10.273 ( 1.493 0.000 3.429) 3.740 10.372 ( -6.856 0.000 7.403) 10.090 10.383 ( -0.373 0.000 -1.008) 1.075 10.628 ( -4.008 0.000 1.790) 4.390 10.848 ( 2.075 0.000 2.151) 2.989 10.940 ( 1.600 0.000 -6.208) 6.411 11.019 ( -4.839 0.000 -1.928) 5.208 11.117 ( 0.941 0.000 0.779) 1.222 11.344 ( -1.705 0.000 -12.582) 12.697 11.602 ( -3.628 0.000 6.711) 7.629 11.740 ( -0.153 0.000 2.146) 2.152 11.876 ( 1.971 0.000 5.238) 5.596 12.086 ( -5.297 0.000 8.070) 9.653 12.202 ( -12.297 0.000 -2.377) 12.524 12.208 ( 8.342 0.000 0.142) 8.343 12.537 ( 10.181 0.000 -2.927) 10.594 12.600 ( -1.792 0.000 10.680) 10.829 12.917 ( 1.608 0.000 -13.652) 13.747 13.128 ( -4.032 0.000 -6.357) 7.528 13.393 ( -7.855 0.000 11.260) 13.729 13.581 ( 4.955 0.000 -11.753) 12.755 13.959 ( -3.677 0.000 0.746) 3.752 14.085 ( 1.937 0.000 -1.743) 2.606 14.205 ( -2.526 0.000 -6.477) 6.952 14.519 ( 2.633 0.000 -13.686) 13.937 15.004 ( -12.819 0.000 22.824) 26.178 15.036 ( 4.428 0.000 3.749) 5.802 15.178 ( 3.469 0.000 1.172) 3.662 15.727 ( -2.868 0.000 -8.187) 8.675 15.830 ( 12.879 0.000 11.010) 16.944 15.858 ( 11.054 0.000 -3.486) 11.591 16.059 ( -3.757 0.000 4.534) 5.888 16.118 ( -5.603 0.000 -6.569) 8.633 16.448 ( -1.792 0.000 5.148) 5.451 16.654 ( -2.526 0.000 -7.396) 7.815 17.012 ( 2.697 0.000 10.065) 10.420 17.284 ( -16.599 0.000 6.394) 17.788 18.841 ( -4.337 0.000 -4.216) 6.049 19.409 ( -8.604 0.000 13.126) 15.694 19.942 ( 3.237 0.000 19.518) 19.784 20.047 ( -3.898 0.000 16.902) 17.346 21.197 ( 6.108 0.000 -41.091) 41.542 21.519 ( 12.391 0.000 -32.332) 34.625 21.912 ( 1.167 0.000 -22.993) 23.022 22.024 ( 7.822 0.000 -24.655) 25.866 25.274 ( -6.068 0.000 4.885) 7.790 25.382 ( -1.956 0.000 5.222) 5.577 25.590 ( 9.363 0.000 -3.562) 10.018 25.716 ( 7.753 0.000 -8.305) 11.361 25.842 ( -3.236 0.000 13.309) 13.697 25.920 ( 2.425 0.000 15.995) 16.178 27.213 ( -4.291 0.000 -11.860) 12.612 27.396 ( 6.709 0.000 -26.470) 27.307 28.378 ( 1.133 0.000 1.581) 1.945 28.739 ( -5.065 0.000 -10.384) 11.554 28.850 ( -2.988 0.000 2.425) 3.848 28.940 ( 3.440 0.000 -2.617) 4.322 29.543 ( -12.981 0.000 3.771) 13.517 29.827 ( 22.278 0.000 -6.786) 23.289 29.899 ( 9.209 0.000 10.300) 13.816 30.547 ( -9.656 0.000 12.880) 16.097 30.730 ( -1.574 0.000 14.043) 14.131 31.159 ( 9.053 0.000 23.207) 24.910 31.240 ( 0.099 0.000 0.793) 0.799 31.363 ( -4.024 0.000 11.610) 12.287 31.818 ( -0.571 0.000 -0.479) 0.745 31.956 ( -0.595 0.000 13.931) 13.944 32.207 ( -3.332 0.000 -20.175) 20.448 32.863 ( -13.315 0.000 -6.796) 14.949 ======================= Grid point 106 (54/104) ======================= q-point: ( 0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.701 ( -0.395 0.000 14.179) 14.184 2.764 ( 4.288 0.000 29.741) 30.049 3.142 ( 12.287 0.000 32.742) 34.971 3.606 ( -4.658 0.000 5.404) 7.135 3.712 ( -13.524 0.000 11.864) 17.990 3.855 ( 10.965 0.000 23.834) 26.235 4.014 ( 0.700 0.000 -6.779) 6.815 4.078 ( 0.175 0.000 9.884) 9.886 4.377 ( -2.532 0.000 9.790) 10.112 4.401 ( -21.931 0.000 -11.518) 24.772 4.808 ( -5.839 0.000 15.073) 16.165 4.903 ( 3.586 0.000 3.069) 4.720 5.120 ( -17.728 0.000 10.078) 20.392 5.365 ( 13.327 0.000 11.644) 17.697 5.370 ( -7.200 0.000 7.857) 10.656 5.480 ( -6.757 0.000 -7.358) 9.989 5.691 ( -5.995 0.000 22.604) 23.385 5.912 ( -9.884 0.000 33.603) 35.027 6.198 ( 0.434 0.000 -6.786) 6.800 6.217 ( -4.452 0.000 29.801) 30.132 6.358 ( 3.132 0.000 -6.517) 7.231 6.399 ( -1.913 0.000 -5.729) 6.040 6.562 ( -5.291 0.000 35.265) 35.660 6.730 ( 0.621 0.000 9.164) 9.185 6.902 ( 3.648 0.000 16.616) 17.012 7.080 ( 13.244 0.000 -9.870) 16.517 7.131 ( 0.584 0.000 14.543) 14.555 7.225 ( 3.461 0.000 -8.702) 9.364 7.395 ( -5.167 0.000 -0.293) 5.176 7.556 ( 5.471 0.000 16.115) 17.018 7.575 ( 5.219 0.000 -11.778) 12.883 7.736 ( 2.379 0.000 2.783) 3.661 7.953 ( 0.031 0.000 1.212) 1.212 8.106 ( 6.583 0.000 -8.288) 10.584 8.204 ( 0.418 0.000 -5.793) 5.808 8.268 ( -4.808 0.000 11.525) 12.487 8.331 ( 10.684 0.000 -10.465) 14.955 8.382 ( 7.178 0.000 -2.940) 7.757 8.469 ( -2.372 0.000 -10.943) 11.197 8.780 ( -9.258 0.000 4.654) 10.361 8.858 ( 1.174 0.000 -7.484) 7.575 8.931 ( -2.392 0.000 -3.769) 4.464 9.147 ( -2.248 0.000 -0.136) 2.252 9.252 ( 4.351 0.000 -4.064) 5.954 9.411 ( 1.864 0.000 -17.962) 18.058 9.593 ( 8.685 0.000 -6.902) 11.093 9.730 ( -0.188 0.000 -2.382) 2.389 9.800 ( -6.574 0.000 -7.896) 10.274 9.819 ( 2.908 0.000 -6.347) 6.981 9.951 ( 5.522 0.000 -16.942) 17.819 10.112 ( 1.322 0.000 -3.115) 3.384 10.203 ( -2.648 0.000 3.297) 4.229 10.302 ( -3.907 0.000 -4.966) 6.319 10.492 ( 7.290 0.000 10.552) 12.825 10.552 ( -4.296 0.000 -1.229) 4.468 10.858 ( -5.476 0.000 5.062) 7.457 10.903 ( -2.123 0.000 -6.691) 7.020 10.947 ( 0.300 0.000 -0.413) 0.511 11.113 ( -0.900 0.000 0.507) 1.033 11.220 ( -4.011 0.000 -6.466) 7.609 11.569 ( -2.290 0.000 10.219) 10.473 11.776 ( 1.880 0.000 1.374) 2.329 11.829 ( -5.138 0.000 5.096) 7.236 11.930 ( -10.273 0.000 0.977) 10.319 12.143 ( 5.220 0.000 5.653) 7.694 12.315 ( 0.421 0.000 -2.551) 2.585 12.683 ( 4.739 0.000 8.551) 9.776 12.688 ( -0.327 0.000 -3.069) 3.086 12.938 ( 8.140 0.000 -12.406) 14.838 13.126 ( 8.966 0.000 -5.411) 10.472 13.283 ( -5.974 0.000 8.056) 10.030 13.641 ( 4.630 0.000 -8.060) 9.296 13.809 ( -9.107 0.000 0.349) 9.114 14.027 ( -7.389 0.000 -0.046) 7.390 14.188 ( 3.850 0.000 -9.272) 10.039 14.564 ( 6.779 0.000 -11.380) 13.246 15.003 ( 5.007 0.000 17.009) 17.731 15.100 ( -5.523 0.000 5.054) 7.486 15.135 ( -4.460 0.000 6.007) 7.481 15.710 ( -10.945 0.000 -5.427) 12.217 15.757 ( 10.803 0.000 -13.430) 17.236 15.987 ( -3.606 0.000 -4.567) 5.819 16.044 ( -0.441 0.000 12.035) 12.043 16.327 ( 9.828 0.000 2.615) 10.170 16.448 ( -0.343 0.000 3.306) 3.324 16.517 ( -3.995 0.000 11.546) 12.218 16.856 ( -24.481 0.000 13.969) 28.186 17.041 ( -3.945 0.000 9.009) 9.835 18.708 ( -7.397 0.000 3.090) 8.016 19.284 ( -5.220 0.000 4.127) 6.654 19.957 ( -5.250 0.000 15.302) 16.178 20.043 ( -4.704 0.000 18.757) 19.338 21.170 ( 9.091 0.000 -42.136) 43.106 21.627 ( 10.991 0.000 -29.542) 31.521 21.798 ( -1.479 0.000 -25.292) 25.335 22.065 ( 6.132 0.000 -23.673) 24.454 25.200 ( -2.364 0.000 4.565) 5.141 25.394 ( 0.598 0.000 5.864) 5.894 25.833 ( -3.108 0.000 12.495) 12.876 25.870 ( 16.815 0.000 -9.244) 19.188 26.025 ( -0.679 0.000 17.763) 17.776 26.111 ( 28.604 0.000 -14.059) 31.872 26.986 ( -10.114 0.000 -14.186) 17.423 27.358 ( 0.913 0.000 -26.316) 26.332 28.454 ( 4.999 0.000 2.617) 5.642 28.648 ( 0.340 0.000 -8.268) 8.275 28.766 ( -5.479 0.000 1.429) 5.663 28.984 ( 1.507 0.000 -1.921) 2.442 29.336 ( -6.599 0.000 -0.056) 6.599 30.095 ( 3.772 0.000 12.869) 13.411 30.238 ( 14.382 0.000 0.248) 14.384 30.355 ( -11.189 0.000 6.044) 12.717 30.959 ( 17.084 0.000 7.259) 18.562 31.228 ( -1.291 0.000 0.539) 1.399 31.334 ( -2.907 0.000 9.354) 9.795 31.462 ( 6.151 0.000 22.879) 23.692 31.809 ( -0.246 0.000 0.125) 0.276 31.988 ( -4.860 0.000 -17.916) 18.563 31.993 ( -2.601 0.000 15.604) 15.820 32.404 ( -25.504 0.000 -0.203) 25.504 ======================= Grid point 107 (55/104) ======================= q-point: (-0.60 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.660 ( -9.587 0.000 13.814) 16.815 2.759 ( -11.196 0.000 8.260) 13.913 3.170 ( -24.996 0.000 9.687) 26.807 3.507 ( -0.890 0.000 14.453) 14.481 3.664 ( 3.255 0.000 17.695) 17.992 3.906 ( -2.980 0.000 7.796) 8.346 3.921 ( -13.204 0.000 -10.080) 16.612 4.141 ( 4.519 0.000 1.108) 4.653 4.162 ( 0.502 0.000 11.488) 11.499 4.608 ( 5.178 0.000 11.167) 12.309 4.815 ( -15.205 0.000 14.490) 21.004 4.878 ( 6.882 0.000 27.479) 28.328 5.101 ( -6.835 0.000 -7.422) 10.090 5.111 ( 10.982 0.000 9.487) 14.512 5.209 ( -3.831 0.000 -9.874) 10.591 5.782 ( -2.341 0.000 30.705) 30.794 5.789 ( 10.723 0.000 9.792) 14.521 5.867 ( -8.363 0.000 35.753) 36.718 6.250 ( 6.899 0.000 -10.025) 12.169 6.327 ( 2.731 0.000 25.681) 25.826 6.385 ( 2.297 0.000 -14.746) 14.924 6.462 ( 9.309 0.000 -7.992) 12.270 6.562 ( -10.206 0.000 39.734) 41.024 6.739 ( -6.767 0.000 25.282) 26.172 6.876 ( -17.980 0.000 46.799) 50.134 7.102 ( -8.777 0.000 -4.023) 9.655 7.171 ( 0.624 0.000 -7.629) 7.655 7.259 ( 8.574 0.000 -3.282) 9.181 7.542 ( 14.561 0.000 -10.021) 17.676 7.655 ( 6.045 0.000 -8.344) 10.304 7.739 ( 3.356 0.000 7.810) 8.501 7.813 ( 3.115 0.000 4.141) 5.182 7.952 ( -2.662 0.000 3.689) 4.549 8.060 ( -5.461 0.000 -13.252) 14.333 8.202 ( -3.442 0.000 6.173) 7.068 8.223 ( 1.388 0.000 0.474) 1.467 8.361 ( -4.647 0.000 -7.043) 8.438 8.547 ( 8.186 0.000 -6.144) 10.235 8.557 ( 5.856 0.000 2.535) 6.381 8.600 ( -1.812 0.000 0.492) 1.878 8.742 ( -6.770 0.000 -7.724) 10.271 8.840 ( 1.853 0.000 -8.931) 9.121 9.122 ( 1.447 0.000 -5.463) 5.652 9.322 ( 3.548 0.000 -6.645) 7.533 9.393 ( 3.559 0.000 -14.010) 14.455 9.474 ( -11.537 0.000 -5.073) 12.603 9.583 ( -10.562 0.000 1.765) 10.708 9.789 ( 1.892 0.000 -10.860) 11.023 9.878 ( 5.529 0.000 -9.902) 11.341 9.940 ( -3.096 0.000 -15.979) 16.276 10.067 ( -0.904 0.000 -6.135) 6.201 10.185 ( -2.922 0.000 -2.783) 4.035 10.307 ( 3.151 0.000 -9.488) 9.997 10.507 ( 6.489 0.000 -7.030) 9.567 10.666 ( 1.081 0.000 13.229) 13.273 10.759 ( 1.282 0.000 7.262) 7.374 10.921 ( 6.100 0.000 -6.175) 8.680 10.923 ( -3.106 0.000 3.160) 4.431 11.102 ( -0.576 0.000 -4.849) 4.883 11.156 ( 0.574 0.000 1.330) 1.448 11.544 ( -4.385 0.000 14.603) 15.247 11.750 ( -8.347 0.000 7.124) 10.974 11.817 ( 1.953 0.000 -1.341) 2.370 11.897 ( 9.510 0.000 -2.680) 9.880 12.175 ( -11.141 0.000 1.714) 11.272 12.280 ( 4.521 0.000 3.925) 5.986 12.654 ( 0.344 0.000 -5.130) 5.141 12.881 ( 9.191 0.000 11.090) 14.404 12.990 ( 1.389 0.000 -9.431) 9.533 13.216 ( -3.200 0.000 6.114) 6.901 13.423 ( 17.239 0.000 -7.245) 18.700 13.603 ( -8.996 0.000 -2.404) 9.312 13.694 ( 1.608 0.000 -3.190) 3.573 13.836 ( -6.928 0.000 -1.726) 7.140 14.295 ( 9.403 0.000 -8.979) 13.002 14.677 ( 8.065 0.000 -10.722) 13.416 14.874 ( -10.141 0.000 -5.623) 11.596 15.087 ( -5.874 0.000 5.816) 8.266 15.316 ( 16.507 0.000 7.705) 18.217 15.360 ( -18.157 0.000 -1.824) 18.249 15.910 ( 1.026 0.000 -3.518) 3.664 16.025 ( 12.818 0.000 -2.289) 13.021 16.075 ( -5.521 0.000 9.029) 10.583 16.171 ( -13.727 0.000 14.151) 19.715 16.437 ( -9.232 0.000 9.493) 13.242 16.457 ( -0.329 0.000 3.836) 3.850 16.871 ( 12.678 0.000 22.007) 25.398 16.939 ( -8.412 0.000 6.796) 10.814 18.584 ( -6.638 0.000 12.677) 14.310 19.213 ( -2.475 0.000 -2.842) 3.769 19.901 ( -5.656 0.000 11.211) 12.557 20.045 ( -3.478 0.000 20.730) 21.019 21.199 ( 11.434 0.000 -41.597) 43.140 21.626 ( -2.428 0.000 -29.374) 29.474 21.726 ( 10.509 0.000 -28.380) 30.263 22.070 ( 4.332 0.000 -22.819) 23.227 25.222 ( 1.757 0.000 7.002) 7.219 25.440 ( -0.098 0.000 9.246) 9.246 25.826 ( -2.469 0.000 10.653) 10.936 26.030 ( -6.081 0.000 15.752) 16.885 26.160 ( 9.868 0.000 -12.924) 16.260 26.526 ( 11.851 0.000 -20.262) 23.473 26.766 ( 2.133 0.000 -15.198) 15.347 27.222 ( -0.878 0.000 -24.191) 24.206 28.589 ( 2.383 0.000 2.972) 3.810 28.655 ( -1.935 0.000 2.742) 3.356 28.663 ( 3.884 0.000 -6.235) 7.346 28.992 ( 0.382 0.000 -1.905) 1.943 29.277 ( 1.552 0.000 -1.818) 2.390 30.118 ( -12.532 0.000 -2.436) 12.767 30.160 ( -3.694 0.000 13.607) 14.099 30.452 ( 5.093 0.000 10.591) 11.752 31.204 ( -0.920 0.000 0.574) 1.084 31.213 ( -8.393 0.000 -5.250) 9.899 31.331 ( -1.157 0.000 8.792) 8.868 31.527 ( 2.340 0.000 14.242) 14.433 31.808 ( 0.102 0.000 0.378) 0.392 31.868 ( -11.628 0.000 -9.187) 14.820 31.983 ( -4.726 0.000 15.110) 15.832 32.171 ( 16.216 0.000 10.027) 19.066 ======================= Grid point 108 (56/104) ======================= q-point: (-0.40 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( -18.003 0.000 22.237) 28.611 2.563 ( -7.121 0.000 5.519) 9.009 2.598 ( -29.574 0.000 20.368) 35.910 3.554 ( 1.278 0.000 1.285) 1.813 3.730 ( -1.528 0.000 -5.510) 5.718 3.798 ( 1.945 0.000 13.543) 13.682 3.860 ( -6.846 0.000 12.310) 14.085 4.229 ( 3.346 0.000 -2.472) 4.160 4.262 ( 3.324 0.000 12.915) 13.336 4.515 ( -15.945 0.000 20.756) 26.173 4.789 ( 4.595 0.000 19.080) 19.626 4.880 ( 3.706 0.000 -4.900) 6.144 5.129 ( 0.439 0.000 -3.998) 4.022 5.382 ( 11.126 0.000 16.897) 20.231 5.447 ( 12.260 0.000 6.811) 14.025 5.747 ( -9.617 0.000 30.411) 31.895 5.876 ( -4.632 0.000 0.765) 4.695 5.980 ( 1.184 0.000 31.925) 31.947 6.335 ( -6.478 0.000 19.990) 21.014 6.355 ( 6.952 0.000 -15.102) 16.625 6.373 ( -15.090 0.000 40.489) 43.210 6.607 ( -3.115 0.000 19.099) 19.352 6.654 ( 9.732 0.000 -3.990) 10.518 6.660 ( -9.179 0.000 21.194) 23.096 6.719 ( -6.667 0.000 25.790) 26.638 6.905 ( -6.717 0.000 -4.626) 8.156 7.104 ( -5.246 0.000 -0.960) 5.334 7.407 ( 6.226 0.000 -4.054) 7.429 7.682 ( 2.904 0.000 -17.682) 17.919 7.730 ( 5.607 0.000 -14.769) 15.798 7.756 ( -7.329 0.000 3.562) 8.149 7.847 ( -5.534 0.000 18.847) 19.643 7.897 ( -0.916 0.000 -11.568) 11.605 7.904 ( 3.251 0.000 -3.326) 4.651 8.064 ( -13.219 0.000 -3.605) 13.701 8.120 ( -6.785 0.000 -2.540) 7.245 8.310 ( 1.693 0.000 0.377) 1.735 8.467 ( -4.866 0.000 -3.159) 5.801 8.601 ( 5.442 0.000 -4.411) 7.005 8.743 ( 4.626 0.000 -1.222) 4.784 8.829 ( 5.240 0.000 1.999) 5.609 8.899 ( 4.190 0.000 -4.067) 5.839 9.116 ( 2.199 0.000 -11.773) 11.977 9.240 ( -6.711 0.000 -0.325) 6.719 9.364 ( 2.229 0.000 7.880) 8.189 9.440 ( 5.424 0.000 -9.513) 10.951 9.523 ( 6.730 0.000 -6.143) 9.112 9.573 ( -12.948 0.000 -12.758) 18.177 9.731 ( -6.875 0.000 -9.212) 11.495 9.951 ( 4.893 0.000 -8.070) 9.437 10.056 ( 2.295 0.000 -14.240) 14.424 10.118 ( 1.156 0.000 -3.257) 3.457 10.289 ( 1.182 0.000 -4.109) 4.275 10.696 ( -3.956 0.000 10.399) 11.126 10.712 ( 11.487 0.000 -9.919) 15.177 10.865 ( -3.079 0.000 3.596) 4.734 10.876 ( 2.781 0.000 2.282) 3.598 11.033 ( 3.486 0.000 1.251) 3.704 11.067 ( 0.251 0.000 -5.353) 5.359 11.223 ( 5.029 0.000 -1.859) 5.361 11.575 ( 0.827 0.000 11.100) 11.131 11.666 ( -0.936 0.000 6.847) 6.911 11.838 ( 0.351 0.000 -5.155) 5.167 11.982 ( -5.114 0.000 3.224) 6.045 12.090 ( 7.858 0.000 -2.546) 8.260 12.355 ( 1.021 0.000 3.698) 3.836 12.623 ( -3.283 0.000 -1.700) 3.697 12.922 ( -2.467 0.000 -6.483) 6.937 12.969 ( -9.839 0.000 12.814) 16.156 13.317 ( 9.178 0.000 9.104) 12.928 13.428 ( -4.717 0.000 -9.932) 10.996 13.609 ( -3.252 0.000 -6.713) 7.459 13.724 ( 13.440 0.000 -7.381) 15.333 13.873 ( 7.645 0.000 0.230) 7.648 14.422 ( 2.338 0.000 -1.197) 2.626 14.669 ( -4.410 0.000 -12.659) 13.405 14.822 ( 10.506 0.000 -14.224) 17.683 14.975 ( -4.397 0.000 3.071) 5.363 15.034 ( -7.919 0.000 0.722) 7.952 15.620 ( -1.026 0.000 9.793) 9.846 15.832 ( -7.735 0.000 7.462) 10.747 15.902 ( -1.452 0.000 1.840) 2.344 16.090 ( -2.488 0.000 8.425) 8.785 16.261 ( 7.079 0.000 -4.467) 8.370 16.475 ( 7.097 0.000 0.921) 7.157 16.487 ( 0.249 0.000 12.172) 12.174 16.792 ( -5.348 0.000 3.563) 6.426 17.261 ( 13.706 0.000 17.242) 22.026 18.618 ( 4.113 0.000 27.663) 27.967 19.145 ( -1.951 0.000 -3.080) 3.646 19.820 ( -6.548 0.000 10.745) 12.583 20.068 ( -3.557 0.000 20.536) 20.841 21.276 ( 12.794 0.000 -39.339) 41.367 21.443 ( -0.490 0.000 -34.658) 34.662 21.824 ( 10.501 0.000 -27.097) 29.061 22.046 ( 3.158 0.000 -22.383) 22.605 25.317 ( 2.680 0.000 10.234) 10.579 25.452 ( -3.181 0.000 10.234) 10.717 25.825 ( -2.090 0.000 9.853) 10.072 25.930 ( -8.154 0.000 12.214) 14.686 26.021 ( -11.298 0.000 -14.828) 18.642 26.389 ( -16.023 0.000 -22.462) 27.591 26.944 ( 16.280 0.000 -12.027) 20.241 27.235 ( 10.756 0.000 -21.750) 24.264 28.489 ( -5.948 0.000 0.693) 5.988 28.742 ( 5.433 0.000 -4.552) 7.088 28.782 ( 4.878 0.000 6.016) 7.745 28.997 ( 1.135 0.000 -3.095) 3.297 29.387 ( 8.897 0.000 0.430) 8.907 29.777 ( -15.101 0.000 -13.367) 20.167 30.058 ( -11.038 0.000 11.878) 16.214 30.588 ( 1.881 0.000 15.323) 15.438 30.910 ( -12.108 0.000 6.239) 13.621 31.201 ( 0.342 0.000 0.803) 0.873 31.263 ( -22.297 0.000 16.568) 27.779 31.361 ( -0.639 0.000 10.889) 10.907 31.819 ( 0.819 0.000 0.015) 0.819 31.939 ( -5.031 0.000 13.009) 13.948 32.045 ( 18.101 0.000 -16.204) 24.295 32.629 ( 19.715 0.000 5.988) 20.605 ======================= Grid point 109 (57/104) ======================= q-point: (-0.20 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( -7.860 0.000 35.897) 36.748 2.279 ( -9.277 0.000 39.664) 40.734 2.517 ( -0.651 0.000 10.177) 10.197 3.546 ( -5.362 0.000 14.991) 15.921 3.747 ( 1.643 0.000 0.419) 1.696 3.791 ( -3.231 0.000 9.592) 10.121 3.890 ( 2.805 0.000 9.376) 9.786 4.236 ( -0.774 0.000 -7.913) 7.951 4.359 ( -3.953 0.000 17.403) 17.846 4.432 ( 8.401 0.000 9.974) 13.040 4.963 ( 1.844 0.000 19.390) 19.478 5.088 ( 11.185 0.000 -0.583) 11.200 5.105 ( -3.153 0.000 0.155) 3.157 5.501 ( -13.375 0.000 -4.236) 14.029 5.518 ( -4.508 0.000 19.854) 20.359 5.725 ( -3.192 0.000 23.990) 24.202 5.777 ( 0.872 0.000 -0.064) 0.874 6.093 ( -9.781 0.000 33.408) 34.810 6.224 ( -14.564 0.000 41.620) 44.095 6.362 ( -6.432 0.000 45.652) 46.103 6.382 ( 2.955 0.000 -15.765) 16.040 6.416 ( -2.621 0.000 11.467) 11.762 6.620 ( -10.378 0.000 -4.086) 11.154 6.643 ( -3.191 0.000 2.668) 4.160 6.836 ( 3.827 0.000 11.620) 12.234 6.885 ( -0.729 0.000 -0.217) 0.761 7.001 ( 2.558 0.000 -4.075) 4.811 7.406 ( -16.683 0.000 -11.769) 20.417 7.486 ( -3.457 0.000 4.425) 5.615 7.590 ( -0.063 0.000 -22.231) 22.232 7.748 ( -4.151 0.000 -8.061) 9.067 7.803 ( -8.186 0.000 15.522) 17.548 7.837 ( 5.363 0.000 -15.463) 16.367 7.946 ( -1.351 0.000 0.112) 1.355 7.962 ( 6.140 0.000 -4.251) 7.468 8.061 ( 6.202 0.000 1.685) 6.426 8.307 ( -1.587 0.000 -3.114) 3.495 8.384 ( -2.824 0.000 -1.477) 3.187 8.688 ( 3.037 0.000 -9.529) 10.001 8.782 ( 0.261 0.000 -1.557) 1.579 8.829 ( -1.710 0.000 0.277) 1.732 8.875 ( -1.024 0.000 3.391) 3.542 9.178 ( -1.697 0.000 1.151) 2.051 9.199 ( 2.607 0.000 -3.780) 4.591 9.301 ( 1.933 0.000 -8.160) 8.385 9.498 ( 3.199 0.000 -13.919) 14.282 9.590 ( 8.689 0.000 9.380) 12.786 9.604 ( 3.407 0.000 -8.317) 8.988 9.749 ( 10.123 0.000 -5.460) 11.502 10.000 ( 2.320 0.000 -6.670) 7.062 10.059 ( 4.285 0.000 -10.412) 11.259 10.181 ( 5.012 0.000 -3.095) 5.890 10.336 ( 3.565 0.000 -1.116) 3.735 10.574 ( -11.430 0.000 10.584) 15.578 10.733 ( -5.571 0.000 2.487) 6.101 10.856 ( -3.429 0.000 1.763) 3.855 10.909 ( 5.211 0.000 -8.117) 9.646 11.075 ( -0.477 0.000 2.834) 2.874 11.075 ( 2.477 0.000 -3.034) 3.917 11.334 ( 6.343 0.000 -8.198) 10.366 11.617 ( -0.424 0.000 6.093) 6.108 11.763 ( 4.898 0.000 5.720) 7.530 11.779 ( -2.427 0.000 -3.354) 4.140 12.026 ( 6.644 0.000 0.731) 6.684 12.162 ( -1.149 0.000 0.893) 1.455 12.362 ( -2.196 0.000 2.067) 3.016 12.494 ( -5.689 0.000 2.064) 6.051 12.731 ( -14.641 0.000 12.453) 19.220 12.906 ( 3.771 0.000 -10.853) 11.490 13.278 ( -5.259 0.000 -10.555) 11.793 13.458 ( -1.389 0.000 11.971) 12.051 13.557 ( 1.919 0.000 -12.268) 12.418 13.920 ( 7.163 0.000 -4.438) 8.426 14.020 ( 4.220 0.000 0.414) 4.240 14.352 ( -7.470 0.000 -0.190) 7.472 14.559 ( -0.028 0.000 -15.013) 15.013 14.933 ( 4.118 0.000 -2.602) 4.871 15.037 ( 9.219 0.000 -6.044) 11.024 15.127 ( 5.478 0.000 15.444) 16.387 15.422 ( -4.907 0.000 10.798) 11.861 15.845 ( -4.871 0.000 1.214) 5.020 15.848 ( 0.742 0.000 0.121) 0.752 16.102 ( -0.549 0.000 2.145) 2.214 16.255 ( -3.234 0.000 -7.465) 8.135 16.487 ( -5.054 0.000 11.071) 12.170 16.632 ( 6.918 0.000 -6.194) 9.286 16.855 ( 6.808 0.000 7.553) 10.169 17.459 ( -1.042 0.000 2.832) 3.018 18.897 ( 3.138 0.000 0.903) 3.265 19.280 ( 14.552 0.000 26.628) 30.345 19.748 ( -2.691 0.000 13.669) 13.931 20.068 ( -5.076 0.000 19.846) 20.485 21.283 ( 3.053 0.000 -38.437) 38.558 21.400 ( 12.971 0.000 -36.134) 38.391 21.918 ( 9.019 0.000 -25.582) 27.125 22.007 ( 3.133 0.000 -22.686) 22.901 25.369 ( -3.764 0.000 8.463) 9.263 25.411 ( -3.457 0.000 8.518) 9.193 25.730 ( -10.446 0.000 -10.550) 14.847 25.829 ( -0.830 0.000 10.953) 10.985 25.830 ( -19.602 0.000 -11.959) 22.962 25.855 ( -3.865 0.000 12.699) 13.275 27.206 ( 10.448 0.000 -10.558) 14.854 27.346 ( 8.414 0.000 -24.341) 25.755 28.393 ( -3.035 0.000 1.022) 3.202 28.836 ( 4.251 0.000 -3.896) 5.766 28.863 ( 0.510 0.000 4.188) 4.219 28.953 ( -4.586 0.000 -8.622) 9.766 29.539 ( 3.854 0.000 -10.400) 11.091 29.632 ( 11.692 0.000 5.938) 13.113 29.821 ( -14.704 0.000 8.196) 16.834 30.613 ( -5.239 0.000 16.329) 17.149 30.860 ( -5.331 0.000 11.541) 12.713 30.950 ( -6.987 0.000 20.309) 21.478 31.221 ( 0.942 0.000 1.165) 1.499 31.383 ( -2.585 0.000 12.368) 12.635 31.831 ( -0.039 0.000 -0.514) 0.516 31.915 ( -1.934 0.000 12.280) 12.432 32.251 ( 7.846 0.000 -18.368) 19.974 32.952 ( 7.741 0.000 -4.231) 8.822 ======================= Grid point 110 (58/104) ======================= q-point: ( 0.00 0.17 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.389 ( 7.655 0.643 39.024) 39.773 2.637 ( 1.620 4.592 12.647) 13.552 2.767 ( 9.296 14.210 38.150) 41.759 3.658 ( -1.415 0.915 12.188) 12.304 3.718 ( -2.101 -0.513 7.402) 7.711 3.769 ( -1.449 0.590 6.346) 6.536 3.956 ( 1.976 -5.925 6.221) 8.815 4.152 ( 1.323 2.210 -5.829) 6.373 4.398 ( -5.310 2.425 2.242) 6.254 4.721 ( -8.168 -5.032 12.406) 15.683 4.937 ( -8.192 -5.284 0.048) 9.748 4.986 ( -2.530 3.021 15.112) 15.618 5.096 ( -7.943 10.106 9.518) 15.994 5.326 ( -1.998 -0.633 8.996) 9.236 5.412 ( -0.366 4.735 3.794) 6.079 5.675 ( -1.687 -5.231 18.515) 19.313 5.850 ( -4.587 5.862 10.221) 12.644 5.984 ( -10.622 1.275 31.475) 33.243 6.110 ( -4.778 -6.736 19.793) 21.447 6.349 ( -10.041 0.653 16.042) 18.937 6.370 ( -2.532 -0.977 7.434) 7.914 6.481 ( -1.980 4.028 20.201) 20.693 6.549 ( 3.758 -5.811 2.704) 7.430 6.652 ( 1.454 5.820 7.466) 9.577 6.809 ( 4.580 -3.034 2.326) 5.966 6.892 ( -11.945 2.876 -15.483) 19.766 7.112 ( 0.498 7.807 7.247) 10.664 7.249 ( 3.908 11.799 -4.621) 13.261 7.479 ( -0.867 2.523 6.741) 7.250 7.549 ( 5.264 -0.397 -12.918) 13.955 7.589 ( -8.098 1.547 4.279) 9.289 7.692 ( -1.381 -2.004 5.833) 6.321 7.936 ( -0.172 0.482 -2.230) 2.288 8.037 ( 5.037 4.287 -6.164) 9.041 8.113 ( 8.450 -2.040 -10.844) 13.898 8.172 ( 2.394 0.158 -1.587) 2.876 8.300 ( 2.293 -1.338 -4.081) 4.868 8.338 ( 0.172 3.890 3.029) 4.933 8.656 ( -4.122 4.219 -8.575) 10.408 8.825 ( 3.918 -0.562 -0.208) 3.963 8.877 ( 3.661 0.260 1.398) 3.927 8.910 ( -0.324 3.459 -1.407) 3.748 9.091 ( -0.110 -5.870 0.222) 5.875 9.203 ( 2.729 -0.535 -4.392) 5.198 9.355 ( 4.842 -7.438 -7.002) 11.305 9.440 ( 4.428 -4.721 -10.381) 12.233 9.606 ( 4.486 -6.885 -5.972) 10.158 9.663 ( 6.038 -9.085 -5.287) 12.122 9.846 ( -3.033 -4.551 -1.651) 5.713 9.890 ( 4.011 -4.386 -3.995) 7.161 10.180 ( -1.119 5.764 -5.119) 7.790 10.307 ( 0.240 4.532 0.371) 4.554 10.428 ( -4.198 5.023 2.564) 7.031 10.506 ( -0.149 9.513 -1.740) 9.672 10.626 ( -1.242 0.552 1.527) 2.044 10.806 ( -0.415 -4.177 -0.287) 4.208 10.907 ( 1.417 -3.661 -4.304) 5.825 10.973 ( -4.271 -3.363 0.525) 5.462 11.103 ( -0.115 -2.017 0.755) 2.157 11.318 ( -2.191 -1.704 -11.123) 11.464 11.608 ( -2.508 0.215 2.055) 3.249 11.741 ( -0.265 -0.546 3.240) 3.296 11.912 ( 4.588 2.412 4.051) 6.578 12.011 ( -2.109 -5.870 5.768) 8.496 12.178 ( -7.414 -1.782 -1.570) 7.785 12.223 ( 2.461 1.221 1.304) 3.041 12.575 ( 10.117 3.298 -5.504) 11.980 12.624 ( 0.388 2.083 4.741) 5.193 12.961 ( -0.119 4.827 -8.264) 9.571 13.163 ( -3.731 3.674 -4.208) 6.718 13.431 ( -10.058 2.985 11.021) 15.216 13.531 ( 3.338 -4.891 -11.174) 12.646 13.880 ( -3.086 -6.940 2.413) 7.969 14.062 ( 3.638 -1.388 -1.833) 4.304 14.282 ( -5.252 4.823 -0.409) 7.142 14.419 ( -2.201 -15.710 -0.866) 15.887 14.670 ( -2.756 -3.079 -5.393) 6.794 15.108 ( 1.717 -6.744 -0.275) 6.965 15.489 ( 1.939 20.683 9.245) 22.739 15.733 ( -0.122 0.462 -5.567) 5.587 15.840 ( 4.505 0.553 12.624) 13.416 15.881 ( 12.700 3.401 -0.670) 13.165 16.048 ( -2.491 -0.378 -1.478) 2.921 16.146 ( -4.002 2.284 -4.926) 6.745 16.365 ( -6.043 -8.086 8.519) 13.209 16.672 ( -1.787 2.090 -7.783) 8.254 16.995 ( -0.522 -3.292 8.330) 8.972 17.183 ( -8.037 -8.645 5.919) 13.204 18.848 ( -4.111 1.171 -0.479) 4.301 19.371 ( -7.256 -4.648 15.926) 18.108 19.857 ( 3.306 -7.112 19.416) 20.940 19.993 ( -5.711 -4.354 17.440) 18.860 21.274 ( 6.296 7.171 -39.836) 40.963 21.559 ( 11.740 3.591 -31.797) 34.084 21.897 ( 1.630 -1.460 -24.086) 24.185 22.012 ( 7.902 -1.333 -25.161) 26.407 25.294 ( -7.061 1.705 3.495) 8.061 25.380 ( -2.861 -0.294 4.524) 5.361 25.598 ( 9.885 0.830 -3.028) 10.372 25.696 ( 7.999 -1.703 -5.980) 10.132 25.864 ( -2.675 1.971 12.013) 12.464 25.925 ( 1.967 0.455 15.024) 15.159 27.202 ( -2.792 -0.636 -11.702) 12.048 27.378 ( 5.845 -1.891 -25.253) 25.989 28.426 ( 1.206 4.817 0.768) 5.024 28.735 ( -4.894 -0.481 -9.727) 10.899 28.873 ( -1.973 1.721 2.083) 3.346 28.930 ( 3.025 -1.063 -1.976) 3.766 29.555 ( -10.677 1.187 3.572) 11.321 29.746 ( 15.781 -4.401 2.336) 16.549 30.053 ( 9.016 11.485 -0.842) 14.625 30.546 ( -10.478 -0.379 11.398) 15.487 30.751 ( 0.522 2.355 14.585) 14.783 31.114 ( 6.002 -3.325 20.526) 21.643 31.256 ( 2.212 -0.106 2.841) 3.602 31.343 ( -2.942 -1.686 12.713) 13.158 31.789 ( -0.902 -2.210 0.872) 2.541 31.932 ( -0.483 -2.419 13.981) 14.197 32.276 ( -3.331 6.752 -19.505) 20.908 32.841 ( -11.590 -2.580 -9.058) 14.934 ======================= Grid point 111 (59/104) ======================= q-point: ( 0.20 0.17 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.691 ( 1.463 -0.751 15.536) 15.623 2.794 ( 6.592 4.097 26.812) 27.913 3.218 ( 13.393 6.987 29.729) 33.347 3.568 ( -7.590 0.469 3.688) 8.451 3.744 ( -8.413 -1.364 11.775) 14.536 3.851 ( 10.091 -9.400 2.580) 14.030 3.974 ( -2.052 -13.723 2.353) 14.073 4.099 ( -6.123 10.392 3.038) 12.438 4.180 ( -8.830 1.125 6.352) 10.935 4.445 ( -10.851 -2.306 0.680) 11.114 4.764 ( -9.490 -2.908 8.893) 13.327 4.980 ( -7.592 1.665 14.284) 16.262 5.161 ( 1.608 8.529 13.687) 16.207 5.277 ( 1.315 -3.623 9.285) 10.053 5.531 ( 1.209 13.269 4.172) 13.962 5.691 ( -5.754 13.440 3.243) 14.975 5.737 ( -4.272 0.541 22.495) 22.903 5.940 ( -8.230 3.280 25.139) 26.655 6.104 ( 2.294 -4.568 3.719) 6.322 6.245 ( -6.968 -0.065 26.400) 27.304 6.348 ( -2.196 2.920 -6.530) 7.483 6.400 ( -3.715 0.027 -1.451) 3.989 6.608 ( -3.459 4.655 27.376) 27.984 6.697 ( 3.767 -5.617 5.022) 8.424 6.892 ( 3.434 -0.092 20.051) 20.343 7.027 ( 10.549 -3.858 3.996) 11.922 7.200 ( 4.003 6.326 -1.607) 7.656 7.307 ( 2.679 7.225 -5.637) 9.547 7.417 ( -5.241 2.505 2.633) 6.378 7.468 ( -2.178 -0.334 5.328) 5.765 7.690 ( 4.470 0.886 -0.629) 4.600 7.748 ( 7.127 3.649 2.944) 8.531 7.919 ( -0.168 -2.540 1.101) 2.773 8.127 ( 5.973 1.019 -6.918) 9.196 8.171 ( 0.313 -0.584 -3.034) 3.105 8.257 ( 2.524 -2.806 0.661) 3.831 8.364 ( 2.111 2.288 1.136) 3.314 8.395 ( 9.501 1.827 -7.879) 12.477 8.522 ( -4.934 4.667 -6.498) 9.399 8.779 ( -7.667 -0.922 1.139) 7.806 8.874 ( -2.484 0.610 -2.447) 3.540 8.934 ( 0.232 1.722 -8.087) 8.272 9.119 ( 1.722 -4.127 0.220) 4.478 9.229 ( 1.364 -1.429 -6.312) 6.614 9.434 ( 4.194 1.158 -16.193) 16.767 9.478 ( 4.088 -10.803 -8.477) 14.327 9.675 ( 4.858 -5.458 -5.185) 8.960 9.739 ( -2.662 -6.052 -2.526) 7.077 9.747 ( 2.042 -6.611 -4.210) 8.099 9.939 ( 4.047 -4.270 -7.194) 9.293 10.072 ( -4.251 2.830 -6.289) 8.101 10.274 ( -1.739 5.030 -1.073) 5.429 10.309 ( -4.557 2.383 -3.293) 6.106 10.553 ( 2.775 2.910 4.645) 6.144 10.607 ( -2.314 3.152 -0.835) 3.999 10.819 ( -1.198 -3.097 1.658) 3.712 10.878 ( -3.359 -2.903 -4.395) 6.247 10.928 ( 1.198 -1.978 1.293) 2.650 11.082 ( -1.476 -3.097 2.718) 4.377 11.189 ( -3.467 0.616 -8.566) 9.261 11.582 ( -0.493 0.299 0.166) 0.600 11.720 ( -4.399 -3.782 6.949) 9.052 11.899 ( -8.809 -0.908 0.493) 8.869 11.981 ( 0.470 9.337 3.455) 9.966 12.101 ( 5.060 -3.251 2.581) 6.544 12.308 ( 0.952 -0.714 -1.582) 1.980 12.696 ( 4.736 1.809 2.463) 5.636 12.754 ( -0.462 5.830 1.253) 5.981 12.945 ( 6.430 0.773 -9.392) 11.408 13.127 ( 4.986 0.551 -4.440) 6.699 13.292 ( -6.151 0.512 8.300) 10.344 13.545 ( 1.213 -9.111 -8.127) 12.269 13.776 ( -5.515 -2.764 1.636) 6.382 14.032 ( -6.466 0.262 -1.228) 6.587 14.242 ( 2.661 3.779 -2.543) 5.275 14.491 ( 7.398 -11.351 -0.678) 13.566 14.678 ( 6.166 -9.076 0.300) 10.977 15.045 ( -8.072 -7.256 3.894) 11.531 15.484 ( -3.948 17.636 3.511) 18.410 15.691 ( -2.830 0.449 -9.959) 10.363 15.852 ( 2.919 5.389 -4.283) 7.477 15.980 ( -2.473 -0.632 2.767) 3.764 16.089 ( 1.509 4.420 3.370) 5.759 16.222 ( -11.146 -15.943 15.771) 25.042 16.334 ( 12.893 1.822 5.121) 13.992 16.542 ( -5.388 0.770 1.459) 5.635 16.892 ( -10.612 1.367 8.111) 13.427 17.068 ( -5.351 1.330 6.250) 8.334 18.731 ( -7.648 2.746 6.480) 10.393 19.250 ( -6.803 -3.725 7.424) 10.736 19.929 ( -3.959 -3.272 16.431) 17.215 19.961 ( -3.565 -6.789 17.288) 18.912 21.247 ( 8.423 7.306 -40.411) 41.921 21.651 ( 9.795 1.657 -29.157) 30.803 21.796 ( -0.085 0.324 -26.478) 26.480 22.049 ( 6.036 -1.686 -24.260) 25.057 25.210 ( -2.229 1.085 4.222) 4.896 25.376 ( 0.399 -1.819 5.329) 5.645 25.816 ( 2.242 -0.502 6.851) 7.226 25.914 ( 11.733 3.372 -3.012) 12.574 26.000 ( 1.400 -2.512 14.551) 14.832 26.104 ( 24.630 -0.751 -10.643) 26.841 27.002 ( -9.346 1.831 -14.173) 17.076 27.322 ( -0.488 -3.560 -24.666) 24.926 28.491 ( 4.157 3.457 1.719) 5.673 28.641 ( -0.369 -0.572 -6.771) 6.805 28.808 ( -4.392 3.737 0.236) 5.772 28.963 ( 0.948 -1.749 -1.471) 2.474 29.404 ( -3.884 6.659 0.021) 7.709 30.042 ( 6.567 -5.330 9.993) 13.092 30.249 ( 9.239 0.965 1.682) 9.440 30.349 ( -10.718 -0.696 5.474) 12.055 30.961 ( 10.655 0.421 8.480) 13.624 31.242 ( 2.941 0.435 8.340) 8.855 31.289 ( -1.319 -3.368 7.026) 7.902 31.487 ( 5.714 1.999 19.092) 20.029 31.771 ( -0.683 -3.073 0.645) 3.214 31.973 ( -2.539 -1.623 15.519) 15.809 32.054 ( -6.173 6.020 -18.188) 20.129 32.420 ( -22.365 0.985 -3.385) 22.641 ======================= Grid point 112 (60/104) ======================= q-point: (-0.60 0.17 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.675 ( -8.566 1.412 12.041) 14.844 2.876 ( -7.310 13.206 9.245) 17.701 3.302 ( -23.077 12.039 9.730) 27.788 3.532 ( 1.827 0.317 12.342) 12.481 3.559 ( 0.201 -6.033 11.999) 13.431 3.791 ( -4.721 -7.761 -8.070) 12.151 4.004 ( -3.400 1.463 5.176) 6.363 4.104 ( -4.849 -2.102 12.464) 13.538 4.204 ( 6.577 1.164 6.953) 9.642 4.535 ( 17.983 -7.958 8.349) 21.364 4.660 ( -3.841 -7.999 13.556) 16.202 4.872 ( -7.897 6.009 18.017) 20.569 5.134 ( -9.164 5.045 -6.786) 12.469 5.365 ( 0.125 12.987 1.467) 13.071 5.401 ( -2.536 12.999 9.780) 16.464 5.635 ( 1.343 -3.465 19.819) 20.165 5.865 ( -9.912 -0.092 32.270) 33.758 5.945 ( 3.470 4.908 16.580) 17.636 6.203 ( 4.853 -3.479 -1.305) 6.113 6.308 ( 2.835 -2.372 -8.587) 9.349 6.336 ( 5.319 1.167 18.132) 18.932 6.438 ( 2.423 -2.373 8.210) 8.882 6.648 ( -6.664 6.746 35.405) 36.652 6.727 ( -4.693 -1.766 15.836) 16.611 6.909 ( -15.108 3.989 39.909) 42.859 7.149 ( -6.185 4.854 -3.791) 8.728 7.236 ( 8.156 -0.857 -0.155) 8.203 7.287 ( -0.258 10.059 -7.889) 12.786 7.488 ( 7.387 -6.965 0.491) 10.165 7.556 ( 8.667 -1.968 -9.543) 13.041 7.750 ( 2.582 -4.767 0.405) 5.437 7.804 ( -1.676 -1.214 1.414) 2.507 7.983 ( 0.487 1.871 0.787) 2.088 8.119 ( -4.627 4.665 -1.326) 6.703 8.200 ( 2.490 3.846 -1.702) 4.887 8.261 ( -0.426 -0.258 -0.638) 0.810 8.384 ( -4.823 3.091 -1.474) 5.915 8.470 ( 4.965 -3.976 -1.534) 6.543 8.569 ( 3.065 -0.243 -1.885) 3.607 8.630 ( -0.791 1.032 -1.818) 2.235 8.770 ( -0.425 3.441 -4.621) 5.777 8.892 ( 0.490 4.098 -9.914) 10.739 9.103 ( -1.594 -2.445 -1.616) 3.336 9.204 ( -1.944 -10.714 -9.469) 14.430 9.388 ( 0.964 -1.617 -11.282) 11.438 9.448 ( -0.343 2.607 -9.821) 10.167 9.612 ( -9.884 -4.888 0.479) 11.037 9.732 ( 1.140 -11.564 -6.791) 13.459 9.776 ( 0.193 -0.179 -9.805) 9.809 9.989 ( 3.873 2.363 -13.626) 14.361 10.003 ( -2.307 -2.223 -4.585) 5.593 10.177 ( -3.133 1.172 -2.444) 4.142 10.367 ( 11.052 -0.664 -10.844) 15.498 10.561 ( -0.898 2.404 -0.803) 2.689 10.628 ( 1.123 -1.280 4.575) 4.882 10.702 ( -5.178 -1.098 6.009) 8.008 10.878 ( 4.737 -4.512 -2.862) 7.141 10.973 ( 2.314 3.753 -0.419) 4.428 11.094 ( 1.181 -3.130 -0.161) 3.350 11.140 ( 1.813 0.654 -4.133) 4.561 11.554 ( -2.836 0.523 6.060) 6.711 11.652 ( -4.706 -6.380 4.662) 9.197 11.817 ( 2.099 0.802 -1.206) 2.550 12.030 ( 2.866 8.834 1.099) 9.352 12.188 ( -8.235 -0.838 2.529) 8.655 12.247 ( 3.054 -0.947 3.527) 4.760 12.686 ( -0.921 3.168 -3.436) 4.763 12.844 ( 2.212 -2.995 11.532) 12.118 12.978 ( 2.571 -1.190 -8.855) 9.297 13.217 ( -3.448 0.028 5.713) 6.673 13.374 ( 13.906 -5.212 -5.994) 16.015 13.500 ( -0.023 -7.869 -7.060) 10.572 13.712 ( -2.308 0.686 0.104) 2.410 13.878 ( -4.489 3.420 -0.304) 5.652 14.357 ( 8.852 5.477 -4.587) 11.375 14.618 ( 6.160 -5.913 -7.507) 11.370 14.857 ( -6.642 -1.547 -5.491) 8.756 14.915 ( 9.013 -11.682 7.599) 16.597 15.400 ( -3.884 4.689 4.376) 7.498 15.448 ( -13.528 6.415 -6.243) 16.221 15.920 ( -2.624 -4.374 6.220) 8.044 16.021 ( 4.067 0.423 4.952) 6.422 16.064 ( -2.413 -3.131 4.884) 6.283 16.095 ( -4.560 2.091 3.024) 5.858 16.367 ( 0.073 5.194 3.186) 6.093 16.706 ( 3.658 0.358 11.879) 12.435 16.762 ( -1.257 2.906 10.571) 11.035 16.971 ( -5.117 -0.905 7.513) 9.135 18.615 ( -6.874 3.551 15.835) 17.624 19.162 ( -3.588 -5.118 0.858) 6.310 19.887 ( -5.050 -1.404 11.104) 12.279 19.990 ( -2.305 -5.051 19.647) 20.417 21.268 ( 10.617 6.613 -39.816) 41.735 21.626 ( -0.812 -0.306 -29.103) 29.116 21.750 ( 9.291 2.725 -29.164) 30.729 22.050 ( 4.290 -2.149 -23.597) 24.080 25.234 ( 1.790 1.326 7.023) 7.368 25.424 ( 0.319 -1.750 8.946) 9.121 25.828 ( -2.403 0.352 10.620) 10.895 26.006 ( -5.780 -2.437 15.035) 16.292 26.186 ( 9.625 2.758 -13.135) 16.516 26.508 ( 13.157 -2.188 -20.647) 24.581 26.773 ( -0.477 1.255 -13.687) 13.753 27.164 ( -1.907 -5.580 -22.213) 22.983 28.595 ( 2.601 0.494 0.903) 2.798 28.648 ( 2.616 -0.239 1.224) 2.898 28.713 ( -1.960 4.429 -3.634) 6.055 28.968 ( 0.474 -1.761 -1.680) 2.480 29.387 ( 2.182 10.188 -1.549) 10.533 30.104 ( -5.812 -3.694 7.872) 10.459 30.146 ( -8.198 0.909 2.702) 8.679 30.438 ( 5.852 -1.575 9.492) 11.262 31.071 ( -2.396 -5.555 1.958) 6.359 31.263 ( -3.848 -4.719 11.447) 12.965 31.392 ( -9.799 7.958 -2.916) 12.955 31.515 ( 5.454 -0.003 11.466) 12.697 31.824 ( -1.806 -4.957 6.376) 8.276 31.851 ( -10.651 2.078 2.831) 11.215 31.972 ( 1.276 2.385 -2.483) 3.672 32.219 ( 12.152 3.009 6.565) 14.136 ======================= Grid point 113 (61/104) ======================= q-point: (-0.40 0.17 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.472 ( -15.191 6.534 17.937) 24.397 2.712 ( -8.698 14.712 5.757) 18.035 2.788 ( -26.040 18.692 20.066) 37.817 3.613 ( 4.675 1.676 0.200) 4.970 3.661 ( 0.764 -6.613 12.503) 14.165 3.732 ( 0.575 1.803 -3.018) 3.563 3.941 ( -4.854 1.290 4.406) 6.681 4.077 ( -2.745 -10.355 10.148) 14.756 4.317 ( 2.648 6.554 3.330) 7.813 4.707 ( -1.295 0.324 16.217) 16.272 4.755 ( -2.219 5.110 19.298) 20.086 4.929 ( 4.830 5.740 -1.205) 7.598 5.109 ( 10.182 -8.670 10.297) 16.878 5.244 ( 1.043 8.445 -4.868) 9.803 5.592 ( -0.130 2.573 15.799) 16.007 5.687 ( -4.350 -9.663 12.147) 16.120 5.849 ( -4.743 3.279 28.587) 29.162 5.980 ( -4.381 -2.277 23.860) 24.365 6.269 ( -1.584 -4.555 14.596) 15.372 6.339 ( -2.292 -2.190 8.082) 8.681 6.430 ( -2.519 1.964 9.509) 10.031 6.605 ( -5.046 -2.364 17.276) 18.153 6.631 ( -11.134 4.563 27.651) 30.156 6.660 ( 4.008 1.806 16.156) 16.743 6.793 ( -5.061 5.327 12.497) 14.497 7.010 ( -2.317 9.273 -4.130) 10.412 7.182 ( -7.477 7.636 -3.333) 11.195 7.396 ( 5.461 -0.310 -0.249) 5.476 7.564 ( -0.105 -10.263 -10.906) 14.976 7.628 ( 3.647 -5.805 -0.815) 6.904 7.716 ( -4.989 -3.138 0.672) 5.932 7.837 ( 1.684 -0.919 -4.613) 4.996 7.913 ( -3.019 -0.964 -8.073) 8.673 8.014 ( -4.678 10.360 5.407) 12.588 8.138 ( -5.115 5.722 -0.422) 7.687 8.239 ( -5.413 5.411 -7.836) 10.953 8.298 ( 1.434 1.103 -1.700) 2.482 8.446 ( -4.174 -1.339 -0.495) 4.411 8.606 ( 6.849 0.832 -3.690) 7.824 8.751 ( 3.984 0.941 -0.849) 4.180 8.812 ( 0.978 -2.498 1.127) 2.909 8.907 ( 2.928 1.196 -4.552) 5.543 9.090 ( 3.359 -3.491 -9.127) 10.333 9.124 ( -0.295 -6.457 0.425) 6.478 9.376 ( -2.323 -4.085 -5.512) 7.243 9.444 ( 2.777 1.083 -0.798) 3.086 9.507 ( 5.274 -1.882 -7.848) 9.640 9.563 ( -9.659 -2.231 -14.547) 17.603 9.657 ( -4.600 -6.961 -7.501) 11.220 9.893 ( -2.012 -5.659 -2.845) 6.646 10.041 ( 5.565 5.253 -7.539) 10.742 10.187 ( 3.706 4.022 -4.706) 7.215 10.447 ( 0.992 11.331 -8.279) 14.069 10.575 ( -1.697 -8.347 6.682) 10.826 10.686 ( 6.772 -1.792 -7.930) 10.581 10.753 ( 4.793 -4.082 0.715) 6.337 10.987 ( -0.677 1.000 -3.790) 3.977 10.995 ( 4.539 -2.062 -0.143) 4.988 11.098 ( -0.830 0.179 -0.586) 1.031 11.214 ( 5.396 -0.152 -1.676) 5.653 11.571 ( 0.871 -0.579 7.424) 7.497 11.623 ( 2.560 -3.511 3.148) 5.366 11.862 ( -0.652 2.330 -1.019) 2.625 11.998 ( -5.572 0.904 3.755) 6.779 12.102 ( 2.918 1.567 -1.288) 3.554 12.336 ( 2.198 -1.581 2.953) 4.006 12.619 ( -6.998 -1.300 1.599) 7.296 12.795 ( -4.122 -7.199 3.282) 8.921 13.062 ( -3.112 5.256 -0.684) 6.146 13.176 ( 3.846 -6.575 1.189) 7.709 13.492 ( 2.977 -2.303 -5.809) 6.922 13.601 ( 0.803 -1.065 -0.548) 1.442 13.684 ( 8.844 -2.971 -9.763) 13.504 13.907 ( 4.496 3.189 4.145) 6.896 14.507 ( 3.261 8.080 2.914) 9.187 14.661 ( -1.090 -2.044 -10.421) 10.675 14.771 ( 5.394 -2.028 -12.754) 13.996 14.969 ( -3.170 0.800 2.422) 4.069 15.126 ( -9.220 6.266 -6.573) 12.941 15.516 ( 6.687 -6.974 7.309) 12.115 15.806 ( -8.219 -1.397 14.200) 16.467 15.984 ( -5.819 -1.561 6.599) 8.936 16.061 ( 2.429 5.225 0.763) 5.813 16.242 ( 8.608 -1.557 -2.880) 9.210 16.414 ( 1.290 1.558 1.029) 2.269 16.697 ( -4.398 7.232 6.607) 10.738 16.778 ( 0.541 1.866 4.178) 4.607 17.103 ( 8.185 -15.644 15.999) 23.826 18.653 ( 3.174 3.753 27.317) 27.756 19.100 ( -1.974 -4.465 0.391) 4.898 19.818 ( -6.015 -0.064 10.800) 12.362 20.025 ( -3.121 -4.228 19.492) 20.188 21.335 ( 12.081 5.737 -37.838) 40.132 21.471 ( 0.553 2.692 -34.070) 34.181 21.830 ( 9.984 0.622 -27.665) 29.418 22.022 ( 3.288 -2.450 -23.338) 23.695 25.328 ( 2.493 1.111 10.265) 10.622 25.446 ( -2.558 -0.643 10.292) 10.625 25.827 ( -2.126 0.248 9.706) 9.939 25.918 ( -7.202 -1.230 11.620) 13.726 26.034 ( -12.299 1.464 -14.599) 19.145 26.358 ( -16.721 -3.481 -21.796) 27.690 26.931 ( 15.631 -0.700 -10.777) 18.999 27.190 ( 11.681 -4.190 -20.929) 24.332 28.529 ( -5.266 3.989 0.239) 6.611 28.743 ( 4.977 0.105 -3.189) 5.912 28.773 ( 4.877 -0.768 4.091) 6.412 28.971 ( 0.631 -2.372 -3.513) 4.285 29.450 ( 2.825 5.594 -0.642) 6.300 29.899 ( -6.815 11.301 -9.412) 16.209 30.022 ( -10.158 -2.997 10.128) 14.654 30.589 ( 2.714 -0.178 14.738) 14.987 30.905 ( -10.931 -0.308 6.695) 12.822 31.186 ( -8.992 -3.839 10.152) 14.095 31.231 ( -8.829 -0.076 7.625) 11.666 31.381 ( -6.784 0.877 9.597) 11.785 31.793 ( 0.978 -2.179 0.432) 2.427 31.878 ( -2.817 -4.430 13.021) 14.040 32.131 ( 15.197 7.308 -13.704) 21.729 32.622 ( 18.859 -1.178 2.481) 19.058 ======================= Grid point 114 (62/104) ======================= q-point: (-0.20 0.17 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.258 ( -11.400 8.083 29.763) 32.881 2.542 ( -7.496 19.985 35.521) 41.441 2.620 ( -2.786 10.398 8.483) 13.705 3.677 ( -2.945 6.727 6.878) 10.061 3.689 ( -1.453 -5.562 11.717) 13.052 3.781 ( 2.383 3.152 3.042) 4.987 3.878 ( -1.111 -3.952 7.768) 8.786 4.109 ( 4.435 -6.903 -5.279) 9.756 4.368 ( 2.338 7.067 2.754) 7.937 4.678 ( -1.689 11.925 14.644) 18.961 4.922 ( 1.296 -5.939 24.218) 24.970 5.133 ( 6.797 6.504 1.968) 9.611 5.155 ( 1.615 0.877 -1.375) 2.295 5.318 ( -8.299 -4.028 7.585) 11.943 5.508 ( -7.624 -8.328 2.311) 11.525 5.601 ( -3.795 -3.925 23.390) 24.019 5.892 ( -2.523 4.131 12.998) 13.870 6.061 ( -4.474 -3.524 29.585) 30.128 6.184 ( -14.257 -4.634 27.899) 31.672 6.335 ( -1.349 -3.642 19.514) 19.897 6.396 ( -6.333 2.570 19.914) 21.054 6.473 ( -2.520 5.392 6.509) 8.820 6.557 ( -6.676 -3.715 13.910) 15.870 6.681 ( -6.285 2.713 -3.094) 7.512 6.828 ( -1.262 0.011 6.422) 6.545 6.992 ( -2.149 8.366 0.609) 8.659 7.080 ( 5.012 7.477 -1.617) 9.145 7.428 ( -1.417 -0.370 -14.845) 14.917 7.474 ( -10.751 1.906 -1.802) 11.066 7.542 ( 0.473 -1.787 -4.987) 5.319 7.701 ( 0.210 -4.422 0.672) 4.477 7.756 ( -8.820 -0.192 4.495) 9.901 7.885 ( 6.429 0.520 -9.496) 11.479 7.991 ( -0.708 5.740 4.325) 7.222 8.073 ( -1.575 6.246 -4.015) 7.591 8.129 ( 2.116 5.594 -6.566) 8.882 8.303 ( -0.044 -1.212 -4.182) 4.355 8.363 ( -3.171 0.618 -0.824) 3.334 8.721 ( 4.725 3.202 -7.969) 9.802 8.759 ( 0.124 -3.009 -0.530) 3.058 8.822 ( -0.859 0.312 2.258) 2.436 8.903 ( 0.737 1.734 -1.966) 2.723 9.112 ( -1.499 -5.040 -0.305) 5.267 9.192 ( 3.585 -1.408 -2.075) 4.375 9.276 ( 0.661 -3.665 -9.703) 10.393 9.426 ( 1.367 -6.218 -8.003) 10.226 9.534 ( 4.832 -5.096 -4.450) 8.314 9.559 ( 4.053 -6.039 -4.169) 8.383 9.734 ( 10.451 -0.881 -3.152) 10.952 9.880 ( 0.500 -9.324 -1.164) 9.410 10.145 ( 6.374 7.568 -8.625) 13.126 10.256 ( 4.194 6.192 -2.350) 7.839 10.455 ( 1.468 8.370 -2.111) 8.756 10.515 ( -3.712 -0.904 2.778) 4.723 10.711 ( -2.517 -1.987 -1.427) 3.510 10.848 ( 0.940 -3.141 -2.734) 4.269 10.918 ( -2.282 -0.124 -2.323) 3.259 11.042 ( -3.172 -1.161 1.270) 3.608 11.070 ( 2.533 -1.914 -0.448) 3.207 11.318 ( 5.484 -1.417 -7.781) 9.624 11.622 ( 0.746 0.568 4.695) 4.788 11.750 ( 2.500 -1.517 4.095) 5.032 11.791 ( 0.844 1.143 -2.379) 2.771 12.010 ( 1.438 -3.193 4.096) 5.389 12.118 ( 0.115 -2.372 -0.278) 2.391 12.351 ( -3.101 -0.918 3.633) 4.864 12.493 ( -1.856 0.214 -0.460) 1.924 12.697 ( -7.381 -2.876 3.458) 8.644 12.979 ( -0.338 6.703 -4.086) 7.857 13.233 ( 0.351 -1.001 -5.170) 5.278 13.510 ( 1.354 -1.473 -5.368) 5.729 13.567 ( -3.231 2.537 0.787) 4.183 13.848 ( 6.153 -7.239 -3.093) 9.991 13.998 ( 1.268 -1.512 4.866) 5.251 14.442 ( -8.596 7.499 2.124) 11.604 14.536 ( -4.586 -3.937 -11.115) 12.652 14.778 ( -2.816 -4.285 -7.980) 9.485 15.015 ( 6.225 -2.020 -4.087) 7.716 15.204 ( 17.563 3.641 3.881) 18.351 15.595 ( -0.963 12.298 14.271) 18.863 15.774 ( 0.351 -1.079 0.218) 1.156 15.901 ( -4.952 -0.517 6.836) 8.457 16.093 ( 0.029 1.416 -2.334) 2.731 16.275 ( -2.869 1.364 -8.544) 9.115 16.420 ( -2.826 -5.565 7.718) 9.926 16.668 ( 2.684 2.383 -3.302) 4.877 16.896 ( 5.462 3.040 5.778) 8.512 17.258 ( -0.354 -19.670 7.845) 21.180 18.884 ( 2.424 -0.744 4.689) 5.330 19.215 ( 10.910 -6.045 25.362) 28.263 19.749 ( -4.066 0.465 13.503) 14.109 20.027 ( -5.022 -4.120 19.305) 20.368 21.341 ( 3.940 5.543 -37.554) 38.165 21.448 ( 12.543 4.549 -35.063) 37.516 21.913 ( 8.525 -0.636 -25.959) 27.331 21.985 ( 3.734 -2.237 -23.825) 24.219 25.386 ( -2.346 1.622 8.450) 8.918 25.417 ( -3.302 0.584 8.534) 9.170 25.720 ( -10.890 -0.966 -9.964) 14.792 25.774 ( -13.515 -3.382 -4.192) 14.548 25.846 ( -2.069 1.225 9.419) 9.721 25.890 ( -7.131 1.790 5.995) 9.487 27.180 ( 9.797 -1.928 -9.819) 14.004 27.324 ( 9.428 -2.139 -24.001) 25.875 28.440 ( -2.723 4.779 0.265) 5.507 28.836 ( 4.042 0.008 -3.349) 5.250 28.864 ( 1.515 -0.175 3.339) 3.671 28.920 ( -3.549 -3.375 -7.843) 9.247 29.492 ( 5.296 -0.161 -0.475) 5.319 29.791 ( -11.969 -2.132 7.037) 14.048 29.887 ( 5.721 19.298 -4.944) 20.726 30.626 ( -5.098 1.286 16.449) 17.269 30.858 ( -5.603 -0.423 10.194) 11.640 30.924 ( -6.369 -2.608 20.316) 21.450 31.219 ( 0.807 -0.415 1.930) 2.133 31.359 ( -3.098 -2.559 12.451) 13.084 31.802 ( -0.566 -2.519 1.241) 2.864 31.884 ( -1.189 -2.776 12.395) 12.758 32.319 ( 7.574 6.669 -17.749) 20.417 32.921 ( 7.756 -3.436 -6.534) 10.708 ======================= Grid point 115 (63/104) ======================= q-point: ( 0.00 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.541 ( 2.195 15.676 24.640) 29.286 2.773 ( -1.209 9.835 5.751) 11.457 3.069 ( 4.064 16.235 28.377) 32.944 3.421 ( -1.308 -16.849 2.461) 17.078 3.571 ( -2.143 -18.959 -3.250) 19.354 3.746 ( -2.741 -7.529 8.024) 11.339 3.955 ( -1.818 7.730 6.234) 10.096 4.249 ( -1.803 -0.222 8.692) 8.880 4.436 ( -1.798 6.567 1.285) 6.929 4.679 ( -9.023 0.992 0.624) 9.099 4.922 ( -4.970 2.092 4.561) 7.063 5.023 ( 1.082 1.538 6.221) 6.499 5.171 ( -10.322 1.062 22.809) 25.058 5.375 ( -3.127 2.311 11.702) 12.331 5.512 ( 0.630 -3.068 21.065) 21.297 5.686 ( 1.753 12.930 6.177) 14.436 5.869 ( -1.795 -7.055 15.079) 16.744 5.958 ( -3.889 -0.114 14.966) 15.464 6.068 ( -5.904 2.473 17.036) 18.199 6.321 ( -2.219 -4.745 18.320) 19.054 6.378 ( -1.734 0.788 16.815) 16.923 6.388 ( -4.130 -5.845 17.951) 19.325 6.590 ( -1.872 6.108 9.893) 11.777 6.727 ( 4.018 0.559 6.621) 7.765 6.829 ( 0.624 5.954 3.706) 7.041 6.955 ( -12.173 3.097 -7.553) 14.656 7.267 ( 2.027 7.766 7.482) 10.973 7.471 ( -4.826 7.320 1.826) 8.956 7.503 ( 8.543 -1.472 -0.874) 8.713 7.609 ( -4.035 4.895 3.355) 7.177 7.642 ( -2.341 8.067 0.537) 8.417 7.661 ( 0.779 -0.157 2.502) 2.626 7.950 ( -0.884 -1.256 -3.912) 4.203 7.998 ( 1.496 -8.911 1.486) 9.157 8.110 ( 5.140 3.455 -6.083) 8.681 8.217 ( 2.034 3.986 -4.854) 6.602 8.298 ( 2.022 2.894 -6.248) 7.176 8.428 ( 0.970 4.897 -2.634) 5.644 8.682 ( -1.263 -1.999 -4.190) 4.811 8.825 ( -0.450 0.603 -1.316) 1.515 8.844 ( 2.591 -4.083 1.772) 5.150 8.966 ( 1.778 -6.388 -3.309) 7.410 9.015 ( -0.601 4.097 -3.781) 5.607 9.133 ( 4.684 -6.781 -8.857) 12.098 9.225 ( 3.331 -3.190 -6.927) 8.322 9.304 ( 4.322 -7.841 -6.845) 11.270 9.468 ( 4.528 -5.620 -3.638) 8.082 9.503 ( 6.744 -7.683 -5.066) 11.409 9.783 ( -1.534 -1.705 -1.082) 2.536 9.821 ( 1.807 -3.028 -2.162) 4.136 10.308 ( -1.588 7.750 -6.028) 9.946 10.403 ( -0.046 4.533 -0.773) 4.598 10.509 ( 2.140 2.531 0.269) 3.326 10.592 ( -6.654 1.070 -1.422) 6.888 10.664 ( 4.265 -0.607 0.243) 4.315 10.755 ( -8.880 -1.841 -1.630) 9.214 10.822 ( 3.051 -2.160 -2.471) 4.481 10.918 ( -5.099 -2.783 1.012) 5.897 11.090 ( 1.824 2.664 -3.737) 4.938 11.283 ( 0.495 -2.600 -10.964) 11.279 11.610 ( -2.409 0.240 -1.085) 2.653 11.695 ( -3.026 -4.273 4.354) 6.809 11.894 ( 2.288 -1.432 4.518) 5.263 11.962 ( 5.666 -1.945 1.419) 6.156 12.174 ( -3.090 1.947 0.101) 3.653 12.240 ( 0.677 0.255 0.947) 1.192 12.633 ( 10.474 2.578 -9.465) 14.351 12.657 ( 5.298 1.198 -6.425) 8.414 13.089 ( -3.222 8.183 -0.617) 8.816 13.249 ( -3.098 4.222 -2.561) 5.829 13.428 ( -4.213 -3.496 0.595) 5.507 13.467 ( -8.433 -0.456 3.318) 9.074 13.744 ( -0.139 -6.539 6.051) 8.910 13.949 ( 3.786 -14.962 16.299) 22.447 14.194 ( -9.675 3.487 -8.246) 13.182 14.388 ( -5.952 1.775 -5.141) 8.063 14.731 ( -2.561 5.642 -12.324) 13.794 14.964 ( -0.469 -7.838 -4.219) 8.914 15.693 ( 11.262 3.430 5.994) 13.210 15.746 ( 4.398 0.956 -3.455) 5.674 15.829 ( -2.591 -0.962 9.147) 9.556 16.003 ( -4.426 -1.040 1.921) 4.936 16.050 ( -2.312 3.414 2.298) 4.720 16.123 ( -5.913 -4.452 8.544) 11.304 16.305 ( 2.791 7.880 0.147) 8.361 16.725 ( 2.039 0.640 -11.584) 11.779 16.859 ( -1.512 -7.044 9.168) 11.660 17.049 ( 1.541 -6.342 2.388) 6.950 18.904 ( -3.930 5.196 8.582) 10.774 19.227 ( -4.240 -10.050 20.359) 23.097 19.778 ( -1.539 -0.560 17.021) 17.100 19.904 ( -5.284 -5.066 17.051) 18.556 21.424 ( 6.441 8.212 -36.558) 38.019 21.611 ( 9.406 0.622 -30.912) 32.317 21.877 ( 3.952 0.171 -26.655) 26.947 21.974 ( 7.800 -2.744 -26.342) 27.609 25.323 ( -7.526 1.341 1.879) 7.872 25.368 ( -4.906 -0.934 2.792) 5.722 25.618 ( 9.983 1.194 -1.894) 10.231 25.664 ( 8.956 -1.560 -2.955) 9.559 25.902 ( -1.803 1.859 11.348) 11.639 25.932 ( 0.832 0.212 13.092) 13.120 27.211 ( -0.088 1.800 -13.455) 13.576 27.329 ( 4.100 -3.256 -21.980) 22.595 28.538 ( 0.524 6.638 -1.142) 6.756 28.715 ( -4.211 -1.985 -7.483) 8.813 28.890 ( 0.304 0.126 0.995) 1.048 28.907 ( 2.487 -1.202 -0.591) 2.825 29.584 ( -4.763 1.878 3.419) 6.156 29.677 ( 9.905 -3.205 3.818) 11.089 30.269 ( -0.542 10.676 -2.828) 11.057 30.518 ( -10.996 -2.941 7.111) 13.421 30.825 ( 4.232 5.625 15.449) 16.977 31.051 ( 4.985 -4.083 19.830) 20.851 31.226 ( -0.309 -1.446 5.700) 5.889 31.308 ( 1.498 -2.639 10.847) 11.263 31.769 ( -1.152 0.569 4.999) 5.162 31.875 ( -0.249 -3.517 12.496) 12.984 32.433 ( -3.864 9.538 -18.161) 20.874 32.759 ( -8.212 -6.339 -13.076) 16.691 ======================= Grid point 116 (64/104) ======================= q-point: ( 0.20 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.749 ( 2.959 8.086 12.707) 15.350 2.899 ( 9.538 7.612 19.506) 23.009 3.313 ( 6.036 -3.594 11.481) 13.460 3.406 ( -2.756 -19.146 2.306) 19.481 3.606 ( 9.959 -6.315 10.995) 16.123 3.727 ( -4.355 1.657 2.966) 5.523 3.901 ( -2.474 4.628 8.278) 9.801 4.188 ( -4.976 -2.330 7.236) 9.086 4.302 ( -19.349 7.827 2.961) 21.081 4.474 ( -0.687 2.698 -1.644) 3.234 4.725 ( -13.332 2.654 4.936) 14.462 5.026 ( -5.102 2.623 10.520) 11.983 5.173 ( 0.424 -2.750 20.109) 20.301 5.350 ( -3.669 2.514 15.260) 15.895 5.630 ( -0.923 -1.736 16.806) 16.921 5.765 ( 4.840 2.870 7.416) 9.309 5.876 ( -6.782 5.525 7.293) 11.389 5.944 ( -3.514 -1.899 11.650) 12.316 6.082 ( 4.513 3.969 7.406) 9.538 6.310 ( -7.256 5.186 25.572) 27.083 6.370 ( -6.263 -1.954 29.125) 29.855 6.490 ( 2.288 -5.129 -1.171) 5.737 6.589 ( -4.134 10.435 -4.555) 12.113 6.738 ( 0.328 9.328 17.682) 19.994 6.895 ( 5.423 -0.282 17.544) 18.365 6.970 ( 9.643 -2.764 1.380) 10.125 7.346 ( -0.626 7.251 5.234) 8.964 7.391 ( -1.842 2.335 10.729) 11.133 7.473 ( -7.323 4.241 -1.409) 8.579 7.573 ( 1.097 7.889 -8.868) 11.919 7.678 ( -0.690 -2.159 4.655) 5.178 7.779 ( 8.830 1.192 1.455) 9.028 7.888 ( -1.659 -1.048 -0.679) 2.077 8.055 ( 1.307 -10.515 5.258) 11.829 8.217 ( 3.766 2.916 -6.197) 7.816 8.251 ( 6.713 8.108 -3.657) 11.144 8.415 ( 0.511 4.072 -1.745) 4.460 8.423 ( 9.397 -0.371 -7.212) 11.851 8.602 ( -4.609 1.889 -3.568) 6.127 8.733 ( -7.198 -2.477 0.408) 7.623 8.874 ( -4.193 -1.140 0.583) 4.385 8.895 ( -1.530 -11.606 -1.859) 11.854 9.035 ( 3.087 -0.060 -10.997) 11.423 9.204 ( 2.045 -2.732 -7.064) 7.845 9.321 ( 6.504 -2.704 -6.234) 9.406 9.387 ( 7.092 -6.018 -7.160) 11.738 9.547 ( 4.085 -5.148 -7.703) 10.126 9.603 ( 4.135 -7.327 -3.701) 9.191 9.697 ( -3.872 1.405 -3.805) 5.608 9.847 ( 4.679 -5.162 -4.827) 8.476 10.171 ( -7.138 6.556 -6.098) 11.451 10.374 ( -3.073 4.738 -4.093) 6.975 10.404 ( -8.614 6.272 -0.269) 10.659 10.494 ( -5.478 -5.108 1.710) 7.683 10.648 ( 2.070 0.572 0.822) 2.299 10.719 ( 0.326 -8.266 0.329) 8.279 10.832 ( -3.058 -1.950 -3.164) 4.813 10.886 ( 2.909 -3.079 2.163) 4.756 11.097 ( 1.096 5.668 -5.377) 7.889 11.230 ( -0.150 2.224 -10.096) 10.339 11.581 ( 0.103 -0.303 -4.069) 4.081 11.633 ( -4.851 -4.734 5.504) 8.731 11.887 ( -5.557 0.269 1.217) 5.695 12.003 ( 2.325 -4.590 -1.693) 5.416 12.169 ( 3.163 7.095 2.906) 8.294 12.294 ( 0.902 -0.923 -0.508) 1.387 12.752 ( 5.397 4.061 -2.584) 7.232 12.849 ( 7.953 2.295 -4.556) 9.448 12.985 ( -4.337 5.061 -1.666) 6.871 13.162 ( -2.924 3.304 0.336) 4.425 13.282 ( -8.250 -2.380 11.368) 14.246 13.350 ( -1.197 -10.504 -9.534) 14.236 13.746 ( -1.101 0.579 4.383) 4.556 13.990 ( -5.566 -7.362 3.501) 9.871 14.207 ( 8.960 -2.303 10.529) 14.015 14.372 ( 6.789 -1.669 -3.765) 7.940 14.634 ( -0.611 1.653 -9.213) 9.380 14.887 ( -4.972 -8.993 -0.836) 10.310 15.686 ( -6.666 5.223 -5.606) 10.156 15.717 ( -6.640 1.616 -2.980) 7.456 15.862 ( 1.480 -2.508 12.802) 13.129 15.971 ( -5.988 -9.375 17.485) 20.723 16.016 ( -1.938 3.326 -1.764) 4.234 16.119 ( 6.234 -2.121 -0.186) 6.588 16.471 ( 9.706 12.053 2.163) 15.625 16.620 ( -6.581 7.903 -7.436) 12.691 16.864 ( -1.656 -3.936 4.870) 6.477 17.036 ( -3.635 -5.503 2.064) 6.911 18.819 ( -8.290 6.797 13.968) 17.607 19.142 ( -9.042 -7.825 15.456) 19.542 19.836 ( -0.710 -3.811 16.847) 17.287 19.875 ( -3.891 -3.694 13.787) 14.794 21.402 ( 7.333 8.546 -36.768) 38.454 21.641 ( 6.153 -3.180 -29.485) 30.288 21.838 ( 4.365 4.225 -28.118) 28.767 22.002 ( 5.887 -3.369 -25.716) 26.595 25.238 ( -1.691 1.930 3.722) 4.521 25.332 ( -0.135 -2.734 4.331) 5.123 25.827 ( 3.057 1.612 6.855) 7.677 25.938 ( 3.671 -3.527 10.611) 11.769 25.981 ( 11.556 3.273 -2.349) 12.238 26.081 ( 18.529 -1.797 -5.975) 19.551 27.057 ( -7.573 4.055 -15.240) 17.495 27.240 ( -3.168 -4.960 -21.267) 22.066 28.558 ( 1.604 3.270 -0.094) 3.643 28.628 ( -0.942 -0.845 -4.373) 4.552 28.875 ( -1.918 2.992 -0.518) 3.592 28.935 ( 0.743 -1.123 -0.791) 1.562 29.559 ( 1.087 9.482 1.016) 9.598 29.912 ( 7.642 -8.384 6.210) 12.932 30.270 ( 1.670 1.328 2.419) 3.226 30.329 ( -8.805 -1.456 4.064) 9.806 30.985 ( 2.411 2.430 11.330) 11.836 31.163 ( -2.400 -6.237 15.067) 16.483 31.315 ( 8.303 4.072 7.977) 12.213 31.492 ( 7.878 -2.616 15.299) 17.406 31.752 ( -2.585 2.255 2.113) 4.029 31.924 ( -0.061 -3.807 9.489) 10.224 32.191 ( -9.361 8.019 -15.127) 19.513 32.412 ( -17.037 -2.345 -8.585) 19.222 ======================= Grid point 117 (65/104) ======================= q-point: (-0.60 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.774 ( -3.513 10.254 6.025) 12.401 3.152 ( 0.330 13.175 16.761) 21.322 3.383 ( 1.356 -13.682 6.076) 15.032 3.436 ( 0.936 -0.987 7.435) 7.558 3.637 ( -3.994 10.769 -0.276) 11.490 3.707 ( -7.125 -0.694 -0.838) 7.208 3.948 ( -7.206 -4.819 8.268) 11.980 4.045 ( -2.160 2.014 13.472) 13.792 4.205 ( 7.530 -0.978 12.172) 14.346 4.436 ( -3.925 -12.813 8.392) 15.811 4.621 ( 7.811 9.513 3.062) 12.684 4.962 ( -3.168 0.492 3.752) 4.935 5.209 ( -5.535 2.123 7.683) 9.704 5.400 ( 0.666 -4.038 17.835) 18.298 5.608 ( -3.862 9.123 -1.277) 9.989 5.729 ( -9.167 7.319 13.184) 17.647 5.824 ( -5.907 -3.545 25.419) 26.336 5.942 ( 1.016 -3.689 6.748) 7.758 6.212 ( -5.660 3.775 27.844) 28.663 6.348 ( -8.177 1.303 19.710) 21.378 6.404 ( 9.229 1.872 10.857) 14.372 6.420 ( 2.381 8.868 2.110) 9.421 6.638 ( 2.251 -4.708 5.810) 7.810 6.820 ( -4.643 8.646 22.244) 24.313 6.981 ( -9.649 2.560 22.621) 24.726 7.218 ( 9.170 0.419 6.817) 11.434 7.337 ( -0.909 12.271 1.140) 12.357 7.374 ( 2.617 -2.861 2.080) 4.400 7.407 ( -2.796 -3.910 2.720) 5.523 7.553 ( -0.951 5.919 -9.869) 11.547 7.673 ( -0.464 -3.622 2.479) 4.413 7.816 ( 1.262 3.835 0.245) 4.045 7.960 ( 2.403 -3.533 -3.685) 5.642 8.105 ( 1.654 -7.429 5.868) 9.610 8.217 ( -1.320 -1.131 -3.677) 4.067 8.313 ( -2.732 5.914 -0.985) 6.589 8.452 ( -1.565 1.202 -2.097) 2.879 8.473 ( -0.358 4.305 -1.707) 4.645 8.568 ( 1.042 2.213 1.968) 3.139 8.662 ( 5.351 0.798 -3.317) 6.346 8.774 ( -2.480 -6.052 -0.745) 6.583 8.880 ( 1.994 -3.085 -4.097) 5.503 9.036 ( 2.018 -2.418 -10.982) 11.424 9.121 ( -5.429 -0.430 -6.260) 8.297 9.352 ( 1.698 -1.569 -10.787) 11.032 9.443 ( -0.268 -5.613 -7.773) 9.592 9.468 ( -6.230 -6.942 -2.600) 9.683 9.606 ( -2.530 3.021 -4.237) 5.786 9.712 ( 1.746 -6.022 -11.895) 13.446 9.937 ( -1.022 -7.140 -2.517) 7.639 10.074 ( 3.681 4.740 -10.337) 11.952 10.189 ( -0.557 -0.541 -4.129) 4.201 10.363 ( 4.397 4.456 -4.306) 7.598 10.516 ( 3.259 0.353 0.610) 3.334 10.669 ( -1.265 -2.448 0.310) 2.772 10.749 ( 1.679 -2.353 -1.354) 3.192 10.753 ( 0.578 -0.805 1.207) 1.561 10.951 ( 2.387 -7.042 1.033) 7.507 11.089 ( 0.906 5.126 -5.977) 7.926 11.181 ( -0.788 2.237 -8.432) 8.759 11.550 ( -1.237 -2.169 -1.193) 2.767 11.566 ( -2.472 -1.215 3.656) 4.577 11.854 ( 3.529 3.049 -3.277) 5.700 12.049 ( 2.218 -6.113 -4.903) 8.145 12.218 ( -3.687 4.736 6.365) 8.748 12.269 ( -1.152 1.426 5.971) 6.246 12.750 ( -5.332 2.944 -0.279) 6.096 12.821 ( -9.944 1.090 11.424) 15.185 12.959 ( 5.821 0.176 -5.974) 8.343 13.199 ( -3.553 -5.543 5.245) 8.418 13.256 ( 10.022 -2.844 -6.168) 12.106 13.374 ( 6.919 -5.470 -9.613) 13.046 13.737 ( -1.922 2.586 1.447) 3.532 13.903 ( -2.947 -2.080 2.479) 4.377 14.440 ( 8.878 2.457 9.175) 13.002 14.555 ( 8.372 1.791 -12.192) 14.898 14.718 ( 9.762 -9.061 8.956) 16.050 14.799 ( 0.609 -5.202 -4.248) 6.744 15.472 ( -10.595 3.040 0.364) 11.028 15.512 ( -10.808 0.994 -7.278) 13.068 15.871 ( -6.770 1.674 20.156) 21.328 16.001 ( 4.703 -2.133 11.271) 12.398 16.083 ( 6.691 1.990 -7.089) 9.949 16.163 ( -2.402 3.116 -5.156) 6.486 16.445 ( -6.041 1.237 5.918) 8.547 16.681 ( 7.571 6.049 1.780) 9.853 16.814 ( -5.276 -5.556 3.059) 8.250 16.937 ( -5.660 -0.704 4.126) 7.040 18.719 ( -7.178 7.523 20.645) 23.115 19.038 ( -5.890 -7.911 10.800) 14.626 19.857 ( -3.387 -1.514 11.154) 11.755 19.895 ( -0.953 -4.316 16.290) 16.879 21.408 ( 8.895 7.610 -36.227) 38.072 21.602 ( 3.108 -2.483 -29.988) 30.251 21.822 ( 6.543 4.657 -29.375) 30.453 21.993 ( 4.338 -3.829 -25.592) 26.238 25.270 ( 1.830 2.437 7.185) 7.804 25.379 ( 1.132 -2.906 8.277) 8.845 25.844 ( -2.721 1.535 10.848) 11.289 25.948 ( -4.896 -3.511 13.353) 14.649 26.255 ( 9.756 4.494 -14.118) 17.739 26.442 ( 13.015 -4.701 -19.021) 23.522 26.825 ( -3.290 4.288 -13.369) 14.420 27.044 ( -3.379 -6.775 -18.537) 20.023 28.605 ( 2.467 0.679 -0.366) 2.585 28.639 ( 2.622 -0.807 1.220) 3.003 28.809 ( -2.893 5.240 -3.288) 6.829 28.938 ( -0.038 -1.764 -1.760) 2.492 29.601 ( 1.256 11.933 0.287) 12.003 29.987 ( -3.474 -8.214 8.403) 12.253 30.197 ( -3.768 4.205 0.695) 5.688 30.386 ( 6.530 -4.138 6.513) 10.109 31.016 ( -2.979 -0.252 7.844) 8.394 31.154 ( -3.999 -6.076 13.472) 15.310 31.473 ( -9.694 2.065 12.215) 15.730 31.576 ( -3.611 2.854 5.927) 7.504 31.722 ( 0.180 -1.921 5.348) 5.685 31.864 ( -7.360 -1.639 -1.996) 7.800 32.068 ( 5.404 6.592 -7.096) 11.091 32.241 ( 9.288 -1.028 1.021) 9.401 ======================= Grid point 118 (66/104) ======================= q-point: (-0.40 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.687 ( -7.459 16.297 9.095) 20.098 3.028 ( -11.051 16.104 5.435) 20.273 3.228 ( -21.627 26.398 18.199) 38.676 3.483 ( 1.966 -10.933 8.347) 13.895 3.623 ( 6.165 0.294 2.339) 6.601 3.698 ( -1.279 -8.094 0.355) 8.202 3.897 ( -2.114 -9.650 0.344) 9.884 4.014 ( 0.805 6.270 7.153) 9.546 4.407 ( 6.654 -3.101 16.573) 18.126 4.481 ( 0.985 -10.149 10.023) 14.298 4.900 ( 2.560 6.039 5.067) 8.288 5.031 ( 8.260 2.319 -0.322) 8.586 5.096 ( 3.190 5.674 4.781) 8.076 5.419 ( -1.697 -2.951 1.816) 3.858 5.566 ( -2.857 4.700 3.641) 6.596 5.613 ( -10.987 5.763 22.167) 25.403 5.855 ( -4.392 -6.235 23.839) 25.029 5.916 ( -4.654 -2.239 24.307) 24.849 6.207 ( -6.071 -1.710 30.037) 30.692 6.247 ( -10.385 -4.910 23.360) 26.032 6.490 ( 1.687 2.883 0.477) 3.374 6.662 ( -4.470 8.973 10.816) 14.747 6.698 ( 9.653 1.266 4.189) 10.598 6.725 ( -12.397 5.125 29.972) 32.837 6.829 ( -7.840 -2.627 6.101) 10.276 7.181 ( -8.271 0.687 6.318) 10.431 7.315 ( -3.612 5.914 -2.618) 7.408 7.417 ( -2.166 3.176 -7.682) 8.590 7.460 ( 2.286 5.193 10.610) 12.032 7.563 ( 7.710 -0.589 3.778) 8.606 7.666 ( -1.135 -2.223 -1.226) 2.781 7.843 ( -0.637 0.750 -1.153) 1.516 7.905 ( -2.543 0.753 -6.921) 7.411 8.139 ( -3.612 -7.509 -0.727) 8.364 8.175 ( -6.727 1.634 -0.835) 6.973 8.188 ( 1.828 1.280 -3.173) 3.879 8.398 ( -1.192 4.966 -1.875) 5.440 8.475 ( -0.551 2.753 -1.760) 3.314 8.618 ( 5.308 -1.430 -0.669) 5.538 8.722 ( -2.415 -4.717 1.021) 5.397 8.791 ( 5.502 3.038 -0.665) 6.320 8.944 ( 0.915 3.062 -5.407) 6.281 9.005 ( 1.979 -6.451 -6.311) 9.239 9.065 ( 3.147 -0.308 -4.794) 5.743 9.257 ( -5.203 -6.044 -8.237) 11.465 9.374 ( 0.612 -7.185 -6.557) 9.747 9.436 ( -0.039 -5.673 -6.310) 8.485 9.510 ( -5.566 -3.387 -9.678) 11.667 9.593 ( 2.219 2.882 -5.185) 6.334 9.787 ( -7.019 -5.773 -2.867) 9.530 10.191 ( 8.575 7.453 -10.066) 15.179 10.284 ( 5.449 6.066 1.250) 8.249 10.468 ( 4.432 -2.900 -5.328) 7.512 10.538 ( 1.215 0.057 -5.955) 6.078 10.701 ( 4.756 -0.529 0.603) 4.823 10.735 ( 0.240 4.901 -3.227) 5.873 10.902 ( 5.295 -5.570 3.539) 8.461 10.993 ( 2.266 -7.850 -4.095) 9.139 11.045 ( -2.014 2.199 -7.846) 8.394 11.202 ( 6.126 -2.179 -4.087) 7.680 11.559 ( 1.550 -0.438 2.505) 2.978 11.582 ( 3.928 -0.681 1.287) 4.189 11.900 ( -1.785 1.674 -2.635) 3.596 11.988 ( -4.126 -2.014 -1.841) 4.946 12.162 ( -2.408 4.682 5.819) 7.847 12.308 ( 0.787 -1.737 6.337) 6.618 12.576 ( -8.811 -1.253 3.974) 9.747 12.703 ( -3.598 -4.107 0.593) 5.493 13.123 ( 6.815 0.708 1.147) 6.947 13.151 ( 0.318 3.905 -2.528) 4.663 13.407 ( 5.319 -4.380 -4.364) 8.156 13.512 ( 8.198 -6.825 -4.489) 11.573 13.672 ( -2.533 1.362 -4.356) 5.219 13.886 ( -1.575 -6.579 6.567) 9.428 14.636 ( 4.705 3.461 -3.048) 6.589 14.704 ( 10.133 9.169 -4.096) 14.266 14.762 ( 1.423 0.504 -4.071) 4.342 14.994 ( 2.035 0.383 1.744) 2.707 15.210 ( -11.366 2.633 -9.316) 14.930 15.374 ( 6.179 -8.333 3.533) 10.959 15.866 ( -1.830 8.762 17.382) 19.551 16.000 ( -9.215 5.553 7.461) 13.092 16.145 ( 4.800 1.509 0.538) 5.060 16.226 ( 7.439 0.198 -6.233) 9.708 16.396 ( -2.860 -5.484 2.886) 6.825 16.672 ( -8.242 -13.314 7.827) 17.506 16.807 ( 3.160 -2.570 3.495) 5.367 16.891 ( -0.172 2.588 4.903) 5.547 18.750 ( 0.796 6.339 25.144) 25.943 18.997 ( -2.031 -6.230 9.570) 11.598 19.823 ( -4.595 0.842 11.410) 12.330 19.934 ( -2.615 -4.948 16.749) 17.659 21.453 ( 10.424 5.984 -34.845) 36.860 21.523 ( 3.392 2.250 -32.639) 32.892 21.848 ( 8.198 1.472 -28.782) 29.963 21.961 ( 3.839 -3.846 -25.810) 26.376 25.356 ( 1.826 1.864 10.347) 10.671 25.426 ( -1.058 -1.486 10.393) 10.552 25.836 ( -2.410 0.816 9.503) 9.837 25.889 ( -5.129 -1.760 10.539) 11.852 26.078 ( -14.419 3.371 -14.700) 20.865 26.266 ( -17.115 -5.861 -18.965) 26.210 26.944 ( 14.611 2.341 -11.598) 18.801 27.101 ( 13.237 -4.997 -18.660) 23.418 28.616 ( -2.257 4.705 0.247) 5.224 28.731 ( 4.299 -1.717 2.694) 5.356 28.779 ( 2.783 1.964 -3.593) 4.951 28.915 ( -0.813 -3.640 -4.498) 5.843 29.573 ( -3.720 7.589 0.810) 8.491 29.888 ( -8.536 -7.654 7.933) 13.943 30.195 ( 3.834 15.217 -3.513) 16.081 30.563 ( 5.557 -3.362 11.313) 13.045 30.912 ( -9.986 1.517 8.373) 13.120 31.083 ( -10.448 -6.264 12.804) 17.673 31.257 ( -8.120 2.197 6.270) 10.492 31.370 ( -10.386 -2.223 8.676) 13.714 31.759 ( -0.049 -0.842 4.441) 4.520 31.811 ( -2.225 -2.684 10.496) 11.060 32.286 ( 14.991 8.902 -12.119) 21.233 32.569 ( 17.198 -4.789 -3.778) 18.248 ======================= Grid point 119 (67/104) ======================= q-point: (-0.20 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.546 ( -9.550 21.265 15.133) 27.792 2.850 ( -7.131 13.083 2.627) 15.130 2.977 ( -9.450 24.760 29.574) 39.711 3.481 ( -5.155 -13.231 7.799) 16.201 3.604 ( -0.325 -13.975 -6.395) 15.372 3.783 ( -2.730 -6.658 11.995) 13.988 3.885 ( 4.561 4.187 1.220) 6.310 4.148 ( 6.706 6.781 5.229) 10.877 4.482 ( -2.074 0.501 2.308) 3.143 4.664 ( 6.013 -5.804 15.049) 17.213 4.887 ( 0.270 5.276 6.556) 8.420 5.098 ( -3.563 -4.315 1.638) 5.831 5.242 ( 1.322 0.485 2.545) 2.909 5.362 ( -6.692 2.323 14.748) 16.361 5.502 ( -6.961 -1.242 20.365) 21.558 5.590 ( 4.722 15.392 7.348) 17.698 5.861 ( -4.466 -8.628 20.451) 22.641 5.964 ( -1.943 -4.707 13.362) 14.300 6.127 ( -10.095 -0.425 32.036) 33.592 6.259 ( -1.834 -4.623 25.697) 26.174 6.414 ( -9.937 -0.571 13.752) 16.976 6.511 ( -14.536 -0.012 24.437) 28.433 6.619 ( -2.783 7.376 3.037) 8.448 6.714 ( -3.509 0.578 -0.208) 3.562 6.851 ( -0.446 3.576 5.239) 6.358 7.097 ( -3.091 1.266 -0.347) 3.358 7.240 ( 0.701 8.013 3.435) 8.747 7.377 ( 2.621 -1.892 -8.884) 9.453 7.567 ( -1.295 1.143 13.339) 13.450 7.589 ( -1.357 6.830 -6.175) 9.308 7.661 ( -0.527 3.301 1.997) 3.894 7.766 ( -6.431 1.218 2.427) 6.981 7.896 ( 4.443 -0.322 -5.490) 7.070 8.041 ( -3.642 -7.647 -1.162) 8.549 8.077 ( -0.901 3.348 -0.848) 3.570 8.200 ( 1.202 0.819 -3.422) 3.718 8.360 ( -2.729 7.843 -6.320) 10.436 8.430 ( -0.258 4.287 -4.736) 6.393 8.691 ( 0.358 -3.550 0.991) 3.704 8.763 ( 5.964 -2.046 -1.222) 6.422 8.837 ( -1.431 2.456 -2.519) 3.798 8.917 ( 2.940 -0.308 -6.686) 7.310 9.039 ( 0.230 -1.453 0.486) 1.549 9.145 ( 2.691 -3.954 -3.865) 6.149 9.166 ( 1.760 -5.525 -9.487) 11.119 9.308 ( -0.736 -7.930 -12.419) 14.754 9.407 ( 2.143 -6.592 -4.294) 8.154 9.425 ( 1.028 -5.744 -4.863) 7.596 9.719 ( 7.123 -0.539 -0.724) 7.180 9.760 ( 3.378 -3.048 0.170) 4.553 10.303 ( 5.390 8.526 -9.799) 14.062 10.379 ( 3.047 6.523 0.463) 7.215 10.470 ( -0.722 -0.998 1.425) 1.884 10.584 ( 3.958 0.842 -5.780) 7.056 10.705 ( -1.785 -2.486 -3.001) 4.286 10.775 ( 2.111 -1.541 -1.966) 3.270 10.909 ( -4.678 -0.456 -0.479) 4.725 11.009 ( -1.756 -2.410 -0.354) 3.003 11.037 ( 4.516 1.278 -5.760) 7.430 11.282 ( 3.190 -3.160 -7.220) 8.502 11.637 ( 2.674 0.962 2.153) 3.566 11.708 ( 2.643 -2.770 2.520) 4.584 11.812 ( 1.313 0.858 -0.197) 1.581 11.901 ( -4.562 -5.831 2.751) 7.899 12.147 ( -0.243 4.522 3.447) 5.691 12.323 ( -3.310 -2.570 5.095) 6.597 12.513 ( 3.198 2.066 -5.323) 6.544 12.635 ( -0.934 -3.713 -4.436) 5.860 13.126 ( -0.597 8.487 -0.037) 8.508 13.263 ( 3.676 2.787 -3.165) 5.595 13.464 ( 1.571 -1.519 -2.662) 3.444 13.572 ( -2.751 -0.145 -0.187) 2.761 13.679 ( 4.954 -10.011 -1.165) 11.230 13.877 ( -2.828 -12.445 12.903) 18.149 14.520 ( -13.420 6.717 -8.660) 17.326 14.612 ( -11.521 7.143 -2.520) 13.788 14.804 ( 2.556 3.512 -13.370) 14.059 14.966 ( 0.495 -3.242 -7.376) 8.072 15.293 ( 18.648 7.020 4.291) 20.382 15.613 ( 9.768 -6.104 0.465) 11.528 15.864 ( -5.943 0.307 12.909) 14.214 15.961 ( 2.079 15.080 13.055) 20.054 16.148 ( -4.071 0.940 -2.053) 4.655 16.274 ( -7.306 -4.098 -4.053) 9.306 16.303 ( 0.269 -3.257 -0.466) 3.302 16.657 ( 4.048 -10.758 2.100) 11.685 16.853 ( -0.407 -6.046 5.208) 7.990 16.964 ( 3.816 -3.598 5.404) 7.531 18.897 ( 1.039 2.512 11.760) 12.070 19.090 ( 4.911 -6.778 22.260) 23.782 19.775 ( -4.774 2.435 14.116) 15.099 19.934 ( -4.710 -5.389 17.802) 19.187 21.458 ( 5.413 6.359 -35.045) 36.026 21.534 ( 11.005 3.652 -32.935) 34.917 21.895 ( 7.062 -1.036 -27.060) 27.985 21.934 ( 5.628 -2.852 -26.538) 27.278 25.417 ( -0.617 1.371 8.707) 8.836 25.429 ( -2.636 0.543 8.549) 8.963 25.701 ( -11.804 -0.886 -8.967) 14.851 25.719 ( -14.019 -2.274 -6.063) 15.442 25.873 ( -1.354 1.510 9.409) 9.625 25.908 ( -4.254 0.100 7.315) 8.462 27.167 ( 9.585 0.930 -11.911) 15.317 27.273 ( 10.237 -3.238 -21.387) 23.930 28.557 ( -1.927 7.391 -1.292) 7.746 28.823 ( 1.004 -5.308 -0.478) 5.423 28.839 ( 2.546 0.079 -3.305) 4.172 28.863 ( 0.367 -1.085 -3.245) 3.441 29.532 ( 1.299 3.895 2.570) 4.844 29.721 ( -9.342 -4.875 6.238) 12.245 30.270 ( 3.767 19.788 -7.500) 21.494 30.651 ( -4.278 0.609 14.486) 15.117 30.829 ( -7.652 -2.746 7.157) 10.831 30.866 ( -2.457 -3.298 20.190) 20.605 31.208 ( -0.804 -0.321 5.384) 5.453 31.294 ( -3.687 -4.046 12.467) 13.616 31.768 ( -0.970 -0.630 5.258) 5.384 31.829 ( -0.796 -2.922 11.539) 11.929 32.475 ( 7.507 9.625 -16.568) 20.579 32.821 ( 7.718 -7.281 -10.845) 15.172 ======================= Grid point 120 (68/104) ======================= q-point: ( 0.00 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.873 ( -0.371 -10.859 7.726) 13.333 2.873 ( -0.371 10.859 7.726) 13.333 3.156 ( -5.285 -1.873 5.260) 7.688 3.156 ( -5.285 1.873 5.260) 7.688 3.514 ( 0.659 -13.974 11.895) 18.363 3.514 ( 0.659 13.974 11.895) 18.363 4.122 ( -2.101 -9.288 10.299) 14.026 4.122 ( -2.101 9.288 10.299) 14.026 4.619 ( -3.664 -7.963 -5.052) 10.117 4.619 ( -3.664 7.963 -5.052) 10.117 4.999 ( -0.474 -4.708 1.521) 4.971 4.999 ( -0.474 4.708 1.521) 4.971 5.266 ( -7.613 -8.454 30.659) 32.702 5.266 ( -7.613 8.454 30.659) 32.702 5.620 ( -0.684 -11.411 7.345) 13.587 5.620 ( -0.684 11.411 7.345) 13.587 5.924 ( -0.765 -4.858 12.991) 13.890 5.924 ( -0.765 4.858 12.991) 13.890 6.164 ( -3.548 -7.952 13.560) 16.115 6.164 ( -3.548 7.952 13.560) 16.115 6.382 ( -2.402 -1.049 24.018) 24.160 6.382 ( -2.402 1.049 24.018) 24.160 6.690 ( 0.818 -4.195 6.033) 7.393 6.690 ( 0.818 4.195 6.033) 7.393 6.954 ( -5.716 -4.500 3.525) 8.084 6.954 ( -5.716 4.500 3.525) 8.084 7.393 ( 4.422 -6.157 7.061) 10.360 7.393 ( 4.422 6.157 7.061) 10.360 7.605 ( -4.588 -3.694 4.758) 7.572 7.605 ( -4.588 3.694 4.758) 7.572 7.729 ( 0.436 -5.348 -0.462) 5.385 7.729 ( 0.436 5.348 -0.462) 5.385 7.885 ( 0.063 -3.091 -3.441) 4.626 7.885 ( 0.063 3.091 -3.441) 4.626 8.204 ( 4.727 -5.203 -4.405) 8.296 8.204 ( 4.727 5.203 -4.405) 8.296 8.445 ( 0.296 -7.845 -7.227) 10.671 8.445 ( 0.296 7.845 -7.227) 10.671 8.677 ( -0.148 -7.726 -0.151) 7.729 8.677 ( -0.148 7.726 -0.151) 7.729 8.867 ( -2.459 -3.141 -2.526) 4.721 8.867 ( -2.459 3.141 -2.526) 4.721 9.076 ( 3.185 -1.594 -6.656) 7.549 9.076 ( 3.185 1.594 -6.656) 7.549 9.206 ( 5.639 -2.232 -7.188) 9.405 9.206 ( 5.639 2.232 -7.188) 9.405 9.421 ( 5.597 -0.737 -3.664) 6.731 9.421 ( 5.597 0.737 -3.664) 6.731 9.780 ( -0.027 -1.217 -1.673) 2.069 9.780 ( -0.027 1.217 -1.673) 2.069 10.427 ( -0.015 -3.195 -4.368) 5.412 10.427 ( -0.015 3.195 -4.368) 5.412 10.557 ( -0.106 -4.259 -0.339) 4.274 10.557 ( -0.106 4.259 -0.339) 4.274 10.675 ( -2.503 -3.010 0.847) 4.006 10.675 ( -2.503 3.010 0.847) 4.006 10.858 ( -4.755 -3.339 -0.325) 5.820 10.858 ( -4.755 3.339 -0.325) 5.820 11.199 ( 3.012 -6.554 -10.337) 12.605 11.199 ( 3.012 6.554 -10.337) 12.605 11.628 ( -3.239 -2.135 1.036) 4.015 11.628 ( -3.239 2.135 1.036) 4.015 11.909 ( 3.354 -2.609 3.833) 5.723 11.909 ( 3.354 2.609 3.833) 5.723 12.222 ( 0.507 -2.218 -0.239) 2.288 12.222 ( 0.507 2.218 -0.239) 2.288 12.663 ( 9.104 -0.599 -10.959) 14.260 12.663 ( 9.104 0.599 -10.959) 14.260 13.228 ( -2.682 -5.865 -3.446) 7.312 13.228 ( -2.682 5.865 -3.446) 7.312 13.443 ( -10.541 -2.543 6.979) 12.895 13.443 ( -10.541 2.543 6.979) 12.895 13.717 ( 4.457 -6.233 10.910) 13.332 13.717 ( 4.457 6.233 10.910) 13.332 14.333 ( -9.639 -7.403 -7.007) 14.029 14.333 ( -9.639 7.403 -7.007) 14.029 14.838 ( -2.045 -5.866 -9.070) 10.993 14.838 ( -2.045 5.866 -9.070) 10.993 15.744 ( 7.613 -1.948 0.284) 7.864 15.744 ( 7.613 1.948 0.284) 7.864 15.855 ( -5.977 -5.747 15.906) 17.937 15.855 ( -5.977 5.747 15.906) 17.937 16.103 ( -4.851 -0.774 -3.152) 5.837 16.103 ( -4.851 0.774 -3.152) 5.837 16.546 ( 8.319 -14.316 -0.258) 16.559 16.546 ( 8.319 14.316 -0.258) 16.559 16.917 ( -0.171 -7.456 -0.113) 7.458 16.917 ( -0.171 7.456 -0.113) 7.458 19.040 ( -3.736 -9.236 17.234) 19.906 19.040 ( -3.736 9.236 17.234) 19.906 19.816 ( -4.191 -3.924 16.422) 17.397 19.816 ( -4.191 3.924 16.422) 17.397 21.559 ( 6.868 -5.727 -32.703) 33.904 21.559 ( 6.868 5.727 -32.703) 33.904 21.915 ( 6.919 -3.258 -27.433) 28.479 21.915 ( 6.919 3.258 -27.433) 28.479 25.347 ( -6.593 -1.262 1.630) 6.907 25.347 ( -6.593 1.262 1.630) 6.907 25.640 ( 9.561 -1.181 -1.484) 9.748 25.640 ( 9.561 1.181 -1.484) 9.748 25.928 ( -0.564 -0.812 11.747) 11.789 25.928 ( -0.564 0.812 11.747) 11.789 27.264 ( 2.195 -3.548 -17.539) 18.029 27.264 ( 2.195 3.548 -17.539) 18.029 28.651 ( -1.826 -5.010 -3.960) 6.642 28.651 ( -1.826 5.010 -3.960) 6.642 28.891 ( 1.760 -0.342 0.006) 1.793 28.891 ( 1.760 0.342 0.006) 1.793 29.624 ( 2.701 -2.483 3.671) 5.190 29.624 ( 2.701 2.483 3.671) 5.190 30.430 ( -8.127 -6.651 1.600) 10.623 30.430 ( -8.127 6.651 1.600) 10.623 30.946 ( 4.874 -6.771 16.606) 18.584 30.946 ( 4.874 6.771 16.606) 18.584 31.246 ( 1.276 -3.200 9.209) 9.832 31.246 ( 1.276 3.200 9.209) 9.832 31.809 ( -0.570 -3.281 9.301) 9.879 31.809 ( -0.570 3.281 9.301) 9.879 32.611 ( -5.424 -9.205 -16.148) 19.363 32.611 ( -5.424 9.205 -16.148) 19.363 ======================= Grid point 122 (69/104) ======================= q-point: ( 0.20 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.983 ( 4.627 -14.201 8.249) 17.062 2.983 ( 4.627 14.201 8.249) 17.062 3.129 ( 2.512 -10.962 6.838) 13.162 3.129 ( 2.512 10.962 6.838) 13.162 3.668 ( 6.803 -6.586 10.824) 14.381 3.668 ( 6.803 6.586 10.824) 14.381 4.069 ( -4.548 -9.855 8.694) 13.907 4.069 ( -4.548 9.855 8.694) 13.907 4.422 ( -13.585 -5.887 -0.100) 14.806 4.422 ( -13.585 5.887 -0.100) 14.806 4.913 ( -5.915 -12.787 -2.380) 14.288 4.913 ( -5.915 12.787 -2.380) 14.288 5.254 ( -5.213 -8.933 30.629) 32.328 5.254 ( -5.213 8.933 30.629) 32.328 5.700 ( 2.928 -6.892 5.864) 9.510 5.700 ( 2.928 6.892 5.864) 9.510 5.927 ( -3.785 -0.622 7.182) 8.143 5.927 ( -3.785 0.622 7.182) 8.143 6.227 ( 3.365 -9.586 14.376) 17.604 6.227 ( 3.365 9.586 14.376) 17.604 6.401 ( -6.204 -3.240 24.823) 25.791 6.401 ( -6.204 3.240 24.823) 25.791 6.827 ( 1.069 -8.590 3.975) 9.525 6.827 ( 1.069 8.590 3.975) 9.525 6.898 ( 5.549 -5.567 8.035) 11.240 6.898 ( 5.549 5.567 8.035) 11.240 7.409 ( -7.504 -1.399 10.552) 13.024 7.409 ( -7.504 1.399 10.552) 13.024 7.580 ( 1.878 -6.036 0.510) 6.342 7.580 ( 1.878 6.036 0.510) 6.342 7.749 ( 1.445 -10.729 -3.316) 11.322 7.749 ( 1.445 10.729 -3.316) 11.322 7.880 ( 0.430 -5.455 3.313) 6.397 7.880 ( 0.430 5.455 3.313) 6.397 8.347 ( 7.699 -7.533 -6.160) 12.408 8.347 ( 7.699 7.533 -6.160) 12.408 8.430 ( 3.202 -8.242 -5.581) 10.456 8.430 ( 3.202 8.242 -5.581) 10.456 8.617 ( -5.683 -8.580 0.056) 10.292 8.617 ( -5.683 8.580 0.056) 10.292 8.814 ( -1.154 -4.294 -0.578) 4.484 8.814 ( -1.154 4.294 -0.578) 4.484 9.091 ( -0.642 -6.476 -5.544) 8.549 9.091 ( -0.642 6.476 -5.544) 8.549 9.332 ( 8.439 -1.471 -6.902) 11.000 9.332 ( 8.439 1.471 -6.902) 11.000 9.512 ( 4.014 -1.631 -6.728) 8.003 9.512 ( 4.014 1.631 -6.728) 8.003 9.756 ( 1.024 -4.355 -4.964) 6.683 9.756 ( 1.024 4.355 -4.964) 6.683 10.303 ( -10.003 -7.461 -4.791) 13.367 10.303 ( -10.003 7.461 -4.791) 13.367 10.522 ( -3.600 -5.098 4.334) 7.598 10.522 ( -3.600 5.098 4.334) 7.598 10.600 ( -0.724 -3.272 -2.437) 4.144 10.600 ( -0.724 3.272 -2.437) 4.144 10.829 ( 0.839 -2.020 -0.153) 2.193 10.829 ( 0.839 2.020 -0.153) 2.193 11.214 ( 2.668 -4.602 -11.252) 12.446 11.214 ( 2.668 4.602 -11.252) 12.446 11.579 ( -2.220 -0.925 0.588) 2.476 11.579 ( -2.220 0.925 0.588) 2.476 11.921 ( -1.377 -3.518 -0.334) 3.793 11.921 ( -1.377 3.518 -0.334) 3.793 12.261 ( 1.816 -2.993 0.664) 3.563 12.261 ( 1.816 2.993 0.664) 3.563 12.828 ( 9.022 -3.433 -7.003) 11.925 12.828 ( 9.022 3.433 -7.003) 11.925 13.133 ( -9.073 -9.601 1.862) 13.341 13.133 ( -9.073 9.601 1.862) 13.341 13.240 ( -4.569 -3.850 2.340) 6.417 13.240 ( -4.569 3.850 2.340) 6.417 13.822 ( 0.575 -7.623 7.238) 10.527 13.822 ( 0.575 7.623 7.238) 10.527 14.276 ( 5.599 -6.959 1.867) 9.125 14.276 ( 5.599 6.959 1.867) 9.125 14.731 ( -3.569 -7.560 -5.867) 10.213 14.731 ( -3.569 7.560 -5.867) 10.213 15.730 ( -7.061 -0.351 -0.512) 7.088 15.730 ( -7.061 0.351 -0.512) 7.088 15.859 ( -1.304 -2.856 14.259) 14.601 15.859 ( -1.304 2.856 14.259) 14.601 16.069 ( 2.844 -2.605 -2.328) 4.505 16.069 ( 2.844 2.605 -2.328) 4.505 16.674 ( 4.020 -7.504 -8.210) 11.827 16.674 ( 4.020 7.504 -8.210) 11.827 16.879 ( -3.424 -9.308 4.598) 10.932 16.879 ( -3.424 9.308 4.598) 10.932 18.975 ( -9.075 -9.427 18.835) 22.934 18.975 ( -9.075 9.427 18.835) 22.934 19.820 ( -2.031 -1.679 14.156) 14.399 19.820 ( -2.031 1.679 14.156) 14.399 21.546 ( 6.126 -6.691 -32.709) 33.944 21.546 ( 6.126 6.691 -32.709) 33.944 21.926 ( 5.711 -4.687 -27.325) 28.306 21.926 ( 5.711 4.687 -27.325) 28.306 25.281 ( -0.886 -2.604 3.707) 4.616 25.281 ( -0.886 2.604 3.707) 4.616 25.873 ( 3.402 -3.214 8.207) 9.448 25.873 ( 3.402 3.214 8.207) 9.448 26.038 ( 14.233 -2.756 -3.335) 14.876 26.038 ( 14.233 2.756 -3.335) 14.876 27.145 ( -5.536 -5.133 -17.843) 19.375 27.145 ( -5.536 5.133 -17.843) 19.375 28.605 ( -0.561 -1.771 -2.101) 2.805 28.605 ( -0.561 1.771 -2.101) 2.805 28.915 ( 0.243 -1.401 -0.500) 1.507 28.915 ( 0.243 1.401 -0.500) 1.507 29.741 ( 5.398 -9.759 3.182) 11.598 29.741 ( 5.398 9.759 3.182) 11.598 30.298 ( -4.660 -1.689 2.870) 5.727 30.298 ( -4.660 1.689 2.870) 5.727 31.055 ( -1.314 -5.000 13.937) 14.864 31.055 ( -1.314 5.000 13.937) 14.864 31.407 ( 8.055 -5.460 12.456) 15.807 31.407 ( 8.055 5.460 12.456) 15.807 31.834 ( -0.329 -5.409 4.727) 7.191 31.834 ( -0.329 5.409 4.727) 7.191 32.329 ( -12.600 -6.335 -12.277) 18.698 32.329 ( -12.600 6.335 -12.277) 18.698 ======================= Grid point 124 (70/104) ======================= q-point: (-0.60 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.050 ( 0.413 -18.187 2.298) 18.336 3.050 ( 0.413 18.187 2.298) 18.336 3.344 ( 9.034 -7.572 15.796) 19.709 3.344 ( 9.034 7.572 15.796) 19.709 3.740 ( -2.323 -7.508 -2.336) 8.199 3.740 ( -2.323 7.508 -2.336) 8.199 4.022 ( -14.809 -12.730 10.514) 22.179 4.022 ( -14.809 12.730 10.514) 22.179 4.222 ( 4.097 -8.520 11.570) 14.941 4.222 ( 4.097 8.520 11.570) 14.941 4.829 ( 2.424 -11.754 -4.381) 12.776 4.829 ( 2.424 11.754 -4.381) 12.776 5.302 ( -3.040 -6.743 19.238) 20.611 5.302 ( -3.040 6.743 19.238) 20.611 5.726 ( -3.081 -5.686 6.033) 8.844 5.726 ( -3.081 5.686 6.033) 8.844 5.860 ( -5.481 -5.546 13.638) 15.710 5.860 ( -5.481 5.546 13.638) 15.710 6.296 ( -10.403 -4.582 38.078) 39.739 6.296 ( -10.403 4.582 38.078) 39.739 6.485 ( 8.384 -4.529 3.795) 10.257 6.485 ( 8.384 4.529 3.795) 10.257 6.731 ( -3.337 -13.613 -4.588) 14.748 6.731 ( -3.337 13.613 -4.588) 14.748 7.164 ( 1.424 -12.130 15.763) 19.941 7.164 ( 1.424 12.130 15.763) 19.941 7.303 ( -2.799 -2.718 12.834) 13.414 7.303 ( -2.799 2.718 12.834) 13.414 7.586 ( -0.576 -6.137 0.005) 6.164 7.586 ( -0.576 6.137 0.005) 6.164 7.740 ( -0.204 -12.692 -3.559) 13.183 7.740 ( -0.204 12.692 -3.559) 13.183 7.964 ( 4.326 -6.397 2.761) 8.201 7.964 ( 4.326 6.397 2.761) 8.201 8.302 ( -4.393 -8.442 -6.888) 11.748 8.302 ( -4.393 8.442 -6.888) 11.748 8.475 ( -3.883 -4.664 1.507) 6.254 8.475 ( -3.883 4.664 1.507) 6.254 8.621 ( 6.195 -1.569 -1.820) 6.645 8.621 ( 6.195 1.569 -1.820) 6.645 8.800 ( 0.666 -6.367 1.140) 6.503 8.800 ( 0.666 6.367 1.140) 6.503 9.035 ( -0.449 -3.939 -7.863) 8.806 9.035 ( -0.449 3.939 -7.863) 8.806 9.361 ( -1.629 -2.630 -10.012) 10.480 9.361 ( -1.629 2.630 -10.012) 10.480 9.522 ( -2.418 -9.225 -5.716) 11.119 9.522 ( -2.418 9.225 -5.717) 11.119 9.768 ( 0.094 -9.069 -6.189) 10.980 9.768 ( 0.094 9.069 -6.189) 10.980 10.146 ( 2.667 -3.363 -8.647) 9.654 10.146 ( 2.667 3.363 -8.647) 9.654 10.535 ( 2.749 -10.810 -0.151) 11.155 10.535 ( 2.749 10.810 -0.151) 11.155 10.595 ( 2.235 -6.506 1.362) 7.013 10.595 ( 2.235 6.506 1.362) 7.013 10.840 ( -0.094 -4.546 -0.414) 4.565 10.840 ( -0.094 4.546 -0.414) 4.565 11.177 ( -1.459 -3.099 -9.554) 10.149 11.177 ( -1.459 3.099 -9.554) 10.149 11.543 ( -0.618 -1.453 0.302) 1.607 11.543 ( -0.618 1.453 0.302) 1.607 11.933 ( 3.645 -5.502 -5.268) 8.444 11.933 ( 3.645 5.502 -5.268) 8.444 12.273 ( -2.331 -1.268 6.103) 6.655 12.273 ( -2.331 1.268 6.103) 6.655 12.808 ( -11.832 -3.063 5.206) 13.285 12.808 ( -11.832 3.063 5.206) 13.285 13.040 ( 4.979 -8.119 -0.304) 9.529 13.040 ( 4.979 8.119 -0.304) 9.529 13.288 ( 6.427 -3.752 -6.632) 9.968 13.288 ( 6.427 3.752 -6.632) 9.968 13.815 ( -2.787 -5.577 2.572) 6.744 13.815 ( -2.787 5.577 2.572) 6.744 14.521 ( 12.888 -6.543 7.814) 16.430 14.521 ( 12.888 6.543 7.814) 16.430 14.689 ( 3.249 -5.711 -4.679) 8.067 14.689 ( 3.249 5.711 -4.679) 8.067 15.512 ( -11.511 -1.103 -3.164) 11.989 15.512 ( -11.511 1.103 -3.164) 11.989 15.940 ( 1.331 -4.352 18.598) 19.146 15.940 ( 1.331 4.352 18.598) 19.146 16.132 ( 4.465 -3.776 -6.399) 8.669 16.132 ( 4.465 3.776 -6.399) 8.669 16.585 ( -8.685 -12.075 -3.136) 15.201 16.585 ( -8.685 12.075 -3.136) 15.201 16.869 ( 0.155 -7.022 2.681) 7.519 16.869 ( 0.155 7.022 2.681) 7.519 18.878 ( -7.149 -9.030 19.629) 22.758 18.878 ( -7.149 9.030 19.629) 22.758 19.847 ( -1.530 -0.837 12.630) 12.750 19.847 ( -1.530 0.837 12.630) 12.750 21.530 ( 6.471 -5.291 -32.627) 33.681 21.530 ( 6.471 5.291 -32.627) 33.681 21.912 ( 4.905 -4.785 -27.900) 28.729 21.912 ( 4.905 4.785 -27.900) 28.729 25.322 ( 1.681 -3.080 7.616) 8.385 25.322 ( 1.681 3.080 7.616) 8.385 25.886 ( -3.692 -2.933 11.741) 12.652 25.886 ( -3.692 2.933 11.741) 12.652 26.347 ( 11.071 -5.210 -16.179) 20.285 26.347 ( 11.071 5.210 -16.179) 20.285 26.923 ( -3.938 -6.051 -15.390) 16.999 26.923 ( -3.938 6.051 -15.390) 16.999 28.621 ( 2.383 -1.001 0.271) 2.599 28.621 ( 2.383 1.001 0.271) 2.599 28.891 ( -1.650 -3.439 -2.519) 4.571 28.891 ( -1.650 3.439 -2.519) 4.571 29.811 ( -1.588 -10.509 4.117) 11.398 29.811 ( -1.588 10.509 4.117) 11.398 30.292 ( 3.339 -5.561 3.257) 7.259 30.292 ( 3.339 5.561 3.257) 7.259 31.056 ( -3.830 -4.127 12.145) 13.387 31.056 ( -3.830 4.127 12.145) 13.387 31.530 ( -8.094 -4.160 16.351) 18.713 31.530 ( -8.094 4.160 16.351) 18.713 31.793 ( -2.321 -5.556 -6.176) 8.625 31.793 ( -2.321 5.556 -6.176) 8.625 32.182 ( 7.075 -5.066 -3.551) 9.398 32.182 ( 7.075 5.066 -3.551) 9.398 ======================= Grid point 126 (71/104) ======================= q-point: (-0.40 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.028 ( -3.325 -17.233 1.291) 17.598 3.028 ( -3.325 17.233 1.291) 17.598 3.449 ( -9.833 -8.138 13.469) 18.556 3.449 ( -9.833 8.138 13.469) 18.556 3.677 ( -2.227 -3.583 -5.379) 6.836 3.677 ( -2.227 3.583 -5.379) 6.836 3.842 ( -0.903 -17.740 20.671) 27.255 3.842 ( -0.903 17.740 20.671) 27.255 4.395 ( 7.154 -6.608 4.962) 10.930 4.395 ( 7.154 6.608 4.962) 10.930 5.000 ( 8.391 -4.354 1.945) 9.651 5.000 ( 8.391 4.354 1.945) 9.651 5.252 ( -3.317 -10.014 2.358) 10.810 5.252 ( -3.317 10.014 2.358) 10.810 5.681 ( -5.338 -8.786 13.774) 17.187 5.681 ( -5.338 8.786 13.774) 17.187 5.831 ( -4.002 -8.484 19.019) 21.207 5.831 ( -4.002 8.484 19.019) 21.207 6.200 ( -12.806 -0.698 37.427) 39.564 6.200 ( -12.806 0.698 37.427) 39.564 6.599 ( 1.133 -9.065 -8.540) 12.506 6.599 ( 1.133 9.065 -8.540) 12.506 6.748 ( -0.036 -2.125 14.707) 14.860 6.748 ( -0.036 2.125 14.707) 14.860 6.992 ( -12.580 -15.556 17.807) 26.783 6.992 ( -12.580 15.556 17.807) 26.783 7.424 ( 2.322 -4.424 -0.069) 4.996 7.424 ( 2.322 4.424 -0.069) 4.996 7.566 ( -2.034 -5.435 3.781) 6.926 7.566 ( -2.034 5.435 3.781) 6.926 7.765 ( 2.621 -11.363 2.395) 11.905 7.765 ( 2.621 11.363 2.395) 11.905 7.969 ( -3.654 -7.399 -2.405) 8.595 7.969 ( -3.654 7.399 -2.405) 8.595 8.194 ( -2.290 -3.314 -6.977) 8.056 8.194 ( -2.290 3.314 -6.977) 8.056 8.475 ( 2.418 -3.061 1.406) 4.147 8.475 ( 2.418 3.061 1.406) 4.147 8.633 ( -1.135 -5.704 0.221) 5.820 8.633 ( -1.135 5.704 0.221) 5.820 8.871 ( 3.961 -5.996 -1.260) 7.295 8.871 ( 3.961 5.996 -1.260) 7.295 9.019 ( 1.329 -4.636 -6.063) 7.747 9.019 ( 1.329 4.636 -6.063) 7.747 9.250 ( -2.817 -4.709 -11.411) 12.662 9.250 ( -2.817 4.709 -11.411) 12.662 9.435 ( -1.897 -4.210 -7.451) 8.766 9.435 ( -1.897 4.210 -7.451) 8.766 9.677 ( -2.561 -5.597 -2.927) 6.816 9.677 ( -2.561 5.597 -2.927) 6.816 10.292 ( 10.616 -4.111 -7.597) 13.686 10.292 ( 10.616 4.111 -7.597) 13.686 10.510 ( -1.275 -4.034 -3.915) 5.764 10.510 ( -1.275 4.034 -3.915) 5.764 10.776 ( 4.358 -6.747 0.013) 8.032 10.776 ( 4.358 6.747 0.013) 8.032 10.822 ( 2.635 -4.664 1.401) 5.537 10.822 ( 2.635 4.664 1.401) 5.537 11.134 ( 2.412 -4.996 -8.816) 10.416 11.134 ( 2.412 4.996 -8.816) 10.416 11.567 ( 2.873 -1.061 0.662) 3.134 11.567 ( 2.873 1.061 0.662) 3.134 11.940 ( -2.800 -2.665 -4.912) 6.251 11.940 ( -2.800 2.665 -4.912) 6.251 12.251 ( -1.590 -4.333 8.670) 9.822 12.251 ( -1.590 4.333 8.670) 9.822 12.615 ( -6.562 -4.678 1.987) 8.300 12.615 ( -6.562 4.678 1.987) 8.300 13.168 ( 6.005 -2.459 0.042) 6.489 13.168 ( 6.005 2.459 0.042) 6.489 13.399 ( 6.362 -4.111 -5.509) 9.366 13.399 ( 6.362 4.111 -5.509) 9.366 13.743 ( -4.661 -6.508 1.841) 8.214 13.743 ( -4.661 6.508 1.841) 8.214 14.709 ( 5.825 -3.483 -8.316) 10.734 14.709 ( 5.825 3.483 -8.316) 10.734 14.917 ( 10.529 -8.942 6.305) 15.185 14.917 ( 10.529 8.942 6.305) 15.185 15.257 ( -6.819 -3.664 -3.125) 8.348 15.257 ( -6.819 3.664 -3.125) 8.348 16.053 ( 0.592 -7.860 14.303) 16.331 16.053 ( 0.592 7.860 14.303) 16.331 16.188 ( 2.461 -7.448 -3.819) 8.725 16.188 ( 2.461 7.448 -3.819) 8.725 16.372 ( -8.780 -10.253 4.400) 14.198 16.372 ( -8.780 10.253 4.400) 14.198 16.877 ( 0.105 -4.000 0.499) 4.032 16.877 ( 0.105 4.000 0.499) 4.032 18.875 ( -1.330 -6.818 19.320) 20.531 18.875 ( -1.330 6.818 19.320) 20.531 19.858 ( -3.109 -3.021 13.472) 14.152 19.858 ( -3.109 3.021 13.472) 14.152 21.530 ( 7.452 -1.894 -32.497) 33.394 21.530 ( 7.452 1.894 -32.497) 33.394 21.892 ( 5.469 -3.270 -28.376) 29.082 21.892 ( 5.469 3.270 -28.376) 29.082 25.393 ( 0.580 -2.012 10.416) 10.624 25.393 ( 0.580 2.012 10.416) 10.624 25.858 ( -3.329 -1.493 9.720) 10.382 25.858 ( -3.329 1.493 9.720) 10.382 26.159 ( -16.241 -5.278 -16.055) 23.439 26.159 ( -16.241 5.278 -16.055) 23.439 27.011 ( 14.039 -4.509 -15.149) 21.140 27.011 ( 14.039 4.509 -15.149) 21.140 28.687 ( 2.432 -2.942 1.764) 4.205 28.687 ( 2.432 2.942 1.764) 4.205 28.840 ( -0.765 -4.144 -4.978) 6.522 28.840 ( -0.765 4.144 -4.978) 6.522 29.729 ( -6.678 -8.892 4.630) 12.045 29.729 ( -6.678 8.892 4.630) 12.045 30.439 ( 7.606 -10.193 3.919) 13.309 30.439 ( 7.606 10.193 3.919) 13.309 30.973 ( -10.119 -4.993 10.884) 15.678 30.973 ( -10.119 4.993 10.884) 15.678 31.311 ( -10.579 -3.479 8.639) 14.094 31.311 ( -10.579 3.479 8.639) 14.094 31.770 ( -1.376 -1.710 6.985) 7.322 31.770 ( -1.376 1.710 6.985) 7.322 32.447 ( 15.750 -8.012 -8.834) 19.756 32.447 ( 15.750 8.012 -8.834) 19.756 ======================= Grid point 128 (72/104) ======================= q-point: (-0.20 -0.50 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.931 ( -5.692 -13.057 2.328) 14.433 2.931 ( -5.692 13.057 2.328) 14.433 3.268 ( -9.350 -3.586 11.810) 15.484 3.268 ( -9.350 3.586 11.810) 15.484 3.552 ( -6.480 -14.692 3.861) 16.515 3.552 ( -6.480 14.692 3.861) 16.515 4.029 ( 4.912 -11.776 16.282) 20.686 4.029 ( 4.912 11.776 16.282) 20.686 4.589 ( 8.209 -8.418 -1.462) 11.848 4.589 ( 8.209 8.418 -1.462) 11.848 4.998 ( -3.136 -5.988 1.390) 6.901 4.998 ( -3.136 5.988 1.390) 6.901 5.281 ( -2.205 -6.323 11.556) 13.356 5.281 ( -2.205 6.323 11.556) 13.356 5.643 ( -4.796 -12.280 18.073) 22.370 5.643 ( -4.796 12.280 18.073) 22.370 5.858 ( 0.240 -9.071 12.332) 15.310 5.858 ( 0.240 9.071 12.332) 15.310 6.166 ( -4.959 -4.515 28.960) 29.726 6.166 ( -4.959 4.515 28.960) 29.726 6.451 ( -14.064 -4.468 19.225) 24.236 6.451 ( -14.064 4.468 19.225) 24.236 6.708 ( -3.237 -1.556 2.300) 4.265 6.708 ( -3.237 1.556 2.300) 4.265 7.001 ( 1.604 -10.136 6.424) 12.107 7.001 ( 1.604 10.136 6.424) 12.107 7.354 ( -3.888 -3.288 -2.327) 5.599 7.354 ( -3.888 3.288 -2.327) 5.599 7.595 ( 1.213 -3.034 8.069) 8.705 7.595 ( 1.213 3.034 8.069) 8.705 7.777 ( -3.549 -2.719 3.441) 5.642 7.777 ( -3.549 2.719 3.441) 5.642 7.900 ( -0.065 -3.996 -5.637) 6.910 7.900 ( -0.065 3.996 -5.637) 6.910 8.162 ( 1.440 -4.552 -3.067) 5.674 8.162 ( 1.440 4.552 -3.067) 5.674 8.476 ( -0.513 -2.060 -5.314) 5.723 8.476 ( -0.513 2.060 -5.314) 5.723 8.664 ( 1.559 -3.987 1.218) 4.451 8.664 ( 1.559 3.987 1.218) 4.451 8.894 ( 0.050 -2.466 -3.083) 3.948 8.894 ( 0.050 2.466 -3.083) 3.948 9.077 ( 4.860 -4.729 -4.288) 8.023 9.077 ( 4.860 4.729 -4.288) 8.023 9.149 ( -0.973 -5.802 -12.582) 13.889 9.149 ( -0.973 5.802 -12.582) 13.889 9.363 ( 0.474 -1.019 -4.966) 5.092 9.363 ( 0.474 1.019 -4.966) 5.092 9.726 ( 4.900 -1.132 -0.322) 5.039 9.726 ( 4.900 1.132 -0.322) 5.039 10.421 ( 2.533 -4.025 -3.944) 6.178 10.421 ( 2.533 4.025 -3.944) 6.178 10.514 ( 4.163 -8.004 -3.753) 9.772 10.514 ( 4.163 8.004 -3.753) 9.772 10.717 ( -2.879 -5.073 -1.888) 6.131 10.717 ( -2.879 5.073 -1.888) 6.131 10.928 ( 0.372 -4.285 1.604) 4.590 10.928 ( 0.372 4.285 1.604) 4.590 11.173 ( 3.889 -8.483 -9.549) 13.352 11.173 ( 3.889 8.483 -9.549) 13.352 11.662 ( 2.962 -1.908 1.802) 3.957 11.662 ( 2.962 1.908 1.802) 3.957 11.833 ( -2.371 -1.927 1.026) 3.223 11.833 ( -2.371 1.927 1.026) 3.223 12.247 ( -2.750 -5.354 5.435) 8.109 12.247 ( -2.750 5.354 5.435) 8.109 12.566 ( 3.323 -3.461 -7.526) 8.925 12.566 ( 3.323 3.461 -7.526) 8.925 13.257 ( 1.948 -4.368 -2.107) 5.226 13.257 ( 1.948 4.368 -2.107) 5.226 13.512 ( 4.253 -6.793 1.203) 8.105 13.512 ( 4.253 6.793 1.203) 8.105 13.648 ( -4.654 -9.346 5.536) 11.817 13.648 ( -4.654 9.346 5.536) 11.817 14.647 ( -12.461 -4.099 -5.528) 14.235 14.647 ( -12.461 4.099 -5.528) 14.235 14.886 ( 0.272 -5.226 -12.204) 13.278 14.886 ( 0.272 5.226 -12.204) 13.278 15.460 ( 15.953 -9.699 3.539) 19.002 15.460 ( 15.953 9.699 3.539) 19.002 15.980 ( -10.717 -11.730 13.682) 20.967 15.980 ( -10.717 11.730 13.682) 20.967 16.205 ( -1.827 -7.049 -2.024) 7.558 16.205 ( -1.827 7.049 -2.024) 7.558 16.367 ( 5.840 -11.615 4.966) 13.916 16.367 ( 5.840 11.615 4.966) 13.916 16.895 ( 1.521 -4.737 -0.021) 4.976 16.895 ( 1.521 4.737 -0.021) 4.976 18.974 ( 1.440 -5.504 18.006) 18.884 18.974 ( 1.440 5.504 18.006) 18.884 19.840 ( -4.607 -4.446 15.803) 17.051 19.840 ( -4.607 4.446 15.803) 17.051 21.548 ( 7.870 -2.478 -32.496) 33.527 21.548 ( 7.870 2.478 -32.496) 33.527 21.893 ( 6.687 -1.173 -28.107) 28.915 21.893 ( 6.687 1.173 -28.107) 28.915 25.432 ( -1.135 -0.300 8.749) 8.828 25.432 ( -1.135 0.300 8.749) 8.828 25.694 ( -13.307 -0.391 -7.742) 15.400 25.694 ( -13.307 0.391 -7.742) 15.400 25.898 ( -1.925 -1.050 8.722) 8.994 25.898 ( -1.925 1.050 8.722) 8.994 27.210 ( 10.032 -3.258 -16.758) 19.801 27.210 ( 10.032 3.258 -16.758) 19.801 28.699 ( -1.003 -7.500 -2.414) 7.942 28.699 ( -1.003 7.500 -2.414) 7.942 28.848 ( 2.478 -0.677 -1.923) 3.209 28.848 ( 2.478 0.677 -1.923) 3.209 29.622 ( -4.155 -5.445 4.526) 8.209 29.622 ( -4.155 5.445 4.526) 8.209 30.569 ( -0.529 -11.086 -0.662) 11.118 30.569 ( -0.529 11.086 -0.662) 11.118 30.810 ( -4.412 -1.909 16.164) 16.864 30.810 ( -4.412 1.909 16.164) 16.864 31.227 ( -3.059 -2.619 10.435) 11.186 31.227 ( -3.059 2.619 10.435) 11.186 31.782 ( -0.935 -1.916 8.995) 9.244 31.782 ( -0.935 1.916 8.995) 9.244 32.659 ( 7.612 -9.738 -14.365) 18.950 32.659 ( 7.612 9.738 -14.365) 18.950 ======================= Grid point 140 (73/104) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.922 ( 2.621 0.000 20.008) 20.179 3.163 ( 2.514 0.000 31.423) 31.524 3.427 ( 9.166 0.000 37.401) 38.507 3.696 ( 10.823 0.000 -5.833) 12.294 3.756 ( -3.717 0.000 4.499) 5.836 3.793 ( 2.731 0.000 -8.524) 8.950 3.994 ( -1.730 0.000 -4.330) 4.663 4.192 ( 3.496 0.000 9.294) 9.930 4.616 ( -2.914 0.000 2.302) 3.714 4.716 ( -22.511 0.000 -14.144) 26.585 4.847 ( 5.080 0.000 5.442) 7.445 5.167 ( 1.583 0.000 9.260) 9.395 5.279 ( 10.787 0.000 12.656) 16.629 5.305 ( -11.969 0.000 4.620) 12.829 5.543 ( 2.844 0.000 -4.203) 5.075 5.607 ( -14.608 0.000 -9.573) 17.465 6.012 ( -9.910 0.000 -0.830) 9.945 6.130 ( 6.846 0.000 -13.117) 14.796 6.219 ( -3.738 0.000 -7.233) 8.142 6.250 ( -7.139 0.000 -2.283) 7.495 6.525 ( -0.206 0.000 14.752) 14.753 6.660 ( -9.957 0.000 7.384) 12.396 6.741 ( -3.881 0.000 15.452) 15.932 6.849 ( -1.587 0.000 -1.289) 2.044 7.029 ( 2.942 0.000 -6.282) 6.936 7.170 ( 0.193 0.000 27.402) 27.402 7.251 ( -1.930 0.000 29.087) 29.151 7.271 ( 7.655 0.000 -7.228) 10.528 7.365 ( -4.446 0.000 18.048) 18.588 7.516 ( 1.206 0.000 -9.330) 9.408 7.618 ( 7.175 0.000 -13.833) 15.583 7.757 ( 1.495 0.000 19.904) 19.960 7.947 ( -2.357 0.000 13.436) 13.641 7.963 ( 4.264 0.000 -8.069) 9.126 8.016 ( 0.115 0.000 11.165) 11.165 8.192 ( -1.600 0.000 -3.408) 3.765 8.396 ( -3.395 0.000 11.883) 12.358 8.410 ( -2.366 0.000 -9.495) 9.786 8.534 ( -1.260 0.000 19.536) 19.577 8.754 ( 0.878 0.000 -5.652) 5.720 8.873 ( 3.186 0.000 -1.188) 3.401 8.881 ( -0.103 0.000 -8.812) 8.813 9.055 ( 2.904 0.000 -7.318) 7.873 9.061 ( 2.082 0.000 -14.992) 15.135 9.109 ( 1.264 0.000 -11.909) 11.976 9.420 ( 5.385 0.000 2.511) 5.942 9.456 ( 8.329 0.000 -15.852) 17.907 9.662 ( 1.532 0.000 -9.546) 9.669 9.828 ( -1.292 0.000 2.760) 3.048 10.001 ( -4.174 0.000 10.825) 11.602 10.014 ( 3.757 0.000 -7.347) 8.251 10.356 ( -1.716 0.000 -2.280) 2.854 10.410 ( 5.506 0.000 9.597) 11.064 10.500 ( -11.764 0.000 6.250) 13.321 10.657 ( -5.112 0.000 -0.789) 5.172 10.827 ( 5.257 0.000 -5.647) 7.715 10.879 ( 2.768 0.000 0.710) 2.858 10.966 ( -7.209 0.000 -2.683) 7.692 11.040 ( -0.179 0.000 -9.639) 9.641 11.077 ( 5.805 0.000 -11.196) 12.611 11.702 ( -2.930 0.000 3.979) 4.941 11.770 ( 2.040 0.000 0.915) 2.236 12.005 ( 1.157 0.000 9.043) 9.117 12.221 ( 5.608 0.000 0.226) 5.612 12.223 ( -11.984 0.000 5.155) 13.046 12.262 ( -5.294 0.000 8.103) 9.679 12.460 ( 9.914 0.000 -6.020) 11.599 12.665 ( 1.486 0.000 -12.008) 12.100 12.834 ( -2.129 0.000 11.944) 12.132 13.010 ( -3.167 0.000 -4.700) 5.667 13.390 ( 3.678 0.000 -4.116) 5.520 13.599 ( -7.792 0.000 8.642) 11.636 13.913 ( -3.714 0.000 -20.861) 21.189 13.929 ( 4.488 0.000 -5.747) 7.292 14.072 ( 3.170 0.000 0.993) 3.322 14.274 ( 0.756 0.000 -11.194) 11.220 15.119 ( 9.566 0.000 6.192) 11.395 15.268 ( -13.263 0.000 4.890) 14.136 15.287 ( 8.635 0.000 9.467) 12.813 15.709 ( -1.708 0.000 -9.729) 9.878 15.712 ( -16.991 0.000 4.969) 17.703 15.905 ( 22.556 0.000 -0.950) 22.576 16.044 ( -5.370 0.000 0.068) 5.371 16.219 ( 0.901 0.000 2.800) 2.941 16.508 ( 4.298 0.000 -3.522) 5.557 16.532 ( -4.676 0.000 2.609) 5.355 17.215 ( 2.673 0.000 9.924) 10.278 17.382 ( -9.185 0.000 2.584) 9.542 18.979 ( -4.869 0.000 19.837) 20.426 19.757 ( -15.590 0.000 23.087) 27.857 20.373 ( 5.692 0.000 -44.013) 44.380 20.375 ( 2.015 0.000 25.302) 25.382 20.438 ( -8.676 0.000 23.946) 25.470 20.885 ( 15.568 0.000 -33.170) 36.642 21.425 ( 1.179 0.000 -27.349) 27.375 21.510 ( 9.383 0.000 -28.669) 30.165 25.355 ( -6.547 0.000 3.897) 7.619 25.452 ( -3.375 0.000 2.628) 4.277 25.518 ( 4.137 0.000 -4.071) 5.804 25.578 ( 9.863 0.000 -5.749) 11.417 26.130 ( -3.855 0.000 16.689) 17.128 26.251 ( 4.372 0.000 18.366) 18.879 26.897 ( 2.270 0.000 -22.554) 22.668 26.957 ( -1.866 0.000 -17.613) 17.712 28.414 ( 1.717 0.000 2.270) 2.847 28.573 ( -3.829 0.000 -6.894) 7.886 28.881 ( -3.509 0.000 1.000) 3.649 28.908 ( 3.713 0.000 -1.027) 3.852 29.596 ( -16.285 0.000 2.028) 16.411 29.711 ( 21.896 0.000 -5.045) 22.470 30.133 ( 10.564 0.000 13.971) 17.516 30.627 ( -11.813 0.000 -5.024) 12.837 30.977 ( 1.157 0.000 11.596) 11.654 31.231 ( -0.455 0.000 -1.882) 1.936 31.514 ( 11.384 0.000 13.063) 17.327 31.552 ( -4.464 0.000 7.367) 8.614 31.828 ( -0.833 0.000 0.902) 1.228 31.909 ( -5.745 0.000 -9.721) 11.291 32.232 ( 1.906 0.000 14.354) 14.480 32.707 ( -9.415 0.000 -9.661) 13.489 ======================= Grid point 141 (74/104) ======================= q-point: ( 0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.013 ( -3.677 0.000 17.709) 18.087 3.164 ( -11.347 0.000 13.576) 17.694 3.460 ( -6.121 0.000 -4.925) 7.857 3.761 ( -3.268 0.000 -8.659) 9.255 3.816 ( 4.597 0.000 13.862) 14.605 3.964 ( 0.372 0.000 4.050) 4.067 4.083 ( 6.741 0.000 9.681) 11.797 4.161 ( -20.901 0.000 -11.983) 24.092 4.287 ( 2.768 0.000 8.869) 9.291 4.567 ( 4.800 0.000 6.145) 7.798 4.984 ( -11.169 0.000 -2.196) 11.382 5.006 ( 5.867 0.000 6.608) 8.837 5.264 ( -10.014 0.000 -5.774) 11.559 5.286 ( 0.724 0.000 25.672) 25.682 5.555 ( -22.932 0.000 -3.116) 23.143 5.679 ( 16.664 0.000 14.949) 22.387 5.733 ( 11.905 0.000 -9.916) 15.493 6.137 ( -3.421 0.000 -2.348) 4.149 6.166 ( 3.492 0.000 -11.940) 12.440 6.180 ( 0.246 0.000 3.264) 3.273 6.431 ( -6.925 0.000 16.986) 18.343 6.756 ( -4.595 0.000 22.567) 23.030 6.848 ( 12.758 0.000 5.034) 13.716 6.916 ( 7.169 0.000 -9.037) 11.535 7.089 ( 6.099 0.000 -4.381) 7.510 7.284 ( -4.290 0.000 31.542) 31.832 7.368 ( -0.164 0.000 24.780) 24.781 7.371 ( -0.465 0.000 -4.142) 4.168 7.433 ( 1.032 0.000 -1.984) 2.236 7.445 ( 6.110 0.000 0.335) 6.119 7.848 ( 16.251 0.000 -19.067) 25.053 7.875 ( 1.838 0.000 23.402) 23.474 7.937 ( -5.460 0.000 18.528) 19.316 7.991 ( 2.396 0.000 -11.359) 11.609 8.144 ( 4.104 0.000 18.037) 18.498 8.187 ( 3.256 0.000 -8.013) 8.649 8.327 ( -0.997 0.000 -3.439) 3.580 8.404 ( -0.170 0.000 6.142) 6.145 8.569 ( -2.675 0.000 17.950) 18.148 8.712 ( -2.327 0.000 -9.721) 9.995 8.784 ( -3.466 0.000 -6.989) 7.801 8.886 ( -2.982 0.000 -2.632) 3.977 9.014 ( -4.422 0.000 -7.944) 9.092 9.044 ( 3.115 0.000 -14.391) 14.724 9.111 ( 3.237 0.000 -12.686) 13.092 9.508 ( 2.770 0.000 -1.354) 3.083 9.563 ( 6.606 0.000 -20.713) 21.741 9.671 ( 4.738 0.000 -6.615) 8.137 9.784 ( -0.935 0.000 0.065) 0.937 9.866 ( -13.957 0.000 15.776) 21.064 9.948 ( -4.191 0.000 -12.002) 12.713 10.236 ( -7.107 0.000 -3.158) 7.777 10.263 ( -6.451 0.000 2.786) 7.027 10.507 ( -7.034 0.000 -4.802) 8.517 10.649 ( 7.341 0.000 5.218) 9.006 10.801 ( -3.065 0.000 -2.060) 3.693 10.893 ( 0.418 0.000 -6.370) 6.384 10.955 ( -0.456 0.000 4.492) 4.516 10.991 ( 3.292 0.000 -5.805) 6.673 11.172 ( 3.336 0.000 -2.400) 4.109 11.706 ( 2.965 0.000 4.195) 5.137 11.813 ( 0.899 0.000 2.113) 2.296 11.913 ( -12.437 0.000 3.053) 12.806 12.041 ( -2.897 0.000 11.774) 12.125 12.265 ( 0.345 0.000 -3.037) 3.056 12.297 ( 1.410 0.000 8.651) 8.765 12.626 ( -0.663 0.000 -6.553) 6.586 12.698 ( 8.574 0.000 -9.938) 13.125 12.908 ( 3.626 0.000 13.433) 13.914 13.014 ( 8.214 0.000 -5.170) 9.705 13.377 ( -5.551 0.000 3.004) 6.312 13.560 ( 3.454 0.000 1.071) 3.616 13.746 ( -3.676 0.000 -11.223) 11.810 13.939 ( 0.859 0.000 -10.347) 10.382 14.068 ( -6.162 0.000 4.241) 7.480 14.317 ( 7.828 0.000 -13.836) 15.897 15.144 ( 2.223 0.000 -0.467) 2.271 15.177 ( -16.918 0.000 2.472) 17.098 15.330 ( -4.397 0.000 12.468) 13.221 15.521 ( -10.551 0.000 -12.679) 16.495 15.644 ( 15.023 0.000 2.228) 15.187 15.975 ( -1.306 0.000 3.922) 4.133 16.140 ( 2.609 0.000 0.291) 2.625 16.296 ( 3.158 0.000 -4.350) 5.375 16.483 ( -0.890 0.000 -0.289) 0.936 16.745 ( 15.838 0.000 8.173) 17.822 17.105 ( -18.269 0.000 8.546) 20.169 17.232 ( -5.003 0.000 9.801) 11.004 18.990 ( -3.820 0.000 26.975) 27.244 19.510 ( -15.352 0.000 19.873) 25.112 20.329 ( -10.114 0.000 23.494) 25.579 20.336 ( 9.581 0.000 -43.841) 44.876 20.466 ( -3.693 0.000 24.911) 25.183 21.042 ( 12.889 0.000 -30.931) 33.509 21.261 ( -4.019 0.000 -30.415) 30.680 21.569 ( 7.767 0.000 -27.752) 28.818 25.290 ( -0.866 0.000 5.116) 5.189 25.480 ( 4.134 0.000 3.644) 5.510 25.712 ( 14.289 0.000 -7.187) 15.995 25.884 ( 19.338 0.000 -10.091) 21.812 26.104 ( -5.448 0.000 15.766) 16.680 26.375 ( -1.666 0.000 18.481) 18.556 26.685 ( -9.239 0.000 -16.852) 19.218 26.886 ( 1.029 0.000 -22.970) 22.993 28.514 ( 6.342 0.000 3.782) 7.384 28.524 ( 1.391 0.000 -4.836) 5.032 28.785 ( -5.574 0.000 0.710) 5.619 28.958 ( 1.388 0.000 -0.934) 1.673 29.325 ( -8.539 0.000 -0.797) 8.577 30.179 ( 21.941 0.000 -5.193) 22.547 30.323 ( -13.689 0.000 -9.324) 16.563 30.362 ( 4.213 0.000 14.927) 15.510 31.099 ( 5.505 0.000 6.831) 8.773 31.207 ( -0.626 0.000 -2.601) 2.675 31.480 ( -3.687 0.000 4.443) 5.774 31.688 ( -9.900 0.000 -2.121) 10.125 31.833 ( -0.019 0.000 2.126) 2.126 31.847 ( 13.695 0.000 6.261) 15.058 32.300 ( -2.395 0.000 16.042) 16.220 32.378 ( -16.487 0.000 -2.906) 16.741 ======================= Grid point 142 (75/104) ======================= q-point: (-0.60 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.874 ( -11.779 0.000 9.270) 14.989 3.003 ( -10.127 0.000 17.988) 20.643 3.252 ( -11.420 0.000 -3.432) 11.924 3.559 ( -8.883 0.000 -5.218) 10.302 3.772 ( -9.989 0.000 -6.412) 11.870 3.947 ( 1.131 0.000 9.625) 9.691 3.966 ( -2.787 0.000 -3.744) 4.668 4.063 ( 0.832 0.000 -6.397) 6.451 4.428 ( 4.573 0.000 15.809) 16.457 4.785 ( -5.407 0.000 -0.592) 5.439 4.878 ( 11.085 0.000 14.075) 17.916 4.994 ( -0.740 0.000 -11.063) 11.088 5.146 ( -16.272 0.000 4.373) 16.850 5.332 ( 8.561 0.000 12.425) 15.089 5.514 ( 6.896 0.000 32.610) 33.332 5.889 ( 9.282 0.000 -14.827) 17.493 5.975 ( 2.510 0.000 7.579) 7.984 6.068 ( -0.037 0.000 -9.496) 9.496 6.204 ( -0.683 0.000 4.571) 4.622 6.264 ( 12.568 0.000 -9.520) 15.767 6.467 ( -0.647 0.000 23.390) 23.399 6.758 ( -2.393 0.000 20.016) 20.158 7.005 ( 4.905 0.000 -9.009) 10.257 7.124 ( 10.437 0.000 2.692) 10.778 7.152 ( -4.138 0.000 5.632) 6.988 7.268 ( -6.704 0.000 16.881) 18.164 7.302 ( 2.279 0.000 -13.492) 13.683 7.362 ( -11.966 0.000 25.729) 28.375 7.502 ( 3.431 0.000 -9.155) 9.777 7.562 ( 1.047 0.000 15.129) 15.165 7.848 ( -4.968 0.000 -7.580) 9.063 7.862 ( -6.976 0.000 11.488) 13.441 8.038 ( -1.086 0.000 26.214) 26.237 8.101 ( 4.277 0.000 -14.378) 15.001 8.201 ( 4.267 0.000 -7.875) 8.957 8.315 ( 1.831 0.000 27.794) 27.854 8.323 ( -10.777 0.000 7.393) 13.069 8.457 ( 10.451 0.000 -1.431) 10.549 8.597 ( -0.447 0.000 -3.680) 3.707 8.670 ( -8.867 0.000 1.276) 8.958 8.714 ( 4.734 0.000 13.087) 13.917 8.741 ( 1.600 0.000 -2.881) 3.295 8.908 ( 0.133 0.000 -11.296) 11.296 9.073 ( 6.066 0.000 -14.707) 15.909 9.127 ( 4.697 0.000 -15.343) 16.045 9.485 ( -4.784 0.000 -9.558) 10.689 9.522 ( -1.613 0.000 -19.925) 19.990 9.623 ( -9.379 0.000 -4.014) 10.202 9.630 ( -10.502 0.000 10.565) 14.897 9.823 ( 3.040 0.000 -0.305) 3.055 9.904 ( 5.420 0.000 -16.297) 17.175 10.102 ( 0.307 0.000 -7.811) 7.817 10.160 ( -4.867 0.000 0.353) 4.880 10.381 ( -0.343 0.000 -7.380) 7.388 10.741 ( 3.612 0.000 -4.301) 5.616 10.842 ( 1.673 0.000 6.063) 6.290 10.846 ( -0.290 0.000 -8.003) 8.009 10.972 ( 3.318 0.000 7.614) 8.305 11.040 ( 1.007 0.000 -2.175) 2.396 11.189 ( -0.825 0.000 0.612) 1.027 11.774 ( -3.303 0.000 7.048) 7.784 11.818 ( -1.234 0.000 1.611) 2.029 11.876 ( 9.773 0.000 2.840) 10.178 11.989 ( -7.133 0.000 16.128) 17.635 12.185 ( -7.211 0.000 -0.648) 7.240 12.373 ( 2.086 0.000 5.551) 5.930 12.560 ( -1.254 0.000 -6.268) 6.392 12.757 ( 3.680 0.000 -12.935) 13.449 13.127 ( 10.713 0.000 13.610) 17.320 13.255 ( 14.313 0.000 -9.452) 17.152 13.264 ( -4.755 0.000 0.444) 4.775 13.588 ( -9.483 0.000 -1.096) 9.547 13.682 ( 6.311 0.000 2.657) 6.847 13.866 ( -12.771 0.000 4.991) 13.712 14.011 ( 12.539 0.000 -16.820) 20.980 14.415 ( 5.149 0.000 -17.064) 17.824 14.789 ( -12.607 0.000 -0.972) 12.645 15.184 ( -13.950 0.000 -11.702) 18.209 15.246 ( -9.300 0.000 9.119) 13.025 15.321 ( 13.245 0.000 -5.350) 14.285 15.958 ( 4.606 0.000 8.755) 9.893 16.073 ( 11.365 0.000 5.970) 12.837 16.177 ( 0.991 0.000 1.913) 2.155 16.316 ( 0.115 0.000 1.411) 1.416 16.493 ( 3.084 0.000 -0.792) 3.184 16.677 ( -22.012 0.000 11.009) 24.611 17.111 ( -10.071 0.000 9.891) 14.116 17.138 ( 13.935 0.000 3.997) 14.497 19.075 ( -2.182 0.000 36.319) 36.385 19.328 ( -8.154 0.000 16.627) 18.519 20.223 ( -9.455 0.000 21.944) 23.894 20.381 ( 13.093 0.000 -42.697) 44.659 20.495 ( -4.234 0.000 25.961) 26.304 20.996 ( -5.947 0.000 -35.866) 36.356 21.163 ( 11.728 0.000 -30.088) 32.293 21.586 ( 5.647 0.000 -27.370) 27.947 25.365 ( 4.587 0.000 8.171) 9.370 25.610 ( 3.666 0.000 8.740) 9.477 25.922 ( 4.110 0.000 -11.789) 12.485 26.050 ( -5.319 0.000 12.999) 14.045 26.169 ( 9.449 0.000 -16.768) 19.247 26.331 ( -9.263 0.000 15.539) 18.091 26.491 ( 2.248 0.000 -13.825) 14.006 26.803 ( 2.600 0.000 -19.681) 19.852 28.574 ( 4.699 0.000 -3.356) 5.774 28.627 ( -4.393 0.000 1.245) 4.566 28.735 ( 6.260 0.000 5.414) 8.277 28.963 ( -0.258 0.000 -1.286) 1.312 29.252 ( 2.538 0.000 -0.242) 2.550 29.929 ( -17.623 0.000 -14.928) 23.096 30.424 ( -5.077 0.000 13.977) 14.871 30.558 ( 14.154 0.000 -0.427) 14.160 31.155 ( -4.385 0.000 0.165) 4.388 31.192 ( 0.348 0.000 -1.650) 1.687 31.467 ( 0.874 0.000 4.145) 4.236 31.604 ( 4.501 0.000 -1.465) 4.733 31.834 ( -0.565 0.000 2.024) 2.101 31.860 ( -15.694 0.000 4.317) 16.277 32.272 ( -6.576 0.000 14.430) 15.857 32.327 ( 13.891 0.000 4.350) 14.556 ======================= Grid point 143 (76/104) ======================= q-point: (-0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.737 ( -5.029 0.000 13.190) 14.117 2.892 ( -7.917 0.000 25.353) 26.560 2.997 ( -11.963 0.000 18.204) 21.783 3.471 ( 3.044 0.000 -7.635) 8.219 3.689 ( 2.795 0.000 1.218) 3.049 3.880 ( -0.374 0.000 -13.966) 13.971 3.978 ( -0.537 0.000 5.383) 5.410 4.063 ( 0.263 0.000 -3.310) 3.320 4.578 ( 1.311 0.000 19.700) 19.743 4.748 ( 0.167 0.000 -2.062) 2.069 4.871 ( -8.503 0.000 6.663) 10.802 5.006 ( 5.393 0.000 -8.546) 10.105 5.162 ( 8.552 0.000 18.858) 20.706 5.511 ( 3.206 0.000 -4.317) 5.377 5.752 ( 1.895 0.000 19.038) 19.132 5.894 ( -7.546 0.000 2.844) 8.064 5.986 ( 2.994 0.000 -4.957) 5.791 6.050 ( 2.788 0.000 -15.018) 15.274 6.227 ( 1.768 0.000 0.243) 1.784 6.500 ( -4.386 0.000 18.418) 18.933 6.552 ( 13.538 0.000 -5.739) 14.704 6.856 ( 2.298 0.000 15.257) 15.430 6.912 ( -10.235 0.000 0.349) 10.241 7.100 ( -17.512 0.000 19.152) 25.951 7.127 ( -0.418 0.000 0.789) 0.893 7.218 ( -5.850 0.000 16.283) 17.302 7.260 ( -0.535 0.000 -17.888) 17.896 7.306 ( 2.056 0.000 12.067) 12.241 7.438 ( -0.856 0.000 -16.890) 16.912 7.557 ( -15.089 0.000 34.762) 37.895 7.766 ( -1.201 0.000 -1.830) 2.189 7.792 ( 2.002 0.000 -1.416) 2.452 7.995 ( -16.010 0.000 22.097) 27.287 8.001 ( -5.681 0.000 -5.006) 7.572 8.124 ( -6.282 0.000 6.598) 9.111 8.263 ( 2.353 0.000 -4.762) 5.312 8.426 ( -4.570 0.000 31.520) 31.849 8.499 ( -5.925 0.000 7.435) 9.507 8.519 ( 3.028 0.000 -5.752) 6.500 8.704 ( 3.487 0.000 -2.923) 4.550 8.843 ( -0.667 0.000 -2.031) 2.138 8.844 ( 5.217 0.000 -2.959) 5.998 9.008 ( 11.348 0.000 2.878) 11.707 9.147 ( 5.706 0.000 -18.862) 19.707 9.182 ( -1.061 0.000 -5.453) 5.555 9.219 ( -11.104 0.000 -14.040) 17.900 9.361 ( 6.509 0.000 -11.272) 13.017 9.479 ( -0.024 0.000 -17.838) 17.838 9.590 ( 2.822 0.000 8.954) 9.389 9.856 ( -1.696 0.000 -5.389) 5.649 9.900 ( 4.007 0.000 0.132) 4.009 10.112 ( 0.592 0.000 3.450) 3.500 10.191 ( 7.142 0.000 -6.332) 9.545 10.469 ( 12.318 0.000 -15.646) 19.913 10.781 ( 1.107 0.000 -1.333) 1.733 10.828 ( 2.122 0.000 -7.712) 7.998 10.902 ( 0.526 0.000 3.154) 3.198 11.002 ( -3.209 0.000 -1.217) 3.432 11.094 ( 3.082 0.000 3.925) 4.990 11.171 ( -0.114 0.000 -3.196) 3.199 11.773 ( -1.593 0.000 7.992) 8.149 11.780 ( -2.294 0.000 -0.523) 2.353 11.912 ( -4.958 0.000 17.107) 17.811 12.017 ( -5.771 0.000 0.346) 5.781 12.097 ( 7.308 0.000 4.387) 8.524 12.434 ( 1.656 0.000 4.322) 4.628 12.539 ( 1.177 0.000 -7.404) 7.497 12.733 ( -0.707 0.000 -12.174) 12.195 13.127 ( -7.771 0.000 2.334) 8.114 13.317 ( -8.565 0.000 -3.400) 9.215 13.416 ( 3.808 0.000 3.746) 5.341 13.553 ( 12.486 0.000 -9.867) 15.914 13.615 ( -4.863 0.000 6.681) 8.263 13.910 ( 9.263 0.000 4.760) 10.414 14.212 ( 7.104 0.000 -16.234) 17.720 14.306 ( 1.066 0.000 -22.443) 22.468 14.772 ( 5.298 0.000 6.940) 8.732 14.935 ( -0.917 0.000 -6.824) 6.885 15.069 ( -8.397 0.000 5.942) 10.287 15.573 ( 11.404 0.000 -7.694) 13.757 16.012 ( -1.571 0.000 8.204) 8.353 16.162 ( -21.891 0.000 16.312) 27.300 16.205 ( -0.117 0.000 2.815) 2.817 16.235 ( -0.023 0.000 1.394) 1.394 16.420 ( 1.577 0.000 -6.407) 6.598 16.692 ( 12.429 0.000 8.090) 14.830 16.917 ( -11.048 0.000 8.517) 13.949 17.384 ( 8.201 0.000 -1.256) 8.297 19.091 ( -7.902 0.000 19.662) 21.190 19.483 ( 10.590 0.000 38.070) 39.516 20.127 ( -8.598 0.000 21.019) 22.710 20.504 ( 15.950 0.000 -40.226) 43.273 20.516 ( -5.094 0.000 25.914) 26.409 20.716 ( -3.276 0.000 -40.763) 40.894 21.277 ( 11.784 0.000 -29.673) 31.927 21.566 ( 4.253 0.000 -27.344) 27.673 25.514 ( 3.469 0.000 10.215) 10.788 25.651 ( -4.441 0.000 10.948) 11.814 25.757 ( -9.258 0.000 -12.592) 15.629 26.018 ( -2.647 0.000 10.557) 10.884 26.033 ( -13.055 0.000 -15.195) 20.033 26.179 ( -8.976 0.000 13.802) 16.464 26.659 ( 14.771 0.000 -17.362) 22.796 26.891 ( 11.107 0.000 -14.800) 18.504 28.504 ( -5.727 0.000 0.912) 5.800 28.679 ( 5.942 0.000 -2.253) 6.354 28.882 ( 3.313 0.000 4.083) 5.257 28.935 ( -2.123 0.000 -3.639) 4.213 29.445 ( 13.389 0.000 6.334) 14.811 29.491 ( -14.045 0.000 -14.040) 19.859 30.271 ( -13.950 0.000 10.485) 17.450 30.792 ( 7.049 0.000 3.520) 7.879 31.032 ( -5.467 0.000 5.302) 7.616 31.208 ( 1.336 0.000 -0.148) 1.344 31.437 ( -15.486 0.000 3.242) 15.821 31.531 ( 1.897 0.000 5.847) 6.147 31.847 ( 1.054 0.000 2.846) 3.035 31.864 ( 9.403 0.000 -2.149) 9.646 32.172 ( -7.168 0.000 10.662) 12.847 32.651 ( 13.673 0.000 -3.407) 14.091 ======================= Grid point 144 (77/104) ======================= q-point: (-0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.778 ( 1.505 0.000 18.212) 18.274 2.946 ( 0.630 0.000 33.335) 33.341 3.031 ( 4.344 0.000 36.621) 36.878 3.563 ( 7.298 0.000 -6.602) 9.842 3.794 ( 1.173 0.000 5.003) 5.139 3.820 ( 0.059 0.000 -11.586) 11.586 4.034 ( 5.426 0.000 5.911) 8.024 4.042 ( -0.671 0.000 -4.440) 4.490 4.651 ( -4.360 0.000 5.129) 6.732 4.685 ( 2.297 0.000 16.301) 16.462 4.973 ( 10.902 0.000 -1.625) 11.022 5.079 ( 1.869 0.000 -4.193) 4.590 5.303 ( -15.131 0.000 -14.080) 20.668 5.370 ( 0.905 0.000 17.031) 17.055 5.719 ( -8.898 0.000 0.688) 8.925 5.829 ( -3.220 0.000 2.809) 4.273 6.018 ( 0.813 0.000 6.730) 6.779 6.045 ( 4.864 0.000 -17.054) 17.735 6.237 ( 2.255 0.000 -8.108) 8.416 6.494 ( -11.667 0.000 -11.174) 16.155 6.499 ( -2.163 0.000 11.899) 12.094 6.832 ( -14.077 0.000 18.773) 23.464 6.911 ( 5.313 0.000 3.142) 6.172 6.947 ( -2.554 0.000 10.590) 10.893 7.012 ( -6.751 0.000 -0.633) 6.781 7.147 ( -10.801 0.000 16.693) 19.883 7.196 ( 2.632 0.000 -13.626) 13.878 7.244 ( -11.524 0.000 26.221) 28.641 7.433 ( 6.934 0.000 -17.834) 19.134 7.448 ( -8.276 0.000 27.149) 28.383 7.690 ( -4.531 0.000 -3.471) 5.708 7.702 ( -11.387 0.000 19.976) 22.994 7.888 ( 3.907 0.000 2.326) 4.547 7.927 ( 0.600 0.000 -2.651) 2.718 8.049 ( -5.858 0.000 10.727) 12.222 8.253 ( -1.682 0.000 -2.726) 3.203 8.432 ( -4.223 0.000 8.934) 9.882 8.465 ( -3.379 0.000 28.185) 28.387 8.503 ( -1.733 0.000 -10.200) 10.346 8.740 ( 2.059 0.000 -3.391) 3.967 8.827 ( 0.675 0.000 -0.234) 0.714 8.871 ( 2.062 0.000 -5.298) 5.685 9.040 ( 0.081 0.000 -9.471) 9.472 9.095 ( 0.665 0.000 -13.198) 13.215 9.154 ( 1.742 0.000 -15.870) 15.966 9.252 ( 8.878 0.000 4.328) 9.877 9.396 ( 3.470 0.000 -15.253) 15.643 9.623 ( 8.238 0.000 -6.377) 10.418 9.749 ( 6.006 0.000 6.968) 9.199 9.879 ( 8.028 0.000 -7.174) 10.766 9.982 ( 2.475 0.000 2.895) 3.809 10.211 ( 6.318 0.000 6.271) 8.902 10.313 ( 5.367 0.000 -1.115) 5.482 10.652 ( 8.827 0.000 -12.828) 15.572 10.745 ( -8.284 0.000 7.413) 11.116 10.839 ( -1.963 0.000 -1.963) 2.776 10.860 ( -2.265 0.000 -0.952) 2.457 10.946 ( 3.584 0.000 -7.591) 8.395 11.099 ( -3.375 0.000 0.007) 3.375 11.142 ( -0.504 0.000 -9.859) 9.872 11.743 ( -0.210 0.000 -0.230) 0.312 11.750 ( -3.247 0.000 6.094) 6.905 11.937 ( -0.020 0.000 13.170) 13.170 12.029 ( 7.385 0.000 -1.024) 7.455 12.215 ( 1.718 0.000 5.802) 6.051 12.452 ( -4.218 0.000 5.665) 7.063 12.473 ( -4.347 0.000 -5.388) 6.923 12.679 ( 1.770 0.000 -11.844) 11.975 12.930 ( -10.922 0.000 7.056) 13.003 13.134 ( -6.307 0.000 -4.413) 7.698 13.360 ( -0.513 0.000 -4.627) 4.655 13.676 ( -1.039 0.000 9.517) 9.573 13.774 ( 11.753 0.000 -10.934) 16.052 14.015 ( 0.933 0.000 0.543) 1.079 14.090 ( -2.596 0.000 -22.555) 22.704 14.340 ( 0.278 0.000 -9.815) 9.819 14.917 ( 5.772 0.000 5.381) 7.891 15.071 ( 6.513 0.000 6.710) 9.351 15.219 ( 24.241 0.000 0.284) 24.243 15.665 ( -7.159 0.000 2.470) 7.573 15.782 ( -7.857 0.000 -0.377) 7.866 15.955 ( -8.050 0.000 8.186) 11.481 16.168 ( -5.111 0.000 -1.043) 5.216 16.215 ( -0.976 0.000 4.486) 4.591 16.463 ( 4.090 0.000 -9.172) 10.043 16.677 ( -10.858 0.000 8.211) 13.614 17.028 ( 10.443 0.000 8.844) 13.685 17.470 ( 0.451 0.000 -1.656) 1.716 19.015 ( -6.368 0.000 16.767) 17.935 19.872 ( -0.317 0.000 31.444) 31.446 20.113 ( 4.347 0.000 24.378) 24.762 20.497 ( 1.245 0.000 -43.028) 43.046 20.503 ( -7.280 0.000 25.344) 26.368 20.691 ( 17.178 0.000 -36.991) 40.785 21.393 ( 11.320 0.000 -28.904) 31.042 21.522 ( 3.358 0.000 -27.490) 27.694 25.495 ( -7.484 0.000 5.289) 9.164 25.552 ( -3.723 0.000 -8.526) 9.304 25.568 ( -7.383 0.000 7.728) 10.688 25.650 ( -13.736 0.000 -6.946) 15.392 26.065 ( 3.139 0.000 13.962) 14.311 26.135 ( -2.804 0.000 16.348) 16.586 26.844 ( 10.633 0.000 -22.669) 25.039 27.020 ( 5.054 0.000 -14.028) 14.911 28.416 ( -2.642 0.000 1.493) 3.035 28.740 ( -5.290 0.000 -7.154) 8.898 28.828 ( 1.827 0.000 -3.119) 3.615 28.920 ( -0.638 0.000 1.856) 1.962 29.384 ( 8.777 0.000 -5.504) 10.360 29.801 ( 14.560 0.000 11.721) 18.691 29.957 ( -18.198 0.000 6.218) 19.231 30.839 ( -4.683 0.000 1.284) 4.856 30.968 ( -4.376 0.000 5.253) 6.837 31.233 ( 0.771 0.000 -0.156) 0.787 31.290 ( 1.247 0.000 14.305) 14.360 31.573 ( -0.683 0.000 6.563) 6.598 31.865 ( -2.216 0.000 3.676) 4.292 31.983 ( 3.125 0.000 -8.845) 9.381 32.132 ( 0.379 0.000 9.996) 10.003 32.816 ( 3.703 0.000 -9.674) 10.359 ======================= Grid point 145 (78/104) ======================= q-point: ( 0.00 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.900 ( 0.509 -1.701 17.172) 17.264 3.101 ( 7.100 -5.272 31.687) 32.898 3.461 ( 4.076 3.246 27.957) 28.438 3.605 ( 6.070 -10.241 -9.192) 15.041 3.733 ( -4.440 2.929 -0.602) 5.353 3.940 ( 1.003 4.622 7.733) 9.065 4.037 ( 5.274 4.900 -3.985) 8.229 4.112 ( -2.317 -10.496 8.154) 13.492 4.386 ( -3.313 0.570 -3.985) 5.213 4.673 ( -15.048 -5.583 -14.953) 21.936 5.046 ( 2.741 -7.053 6.841) 10.201 5.190 ( -12.154 -7.336 3.721) 14.675 5.299 ( 1.034 26.852 7.907) 28.011 5.401 ( 11.995 6.256 7.666) 15.550 5.475 ( -3.506 0.344 6.940) 7.783 5.789 ( -6.724 11.288 -4.165) 13.783 5.984 ( -4.864 -4.880 -0.835) 6.941 6.135 ( 5.287 0.102 -10.785) 12.012 6.170 ( -2.757 -4.296 -4.585) 6.862 6.262 ( -4.670 0.257 -8.914) 10.067 6.572 ( 0.614 3.226 14.248) 14.621 6.641 ( -12.722 0.962 4.729) 13.607 6.693 ( -2.085 -2.757 9.390) 10.006 6.881 ( -0.555 1.637 3.771) 4.148 7.060 ( -1.288 3.703 4.385) 5.882 7.239 ( 1.021 6.086 15.482) 16.667 7.287 ( -2.451 5.013 22.917) 23.586 7.371 ( -6.601 3.406 14.965) 16.707 7.395 ( 6.241 10.366 4.030) 12.753 7.519 ( 0.894 0.968 -8.057) 8.164 7.641 ( 5.134 0.636 7.451) 9.071 7.848 ( 2.503 8.109 -0.930) 8.537 7.885 ( 2.276 -2.704 2.684) 4.438 7.999 ( -1.747 1.897 12.490) 12.753 8.051 ( -0.523 1.774 2.499) 3.109 8.185 ( -1.926 0.080 1.499) 2.441 8.339 ( -1.959 -4.684 7.203) 8.813 8.487 ( -1.034 6.002 -7.863) 9.945 8.522 ( -0.482 -1.186 15.891) 15.943 8.773 ( 1.049 1.178 -5.670) 5.885 8.846 ( 0.160 -1.055 -4.995) 5.107 8.900 ( 2.409 0.422 -2.959) 3.839 8.996 ( 2.604 -4.387 -9.146) 10.473 9.053 ( 2.299 -1.906 -10.037) 10.472 9.103 ( 2.402 -0.989 -13.149) 13.403 9.324 ( 5.466 -8.470 -5.800) 11.630 9.439 ( 5.307 -3.796 -7.252) 9.755 9.586 ( 3.121 -7.480 -4.953) 9.499 9.828 ( -2.158 -0.298 0.964) 2.382 9.900 ( -0.901 -5.432 1.956) 5.843 10.128 ( -0.401 6.720 1.675) 6.938 10.344 ( 1.246 0.273 3.312) 3.549 10.428 ( -8.978 -1.028 -1.096) 9.103 10.522 ( 3.382 5.472 2.944) 7.074 10.647 ( -0.055 -0.940 -0.785) 1.226 10.762 ( -0.516 -6.101 -5.404) 8.166 10.869 ( 3.570 -1.839 0.519) 4.050 10.957 ( -7.368 -0.577 -1.883) 7.626 11.047 ( -0.272 0.582 -9.133) 9.155 11.096 ( 3.761 0.916 -6.447) 7.520 11.659 ( -5.921 -3.579 3.331) 7.679 11.777 ( 4.757 -0.395 -0.164) 4.776 12.013 ( 2.885 0.065 7.364) 7.909 12.132 ( -2.711 -6.112 4.609) 8.121 12.186 ( -0.980 -4.532 3.974) 6.107 12.267 ( -8.478 1.079 2.486) 8.900 12.468 ( 11.255 0.140 -6.867) 13.185 12.553 ( 1.597 -6.777 -9.426) 11.719 12.959 ( -1.093 8.304 4.773) 9.640 13.092 ( -2.434 6.736 -3.041) 7.782 13.392 ( 1.115 1.544 0.542) 1.980 13.623 ( -8.518 1.635 7.992) 11.795 13.887 ( 0.115 -3.577 -2.568) 4.405 13.940 ( 2.141 2.751 -13.295) 13.744 14.131 ( 1.051 5.211 -6.239) 8.196 14.293 ( 0.237 1.471 -10.574) 10.678 14.791 ( -3.628 -20.976 13.079) 24.984 15.089 ( 8.271 -11.284 -1.646) 14.087 15.567 ( -0.038 9.889 0.433) 9.898 15.643 ( -3.880 -1.126 -4.311) 5.908 15.845 ( -8.208 7.331 1.772) 11.147 15.972 ( 11.373 5.870 0.596) 12.812 16.068 ( 0.515 3.695 0.493) 3.763 16.206 ( 0.671 -1.373 4.749) 4.989 16.472 ( 0.819 -2.973 0.501) 3.124 16.538 ( -2.683 0.012 -0.772) 2.792 17.146 ( 1.338 -7.114 7.316) 10.292 17.282 ( -6.015 -9.348 2.632) 11.423 19.057 ( -5.218 8.065 22.638) 24.592 19.753 ( -14.293 -0.948 24.045) 27.988 20.276 ( 1.828 -6.187 18.124) 19.238 20.392 ( -8.732 -4.042 23.505) 25.398 20.493 ( 6.060 8.505 -34.801) 36.334 20.931 ( 14.259 3.979 -32.652) 35.851 21.391 ( 1.492 -3.446 -28.304) 28.552 21.488 ( 9.536 -2.261 -29.076) 30.684 25.349 ( -6.315 -0.502 2.537) 6.824 25.425 ( -2.627 -2.342 0.283) 3.531 25.543 ( 3.991 2.136 -2.102) 4.991 25.591 ( 8.945 1.125 -4.311) 9.994 26.140 ( -3.571 0.971 16.115) 16.534 26.241 ( 3.505 -1.034 17.432) 17.811 26.904 ( 1.833 0.631 -21.054) 21.143 26.950 ( -0.664 -0.626 -17.259) 17.284 28.447 ( 1.755 3.393 1.598) 4.141 28.582 ( -3.655 0.905 -6.219) 7.270 28.896 ( -1.292 0.831 0.518) 1.621 28.910 ( 1.719 0.399 -0.401) 1.809 29.608 ( -13.767 1.360 2.312) 14.026 29.727 ( 18.469 1.321 -3.509) 18.846 30.145 ( 8.980 1.702 10.034) 13.572 30.595 ( -11.079 -3.402 -6.051) 13.074 31.009 ( 1.583 3.414 11.907) 12.487 31.244 ( -0.402 1.529 -0.469) 1.649 31.474 ( 6.535 -4.101 12.147) 14.390 31.537 ( 0.096 -1.873 7.188) 7.429 31.825 ( -1.909 0.887 2.332) 3.142 31.972 ( -4.238 5.178 -8.859) 11.102 32.219 ( 1.333 -0.894 13.122) 13.220 32.668 ( -8.614 -4.130 -9.594) 13.539 ======================= Grid point 146 (79/104) ======================= q-point: ( 0.20 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.972 ( -1.773 -4.415 16.316) 16.995 3.218 ( -8.103 6.464 13.229) 16.806 3.463 ( -2.123 -1.770 -6.941) 7.471 3.664 ( 1.198 -7.412 2.777) 8.005 3.808 ( -4.219 -4.373 -2.334) 6.510 3.944 ( -10.081 -5.611 10.058) 15.306 4.070 ( 6.180 5.034 2.453) 8.339 4.183 ( 5.268 -1.960 13.889) 14.983 4.283 ( 0.981 -1.536 4.518) 4.871 4.414 ( -3.534 0.845 -4.573) 5.841 4.919 ( -7.604 -5.717 5.352) 10.916 5.123 ( -2.508 -3.052 4.572) 6.042 5.264 ( -8.534 5.353 -0.794) 10.105 5.471 ( -2.964 16.807 7.960) 18.832 5.593 ( -3.599 0.108 -2.965) 4.664 5.752 ( -3.335 9.920 5.639) 11.889 5.803 ( 10.393 4.602 0.355) 11.372 6.102 ( -2.178 -1.650 -2.266) 3.550 6.143 ( 0.124 -3.835 0.182) 3.842 6.220 ( 6.448 6.225 -7.975) 11.997 6.506 ( -4.273 6.222 18.455) 19.939 6.707 ( -1.379 -2.729 17.301) 17.569 6.850 ( 11.950 -0.612 6.255) 13.502 6.978 ( 7.339 4.749 -5.079) 10.110 7.109 ( 5.410 2.014 0.085) 5.774 7.299 ( -1.422 1.204 13.537) 13.664 7.304 ( -5.064 -2.161 10.289) 11.669 7.359 ( 0.223 0.629 9.680) 9.703 7.453 ( -2.544 2.612 9.268) 9.960 7.558 ( 2.688 9.198 4.977) 10.798 7.833 ( 5.188 -1.379 7.341) 9.095 7.916 ( 0.913 0.579 7.277) 7.357 7.963 ( 1.693 1.846 7.880) 8.269 8.014 ( 4.854 3.896 -6.016) 8.657 8.135 ( 4.972 0.829 13.223) 14.151 8.211 ( 5.660 1.939 -4.352) 7.399 8.355 ( 0.519 -2.487 1.855) 3.146 8.424 ( -1.727 5.540 0.533) 5.827 8.544 ( -4.221 -2.266 11.305) 12.278 8.737 ( -2.777 2.399 -7.777) 8.599 8.779 ( -0.122 -0.194 -6.743) 6.747 8.857 ( -5.398 -1.865 -2.147) 6.102 9.017 ( -1.986 0.565 -9.240) 9.468 9.052 ( 3.708 -3.271 -8.771) 10.069 9.104 ( 3.147 1.251 -15.461) 15.828 9.378 ( 2.345 -10.636 -5.741) 12.312 9.541 ( 6.248 -4.660 -11.579) 13.958 9.629 ( 2.921 -4.538 -3.786) 6.592 9.736 ( -3.975 -4.213 -0.456) 5.810 9.837 ( -3.501 -2.639 -0.949) 4.486 10.018 ( -10.279 5.588 1.874) 11.849 10.213 ( -7.165 0.587 -2.189) 7.515 10.294 ( -5.324 3.606 -0.021) 6.430 10.566 ( -4.409 4.321 -3.920) 7.313 10.647 ( 5.056 -1.514 3.801) 6.504 10.796 ( -4.365 -1.111 -2.852) 5.331 10.828 ( 3.219 -7.584 -1.298) 8.341 10.940 ( 0.159 1.931 -3.782) 4.250 10.982 ( 2.526 -1.426 -4.317) 5.201 11.149 ( 0.266 -2.926 1.378) 3.245 11.586 ( -1.366 -5.934 1.704) 6.323 11.870 ( 0.644 -3.387 5.216) 6.253 11.908 ( -11.072 -0.441 0.740) 11.106 12.038 ( -2.822 0.607 3.820) 4.788 12.201 ( 3.114 -4.696 5.950) 8.194 12.277 ( 3.573 0.668 -0.081) 3.635 12.603 ( 5.985 -1.978 -10.135) 11.935 12.740 ( 8.648 3.686 -3.226) 9.939 12.955 ( 2.317 1.390 4.249) 5.035 13.073 ( 1.732 7.250 1.171) 7.545 13.363 ( -5.450 -2.005 2.328) 6.256 13.500 ( -4.108 -4.175 3.240) 6.693 13.772 ( -2.788 2.191 -4.804) 5.971 13.973 ( 2.724 2.341 -8.387) 9.123 14.109 ( -4.362 4.906 -0.529) 6.586 14.346 ( 8.388 2.290 -10.485) 13.621 14.828 ( 4.400 -18.463 8.775) 20.910 15.107 ( -12.288 -12.807 0.261) 17.751 15.401 ( -2.453 4.250 -8.286) 9.630 15.589 ( -6.791 6.377 -1.523) 9.439 15.772 ( 4.248 8.917 0.543) 9.892 15.985 ( 0.014 0.636 2.706) 2.780 16.168 ( 0.581 2.681 0.683) 2.827 16.333 ( 5.336 4.034 -4.083) 7.837 16.427 ( -4.361 -5.342 4.795) 8.399 16.688 ( 13.171 -5.557 8.454) 16.608 17.052 ( -11.837 -4.756 6.538) 14.335 17.187 ( -4.633 -4.632 5.589) 8.612 19.066 ( -4.581 7.750 28.386) 29.779 19.526 ( -15.343 1.429 21.695) 26.611 20.299 ( -9.139 -3.028 21.678) 23.720 20.341 ( 1.103 -3.105 3.291) 4.657 20.489 ( 4.663 5.959 -18.727) 20.197 21.062 ( 11.664 1.178 -31.554) 33.661 21.243 ( -2.452 -1.164 -30.859) 30.978 21.542 ( 7.528 -2.846 -28.295) 29.417 25.293 ( -0.233 0.426 4.726) 4.751 25.456 ( 4.205 -2.452 3.444) 5.963 25.729 ( 13.652 1.680 -6.830) 15.357 25.878 ( 18.298 -0.645 -9.636) 20.691 26.117 ( -5.095 1.390 15.140) 16.035 26.343 ( -2.026 -3.090 17.091) 17.486 26.703 ( -8.743 1.935 -16.485) 18.760 26.879 ( -0.122 -0.801 -21.299) 21.315 28.520 ( 2.453 0.973 -1.042) 2.837 28.551 ( 4.256 2.184 -0.099) 4.785 28.811 ( -5.318 2.502 -0.008) 5.878 28.945 ( 0.701 -1.122 -0.517) 1.420 29.399 ( -5.655 7.587 -0.150) 9.464 30.139 ( 19.281 -4.470 -2.846) 19.996 30.308 ( -10.764 -1.545 -7.355) 13.128 30.337 ( 2.288 -2.280 9.600) 10.129 31.113 ( 2.226 1.787 6.737) 7.317 31.257 ( 3.451 5.050 -1.642) 6.334 31.449 ( -3.621 -3.148 5.038) 6.957 31.716 ( -8.877 2.641 -1.896) 9.454 31.811 ( 12.404 -3.476 7.002) 14.662 31.871 ( -1.125 3.588 1.130) 3.927 32.267 ( -4.724 -2.949 13.885) 14.960 32.371 ( -12.935 -1.104 -1.899) 13.120 ======================= Grid point 147 (80/104) ======================= q-point: (-0.60 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.951 ( -7.086 -2.925 16.584) 18.270 3.026 ( -11.252 14.440 8.264) 20.085 3.362 ( -5.355 8.728 -5.320) 11.539 3.582 ( -4.529 0.288 -8.231) 9.399 3.681 ( -8.351 -3.448 2.518) 9.379 3.838 ( -0.178 -6.976 11.869) 13.768 3.993 ( -5.491 1.223 -4.625) 7.283 4.244 ( -1.671 12.834 -4.308) 13.640 4.343 ( 2.137 -7.174 12.249) 14.355 4.767 ( 18.155 -7.132 15.709) 25.045 4.834 ( -1.931 -1.494 -0.052) 2.442 4.994 ( -10.411 5.054 -5.332) 12.742 5.161 ( 1.134 -4.493 15.312) 15.998 5.293 ( -4.410 0.769 -1.152) 4.622 5.635 ( 2.433 4.894 7.326) 9.140 5.835 ( 4.720 1.556 3.036) 5.824 6.000 ( 2.221 -0.054 3.215) 3.908 6.058 ( 1.163 -0.446 -5.230) 5.376 6.196 ( 1.882 -2.366 0.958) 3.171 6.369 ( 10.532 9.600 -6.540) 15.680 6.560 ( -1.144 8.843 20.912) 22.734 6.744 ( -0.909 0.116 17.786) 17.809 7.063 ( 3.082 1.188 -2.524) 4.157 7.087 ( 4.967 1.668 -2.709) 5.898 7.183 ( -4.607 -5.189 2.491) 7.373 7.229 ( 2.649 6.014 2.133) 6.909 7.309 ( -5.341 -0.305 18.211) 18.980 7.405 ( -3.318 3.825 14.767) 15.610 7.515 ( 6.607 0.302 3.512) 7.488 7.576 ( -3.336 4.438 7.335) 9.199 7.839 ( -5.713 0.447 1.370) 5.892 7.868 ( -5.595 -0.877 5.305) 7.760 8.008 ( -4.074 -2.080 23.437) 23.879 8.153 ( 6.774 -0.823 -7.439) 10.094 8.234 ( -1.515 5.558 -7.866) 9.750 8.321 ( -10.321 0.519 6.788) 12.364 8.371 ( 3.835 5.148 19.565) 20.591 8.450 ( 5.215 -1.982 -0.993) 5.667 8.548 ( 8.384 -2.199 -0.029) 8.668 8.651 ( -9.529 -0.583 -0.318) 9.552 8.735 ( 2.375 2.490 0.234) 3.449 8.800 ( 3.545 3.309 3.216) 5.819 8.891 ( -1.859 -1.284 -11.757) 11.972 9.089 ( 3.465 -1.831 -10.804) 11.493 9.121 ( 6.215 0.611 -13.662) 15.022 9.329 ( -5.220 -9.700 -5.347) 12.245 9.507 ( -2.467 -2.438 -15.395) 15.781 9.562 ( -5.535 -3.935 -5.865) 8.973 9.646 ( -10.783 -5.757 -0.970) 12.262 9.839 ( 2.194 4.794 0.835) 5.338 9.926 ( 7.593 0.155 -10.880) 13.269 10.097 ( -1.403 -0.213 -7.086) 7.226 10.193 ( -2.174 3.991 -0.200) 4.549 10.462 ( -2.152 7.372 -7.280) 10.582 10.702 ( 0.954 -4.781 -1.277) 5.040 10.777 ( 0.691 -5.193 2.570) 5.835 10.878 ( 1.795 -1.369 -1.237) 2.574 10.909 ( 1.099 -0.279 -0.693) 1.328 11.045 ( 2.612 -1.347 -0.193) 2.946 11.150 ( 0.014 -4.479 1.316) 4.668 11.601 ( 0.826 -8.615 2.160) 8.920 11.761 ( -1.456 -4.339 -0.438) 4.598 11.854 ( -4.326 -7.622 8.150) 11.968 12.029 ( 1.137 0.022 -2.212) 2.487 12.255 ( -2.040 4.897 5.573) 7.694 12.362 ( 1.554 3.410 8.039) 8.869 12.630 ( -0.601 4.549 -4.037) 6.112 12.782 ( 3.425 3.000 -8.963) 10.053 13.093 ( 0.392 -2.887 12.774) 13.102 13.217 ( 11.972 -3.216 -6.887) 14.181 13.256 ( -1.031 -1.627 -3.373) 3.884 13.414 ( -3.662 -10.506 -2.007) 11.305 13.779 ( -0.371 3.242 5.495) 6.391 13.908 ( -6.333 5.238 3.816) 9.061 14.096 ( 10.698 7.137 -16.292) 20.756 14.496 ( 7.295 7.083 -10.080) 14.317 14.733 ( -11.851 -5.201 -2.774) 13.236 15.055 ( 4.291 -10.537 4.617) 12.278 15.242 ( -7.651 2.166 -10.815) 13.424 15.408 ( -5.308 3.713 -2.440) 6.922 15.970 ( 6.784 0.909 7.031) 9.813 16.048 ( 5.359 -1.192 3.805) 6.680 16.180 ( 0.348 0.344 2.570) 2.616 16.343 ( -5.644 -8.752 7.034) 12.567 16.389 ( 0.416 6.287 2.849) 6.915 16.791 ( -8.169 5.438 0.329) 9.819 17.006 ( 2.647 -9.025 9.617) 13.451 17.101 ( -0.606 -4.981 3.827) 6.310 19.134 ( -3.239 5.983 36.242) 36.876 19.346 ( -8.799 2.034 19.710) 21.680 20.207 ( -8.654 -1.543 21.538) 23.263 20.385 ( 2.128 -2.779 1.480) 3.800 20.524 ( 6.320 5.865 -16.853) 18.930 20.997 ( -3.907 -0.343 -36.189) 36.400 21.175 ( 10.619 1.564 -30.446) 32.283 21.552 ( 5.454 -3.610 -28.014) 28.768 25.377 ( 4.796 1.272 8.089) 9.489 25.588 ( 4.073 -2.211 8.520) 9.699 25.930 ( 4.140 0.905 -10.301) 11.139 26.067 ( -5.268 1.770 11.321) 12.612 26.148 ( 8.479 -2.281 -15.538) 17.847 26.301 ( -8.213 -2.996 13.925) 16.442 26.509 ( 1.506 1.904 -13.676) 13.890 26.774 ( 1.378 -2.928 -18.530) 18.810 28.574 ( 3.950 0.419 -1.881) 4.395 28.667 ( -2.827 3.604 -0.110) 4.582 28.721 ( 4.129 -1.205 3.962) 5.848 28.942 ( -0.562 -1.749 -1.243) 2.218 29.372 ( 2.886 11.531 0.558) 11.900 29.964 ( -14.305 3.747 -13.514) 20.033 30.361 ( -4.508 -6.564 12.994) 15.240 30.518 ( 13.797 -4.200 -1.600) 14.510 31.126 ( -2.668 -0.071 3.804) 4.647 31.289 ( -2.927 7.224 -4.462) 8.981 31.430 ( 0.423 -3.534 4.907) 6.062 31.638 ( 3.745 2.900 -1.916) 5.109 31.783 ( -9.116 -2.838 4.415) 10.519 31.926 ( -4.785 4.352 2.522) 6.942 32.201 ( -1.115 -5.623 13.619) 14.777 32.338 ( 7.412 -0.455 4.340) 8.602 ======================= Grid point 148 (81/104) ======================= q-point: (-0.40 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.856 ( -8.865 0.166 21.428) 23.190 2.868 ( -7.100 12.526 11.329) 18.321 3.197 ( -9.378 16.921 18.357) 26.669 3.542 ( 4.179 4.797 -6.063) 8.788 3.677 ( 6.854 -0.784 -2.666) 7.396 3.826 ( -2.853 -3.350 -5.777) 7.262 3.912 ( -1.757 -2.051 6.560) 7.094 4.193 ( -1.486 8.030 -3.760) 8.990 4.380 ( -4.033 -12.171 11.419) 17.170 4.858 ( 0.088 2.243 -0.383) 2.277 4.860 ( 6.167 1.120 -3.245) 7.058 5.130 ( 8.756 4.049 8.678) 12.976 5.171 ( 1.115 7.962 7.212) 10.801 5.417 ( 3.031 -10.968 6.793) 13.253 5.659 ( -1.986 -8.190 4.970) 9.784 5.880 ( -3.845 0.201 8.516) 9.346 5.992 ( 0.907 -0.179 -5.466) 5.544 6.064 ( 0.709 1.046 -6.698) 6.817 6.224 ( 1.495 -1.718 -4.086) 4.678 6.536 ( 5.837 -0.814 -9.515) 11.193 6.582 ( -2.929 5.615 11.906) 13.486 6.833 ( 1.543 0.761 12.334) 12.454 6.996 ( -8.624 5.086 7.020) 12.228 7.063 ( -9.419 0.342 19.880) 22.001 7.131 ( -1.975 3.129 -2.358) 4.388 7.229 ( 1.176 1.564 -5.291) 5.641 7.306 ( -9.851 5.103 32.733) 34.562 7.385 ( -3.146 4.511 0.508) 5.523 7.483 ( 0.173 4.757 -4.908) 6.837 7.615 ( -10.730 5.376 18.383) 21.954 7.720 ( 1.003 -2.778 -0.724) 3.041 7.822 ( 1.654 1.509 0.075) 2.240 7.915 ( -13.883 -3.858 18.338) 23.322 8.103 ( -5.616 4.848 -1.294) 7.531 8.164 ( -5.455 4.132 6.710) 9.584 8.239 ( 2.118 -2.804 -3.228) 4.772 8.439 ( -5.353 1.122 18.551) 19.340 8.486 ( -6.415 -0.380 10.109) 11.979 8.529 ( 3.875 1.193 -4.248) 5.873 8.724 ( 3.292 1.659 -1.609) 4.022 8.801 ( 1.858 -3.578 -2.860) 4.943 8.831 ( 2.785 -1.594 -3.609) 4.829 8.982 ( 8.165 -3.259 -3.413) 9.430 9.125 ( 2.126 -3.138 -1.105) 3.948 9.137 ( -4.190 -3.744 -13.671) 14.780 9.237 ( -6.616 0.398 -15.280) 16.656 9.329 ( 8.628 -1.652 -10.017) 13.324 9.457 ( 0.191 -2.515 -13.059) 13.301 9.509 ( 1.905 -5.118 3.416) 6.441 9.906 ( -2.488 -1.023 -0.789) 2.804 9.931 ( 4.772 5.271 1.316) 7.231 10.184 ( 0.874 7.275 1.620) 7.504 10.223 ( 11.623 1.408 -12.386) 17.044 10.474 ( 7.588 2.641 -11.353) 13.909 10.744 ( 3.466 -2.946 -1.749) 4.873 10.757 ( -5.980 -10.439 7.605) 14.232 10.841 ( 1.093 0.382 -8.295) 8.375 11.000 ( 2.137 -1.603 -1.711) 3.172 11.086 ( 1.273 -2.526 1.136) 3.048 11.167 ( 1.669 -1.146 -3.174) 3.765 11.639 ( 2.271 -5.585 0.939) 6.102 11.742 ( -0.618 -9.599 5.651) 11.156 11.871 ( 1.506 -1.842 1.470) 2.797 12.015 ( -2.069 -3.760 -0.058) 4.292 12.193 ( -4.422 8.135 9.607) 13.343 12.397 ( -0.270 0.489 3.504) 3.548 12.615 ( -1.318 4.438 -1.147) 4.769 12.749 ( -3.172 0.532 -7.784) 8.422 13.067 ( -3.837 -5.403 2.597) 7.118 13.198 ( -3.243 -4.319 -0.731) 5.450 13.415 ( 2.305 -3.887 -1.644) 4.809 13.496 ( 14.250 -4.489 -9.404) 17.653 13.641 ( -5.991 1.446 3.874) 7.279 14.028 ( 7.764 9.410 8.057) 14.620 14.290 ( 10.480 5.255 -15.867) 19.728 14.382 ( -3.198 6.779 -19.858) 21.226 14.738 ( 0.509 -1.189 6.553) 6.680 14.934 ( 0.775 0.521 -5.703) 5.779 15.079 ( -9.348 0.738 3.141) 9.889 15.504 ( 11.179 -6.342 -5.349) 13.921 16.032 ( -2.480 1.256 7.396) 7.901 16.134 ( -8.932 -2.146 6.518) 11.264 16.167 ( 1.046 -1.918 5.516) 5.933 16.277 ( -3.706 1.206 7.831) 8.747 16.386 ( 1.291 1.081 -3.282) 3.689 16.776 ( 6.758 5.053 0.002) 8.438 16.878 ( -9.815 -3.901 7.493) 12.950 17.260 ( 6.487 -12.594 1.316) 14.227 19.139 ( -8.012 5.038 22.633) 24.532 19.477 ( 7.768 -0.498 37.724) 38.519 20.127 ( -7.816 0.128 21.045) 22.450 20.435 ( -1.214 -4.922 13.886) 14.783 20.612 ( 11.488 7.252 -27.686) 30.840 20.753 ( -1.722 3.744 -40.295) 40.505 21.273 ( 11.341 -0.394 -30.099) 32.167 21.526 ( 4.226 -4.170 -28.081) 28.701 25.524 ( 3.204 1.060 10.140) 10.687 25.642 ( -3.467 -0.897 10.178) 10.790 25.771 ( -10.108 1.434 -11.976) 15.737 25.997 ( -10.407 -2.314 -5.858) 12.164 26.033 ( -5.570 0.271 1.730) 5.839 26.162 ( -7.697 -1.730 13.397) 15.547 26.664 ( 14.431 0.571 -16.721) 22.094 26.853 ( 11.009 -3.556 -14.545) 18.585 28.534 ( -5.442 3.149 0.349) 6.297 28.688 ( 5.741 1.030 -1.830) 6.113 28.859 ( 3.904 -2.259 3.707) 5.839 28.900 ( -2.808 -3.331 -4.021) 5.928 29.471 ( 0.143 5.328 2.167) 5.753 29.677 ( -0.128 15.625 -9.572) 18.324 30.218 ( -13.082 -5.573 10.020) 17.395 30.758 ( 8.321 -4.141 0.461) 9.306 31.041 ( -5.888 1.432 7.036) 9.286 31.237 ( -0.244 2.878 0.758) 2.986 31.396 ( -12.674 -3.986 5.001) 14.196 31.519 ( -0.374 -1.342 4.755) 4.955 31.835 ( 2.984 0.515 4.473) 5.401 31.941 ( 5.858 5.853 -2.849) 8.757 32.148 ( -5.644 -2.165 10.168) 11.829 32.611 ( 12.966 -4.285 -3.961) 14.219 ======================= Grid point 149 (82/104) ======================= q-point: (-0.20 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.832 ( -2.167 4.926 17.621) 18.425 2.853 ( -0.239 -2.237 27.677) 27.768 3.223 ( 0.811 13.463 31.440) 34.211 3.614 ( 2.437 -3.619 -7.823) 8.958 3.768 ( 2.447 5.769 -8.052) 10.203 3.862 ( 6.496 4.645 1.402) 8.108 3.920 ( 0.817 -5.710 7.808) 9.707 4.136 ( -3.336 -2.286 4.993) 6.426 4.377 ( 2.180 -4.139 -0.023) 4.678 4.918 ( 3.564 -0.022 5.599) 6.637 5.044 ( 4.940 -1.075 -6.919) 8.569 5.108 ( -3.030 8.354 -4.849) 10.124 5.278 ( -4.024 5.370 1.805) 6.949 5.378 ( -0.297 -0.705 15.919) 15.938 5.612 ( -7.824 -8.303 -2.971) 11.789 5.839 ( -0.735 0.535 9.045) 9.090 6.001 ( -0.109 -1.740 4.007) 4.370 6.067 ( 5.064 1.435 -15.124) 16.014 6.207 ( 0.041 -3.213 -5.429) 6.308 6.468 ( -8.277 -3.329 -13.847) 16.472 6.550 ( -3.944 4.386 13.525) 14.755 6.793 ( -11.071 -2.096 13.967) 17.945 6.898 ( -3.882 -1.269 6.795) 7.928 6.951 ( -4.735 1.956 -1.740) 5.410 7.115 ( -3.894 8.943 6.738) 11.855 7.182 ( -3.927 4.544 13.960) 15.197 7.214 ( -2.507 3.933 7.167) 8.551 7.341 ( -6.066 7.301 19.508) 21.695 7.471 ( 1.420 4.564 -5.940) 7.624 7.507 ( -6.732 4.158 15.927) 17.784 7.671 ( -12.177 0.878 15.227) 19.517 7.760 ( 3.369 1.289 -3.522) 5.041 7.882 ( -0.454 4.099 6.507) 7.704 7.994 ( -1.297 3.138 -1.841) 3.862 8.098 ( -4.976 5.076 6.980) 9.963 8.234 ( -1.627 -2.254 -0.608) 2.845 8.386 ( -5.566 -3.642 7.749) 10.212 8.444 ( -1.830 -1.365 19.744) 19.876 8.544 ( -0.210 3.647 -7.508) 8.349 8.756 ( 1.811 0.332 -1.340) 2.277 8.824 ( 1.355 -0.191 -1.062) 1.732 8.857 ( 2.403 -1.179 -4.311) 5.074 8.989 ( 0.387 -4.416 -10.593) 11.483 9.076 ( 1.454 -2.683 -10.729) 11.155 9.122 ( 2.600 -3.156 -13.280) 13.895 9.221 ( 4.845 -3.181 -1.659) 6.028 9.376 ( 3.620 -2.410 -9.924) 10.835 9.526 ( 4.634 -9.014 -2.146) 10.360 9.719 ( 11.100 -1.358 1.296) 11.258 9.888 ( 1.290 -1.865 -2.474) 3.356 10.053 ( 5.168 6.334 2.386) 8.516 10.243 ( 4.513 4.134 1.287) 6.254 10.401 ( 7.459 7.378 -1.156) 10.555 10.576 ( 2.012 -5.574 -8.493) 10.356 10.633 ( -4.603 -7.400 3.965) 9.574 10.813 ( 1.559 -2.325 -1.538) 3.194 10.857 ( 1.826 -1.016 -6.290) 6.628 10.973 ( 1.103 -0.399 -5.790) 5.907 11.080 ( -3.013 -1.918 0.426) 3.597 11.158 ( -1.065 1.208 -7.207) 7.385 11.689 ( 2.588 -3.036 -0.034) 3.990 11.793 ( -6.543 1.002 3.678) 7.573 11.860 ( 6.888 -5.022 6.426) 10.675 12.060 ( 5.627 -3.729 1.288) 6.872 12.162 ( -2.642 0.136 6.279) 6.813 12.397 ( -1.436 -3.303 0.099) 3.603 12.473 ( -7.026 -1.074 -3.003) 7.716 12.664 ( -5.360 -2.543 -3.567) 6.923 12.973 ( -3.306 4.822 1.687) 6.085 13.153 ( -1.272 2.043 -3.347) 4.122 13.382 ( -1.204 3.013 -0.722) 3.324 13.664 ( 2.231 -3.345 3.403) 5.268 13.738 ( 11.841 -3.687 -8.487) 15.028 14.059 ( -7.004 8.788 1.319) 11.315 14.204 ( -1.761 6.491 -17.598) 18.840 14.383 ( -0.717 4.480 -10.594) 11.525 14.755 ( 1.878 -14.865 8.189) 17.075 14.976 ( 0.877 -6.775 0.254) 6.837 15.246 ( 22.238 3.058 1.157) 22.477 15.672 ( 6.089 -3.699 -4.317) 8.330 15.883 ( -9.869 12.005 6.055) 16.680 16.008 ( -6.709 4.235 6.051) 9.978 16.178 ( -5.996 0.732 1.934) 6.342 16.198 ( -0.940 -1.257 3.969) 4.268 16.434 ( 3.814 -2.501 -6.401) 7.859 16.670 ( -9.586 -0.981 5.357) 11.025 17.001 ( 8.688 -3.056 4.874) 10.420 17.338 ( 0.343 -13.105 0.744) 13.131 19.081 ( -6.277 6.833 20.348) 22.364 19.813 ( 1.411 -6.233 32.649) 33.268 20.106 ( -0.281 0.218 23.518) 23.521 20.444 ( -5.779 -5.096 22.272) 23.567 20.572 ( 2.752 7.272 -41.792) 42.509 20.763 ( 15.133 6.204 -33.641) 37.406 21.379 ( 10.968 -1.449 -29.283) 31.304 21.480 ( 3.691 -4.225 -28.365) 28.914 25.506 ( -7.997 0.920 2.923) 8.564 25.546 ( -4.531 -0.186 -3.882) 5.970 25.577 ( -5.949 0.647 5.204) 7.930 25.628 ( -12.932 -2.190 -6.567) 14.668 26.074 ( 2.992 0.907 13.807) 14.156 26.136 ( -2.321 0.065 15.500) 15.673 26.850 ( 10.560 0.591 -21.725) 24.163 26.989 ( 5.758 -2.919 -13.640) 15.090 28.449 ( -2.396 3.365 0.799) 4.207 28.735 ( -6.026 -0.597 -7.122) 9.348 28.819 ( 4.096 -0.330 -1.424) 4.349 28.920 ( 0.507 -0.680 1.585) 1.798 29.461 ( 6.210 7.085 -2.829) 9.837 29.872 ( 9.870 6.847 6.127) 13.485 29.932 ( -14.482 -1.484 5.930) 15.719 30.809 ( -4.536 -3.959 -3.592) 7.011 30.978 ( -3.583 1.607 8.899) 9.726 31.245 ( 0.118 0.921 3.906) 4.015 31.274 ( 1.183 -1.296 11.599) 11.731 31.551 ( -0.972 -2.451 7.098) 7.572 31.860 ( -2.268 0.002 4.353) 4.909 32.021 ( 2.449 2.330 -5.038) 6.067 32.139 ( 1.328 2.020 5.729) 6.218 32.768 ( 3.740 -5.088 -9.646) 11.529 ======================= Grid point 150 (83/104) ======================= q-point: ( 0.00 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.901 ( -1.858 2.785 10.295) 10.826 3.038 ( 7.243 -0.375 22.028) 23.191 3.348 ( -1.040 -12.800 -5.436) 13.945 3.497 ( -1.642 -9.921 6.342) 11.888 3.680 ( -0.899 -0.360 17.483) 17.510 3.903 ( -2.397 -2.839 10.003) 10.671 4.081 ( -2.210 7.846 1.470) 8.283 4.248 ( 2.003 9.226 -0.331) 9.447 4.451 ( -2.088 2.724 -4.540) 5.691 4.594 ( -7.198 -2.921 -4.958) 9.216 4.963 ( -2.700 -1.172 0.937) 3.089 5.050 ( -2.270 -5.072 -1.893) 5.871 5.476 ( 12.509 3.631 8.582) 15.598 5.533 ( -8.494 5.655 8.130) 13.046 5.722 ( -1.268 7.703 1.553) 7.960 5.793 ( -2.026 -5.503 8.434) 10.272 5.966 ( -1.407 0.519 -1.504) 2.124 6.056 ( -5.529 -6.206 -6.679) 10.663 6.169 ( 9.959 4.210 -6.687) 12.713 6.268 ( 0.760 2.567 -6.507) 7.036 6.616 ( 0.139 1.785 14.096) 14.209 6.651 ( -1.559 -0.879 11.582) 11.720 6.753 ( -10.763 8.357 -3.328) 14.027 6.928 ( -1.300 2.974 2.525) 4.112 7.130 ( -3.816 3.773 14.176) 15.158 7.283 ( -2.196 -0.000 23.882) 23.983 7.446 ( -2.474 5.670 -0.628) 6.218 7.483 ( -3.621 8.193 16.649) 18.906 7.580 ( 2.974 6.639 5.389) 9.053 7.615 ( -3.461 10.390 11.852) 16.137 7.682 ( 3.450 6.328 3.874) 8.183 7.851 ( 2.424 -1.979 4.921) 5.832 7.956 ( -1.304 0.774 1.672) 2.257 8.014 ( 0.497 0.198 4.851) 4.881 8.083 ( 0.473 1.444 4.358) 4.615 8.186 ( -1.685 -2.453 3.065) 4.272 8.279 ( -3.746 2.977 5.302) 7.142 8.493 ( -0.266 -2.078 8.352) 8.610 8.583 ( 0.908 3.210 -5.819) 6.708 8.756 ( 2.960 -4.164 -12.456) 13.463 8.834 ( -0.669 -0.197 1.229) 1.413 8.893 ( 1.982 -1.125 1.579) 2.773 8.951 ( 3.195 1.031 -10.261) 10.796 8.989 ( 1.605 -5.464 -7.930) 9.763 9.038 ( 4.571 -6.021 -9.021) 11.769 9.162 ( 3.391 -7.213 -7.963) 11.267 9.325 ( 3.363 -5.686 -7.968) 10.350 9.432 ( 4.742 -8.096 -4.569) 10.436 9.809 ( -3.396 -1.509 3.168) 4.884 9.819 ( -0.427 -2.733 2.214) 3.543 10.250 ( -0.890 6.121 1.678) 6.409 10.354 ( 1.154 1.166 -2.577) 3.055 10.474 ( -1.146 4.216 -4.157) 6.031 10.586 ( -0.932 0.685 -0.553) 1.282 10.621 ( 3.750 -1.989 -3.566) 5.544 10.713 ( -5.335 1.568 -2.722) 6.191 10.796 ( 4.935 -4.100 0.452) 6.432 10.924 ( -6.301 -3.458 -1.782) 7.405 11.054 ( 1.105 0.354 -3.196) 3.400 11.101 ( -1.005 -0.406 -3.519) 3.682 11.599 ( -4.967 -2.149 0.083) 5.413 11.713 ( 2.654 -6.331 -2.685) 7.371 12.002 ( 4.651 0.403 6.540) 8.035 12.065 ( -1.535 -1.429 8.050) 8.319 12.144 ( 1.386 0.033 -1.717) 2.206 12.255 ( -10.935 -2.697 1.066) 11.313 12.453 ( 9.049 -1.175 -10.957) 14.259 12.477 ( 8.372 -1.589 -8.799) 12.249 13.089 ( -2.230 5.411 0.428) 5.868 13.166 ( 0.036 0.839 -4.701) 4.775 13.504 ( -5.843 9.464 10.477) 15.280 13.626 ( -5.094 -1.020 6.702) 8.480 13.812 ( 3.867 -3.051 1.034) 5.033 14.034 ( -6.206 5.410 -8.556) 11.874 14.157 ( 4.423 -5.808 1.432) 7.440 14.291 ( -4.720 -0.999 -5.096) 7.018 14.563 ( -2.513 -0.432 0.537) 2.606 14.858 ( 4.864 -12.204 -6.523) 14.668 15.644 ( -1.831 0.960 -4.447) 4.904 15.656 ( 8.545 1.258 -4.056) 9.542 15.957 ( -6.643 4.680 2.405) 8.474 16.026 ( -5.919 0.610 0.320) 5.959 16.159 ( 4.996 0.080 8.216) 9.616 16.219 ( 2.881 4.609 -1.354) 5.601 16.417 ( -1.238 -1.528 6.199) 6.503 16.527 ( -0.316 -1.392 -5.372) 5.558 16.999 ( -0.137 -6.165 6.130) 8.695 17.103 ( -0.010 -8.787 2.031) 9.018 19.256 ( -5.764 12.609 27.250) 30.574 19.687 ( -9.902 -7.030 27.289) 29.869 20.187 ( -2.699 -1.942 24.759) 24.981 20.301 ( -7.806 -5.292 23.944) 25.734 20.685 ( 6.885 11.382 -39.083) 41.285 20.981 ( 11.194 -0.345 -33.653) 35.468 21.328 ( 4.035 -1.827 -30.132) 30.456 21.429 ( 9.280 -3.959 -29.992) 31.644 25.342 ( -5.422 -0.093 0.595) 5.455 25.381 ( -2.955 -2.143 -0.875) 3.754 25.583 ( 4.689 1.901 -1.238) 5.209 25.608 ( 7.494 0.569 -2.452) 7.906 26.163 ( -2.578 1.438 15.105) 15.391 26.217 ( 1.453 -1.397 15.740) 15.869 26.917 ( 1.236 0.705 -18.277) 18.332 26.939 ( 1.289 -0.539 -17.013) 17.070 28.525 ( 1.178 4.405 -0.054) 4.560 28.599 ( -2.922 0.615 -4.472) 5.377 28.898 ( 1.330 -0.174 0.515) 1.437 28.915 ( 0.216 -0.422 0.244) 0.533 29.646 ( -7.003 2.648 3.320) 8.190 29.738 ( 10.283 -0.728 1.476) 10.414 30.216 ( 3.981 6.153 -0.040) 7.329 30.501 ( -8.316 -6.658 -7.592) 13.081 31.100 ( 2.360 6.214 12.270) 13.955 31.293 ( -0.059 3.787 2.050) 4.307 31.370 ( 3.779 -6.827 12.132) 14.424 31.477 ( 1.820 -4.503 5.746) 7.524 31.875 ( -1.655 4.271 5.458) 7.126 32.031 ( -1.832 -0.652 0.267) 1.963 32.247 ( -1.720 5.493 1.949) 6.077 32.557 ( -6.705 -7.624 -9.004) 13.570 ======================= Grid point 151 (84/104) ======================= q-point: ( 0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.929 ( -0.749 1.580 10.076) 10.227 3.273 ( 5.067 -6.438 1.853) 8.400 3.376 ( 2.986 -4.033 7.794) 9.270 3.473 ( 2.323 -10.683 4.464) 11.809 3.746 ( -6.563 1.758 3.468) 7.628 3.886 ( -2.832 -2.048 10.363) 10.937 4.131 ( 10.768 5.288 13.036) 17.716 4.242 ( -0.821 2.676 2.417) 3.699 4.304 ( -10.288 5.938 -1.743) 12.006 4.506 ( -0.570 2.704 2.617) 3.806 4.812 ( -10.136 -3.394 4.491) 11.594 5.011 ( -3.492 -7.750 -1.465) 8.626 5.365 ( -4.645 7.241 -1.318) 8.703 5.620 ( -12.715 0.968 -1.346) 12.822 5.665 ( -2.768 2.909 9.214) 10.051 5.851 ( 10.341 0.805 3.573) 10.971 5.914 ( -0.077 0.633 -3.869) 3.922 6.012 ( 1.865 -4.598 0.799) 5.026 6.139 ( -4.380 6.739 -14.443) 16.529 6.378 ( 7.790 6.796 0.908) 10.377 6.644 ( -0.508 7.795 16.340) 18.111 6.727 ( 2.575 4.525 11.902) 12.991 6.822 ( 7.730 -1.443 11.818) 14.195 6.994 ( 7.341 -5.272 -1.792) 9.213 7.146 ( 1.557 5.184 5.067) 7.415 7.321 ( -6.066 3.155 21.806) 22.853 7.396 ( -0.124 8.581 -4.072) 9.499 7.461 ( -3.024 6.494 10.360) 12.595 7.513 ( -3.518 5.080 13.287) 14.653 7.719 ( -2.543 7.555 16.501) 18.325 7.805 ( 5.333 -2.162 -2.567) 6.301 7.892 ( -2.389 -2.262 11.304) 11.773 7.959 ( -1.717 -0.908 11.322) 11.487 8.136 ( -0.102 -1.027 3.699) 3.840 8.152 ( 9.153 7.899 0.778) 12.116 8.229 ( 7.997 -3.633 3.068) 9.304 8.294 ( 6.081 1.318 -5.335) 8.196 8.455 ( -5.244 -2.742 6.223) 8.587 8.573 ( -2.803 4.279 -0.082) 5.116 8.770 ( 0.763 -0.302 -4.165) 4.245 8.785 ( 0.529 1.262 -8.484) 8.594 8.855 ( -4.819 -1.139 -1.464) 5.164 8.900 ( -2.801 -7.346 -1.012) 7.927 9.037 ( 2.305 1.082 -10.042) 10.360 9.125 ( 3.981 -0.430 -16.583) 17.060 9.203 ( 6.384 -6.986 -8.025) 12.408 9.407 ( 6.788 -7.488 -8.550) 13.238 9.481 ( 3.295 -9.803 -6.036) 11.975 9.696 ( -7.075 0.126 2.112) 7.385 9.781 ( -1.276 -3.203 -1.978) 3.975 10.115 ( -11.992 5.240 1.134) 13.136 10.287 ( -5.779 4.207 -2.209) 7.482 10.400 ( -6.906 7.364 -1.120) 10.157 10.512 ( -0.239 -5.580 -0.603) 5.617 10.664 ( 2.002 1.029 1.275) 2.587 10.718 ( 3.291 -6.075 -1.162) 7.006 10.765 ( -5.785 -0.303 -3.204) 6.620 10.917 ( 3.846 -2.650 1.277) 4.842 11.006 ( -0.148 1.857 -9.181) 9.368 11.075 ( -2.267 -3.831 0.864) 4.535 11.533 ( -1.132 0.110 -1.068) 1.560 11.723 ( -2.321 -9.311 2.529) 9.923 11.895 ( -9.950 -0.520 -0.641) 9.984 11.977 ( -5.168 -5.113 -1.870) 7.507 12.224 ( 7.444 3.509 3.796) 9.063 12.284 ( 6.478 0.038 1.365) 6.621 12.614 ( 10.371 3.117 -9.188) 14.202 12.755 ( 14.667 -2.111 -4.962) 15.627 12.992 ( -5.282 3.374 1.393) 6.421 13.161 ( 1.257 -1.482 -4.105) 4.541 13.341 ( -13.379 2.723 9.783) 16.797 13.455 ( -10.311 -1.365 6.122) 12.069 13.821 ( -1.000 3.513 3.513) 5.068 13.986 ( 0.622 -1.487 -2.396) 2.887 14.248 ( 1.413 8.495 -6.416) 10.739 14.357 ( 9.301 -1.664 0.208) 9.451 14.570 ( 6.795 -7.090 4.954) 10.999 14.845 ( -4.976 -14.108 -5.006) 15.775 15.494 ( -6.175 5.906 -9.043) 12.441 15.648 ( -6.349 -0.123 -4.963) 8.060 15.913 ( 1.998 5.653 2.301) 6.422 15.991 ( 0.936 0.042 2.138) 2.335 16.210 ( -0.098 1.112 2.162) 2.433 16.287 ( -4.068 -6.464 7.800) 10.917 16.460 ( 5.252 6.137 -3.124) 8.661 16.579 ( 6.170 -4.681 4.821) 9.123 16.971 ( -4.420 -2.938 4.523) 6.973 17.077 ( -3.243 -6.554 1.298) 7.426 19.253 ( -6.608 11.426 30.549) 33.278 19.539 ( -13.894 -1.097 26.161) 29.642 20.225 ( -5.755 -4.345 22.144) 23.289 20.246 ( -5.076 -4.859 24.467) 25.456 20.668 ( 7.945 11.336 -37.778) 40.234 21.026 ( 7.098 -5.716 -33.956) 35.158 21.266 ( 3.612 4.027 -31.076) 31.544 21.468 ( 6.957 -5.005 -29.570) 30.787 25.309 ( 1.187 1.380 3.988) 4.383 25.401 ( 3.797 -3.180 3.281) 5.941 25.768 ( 13.051 2.471 -6.560) 14.814 25.856 ( 15.979 -1.752 -8.462) 18.166 26.153 ( -4.378 2.472 14.032) 14.906 26.275 ( -2.873 -3.879 14.876) 15.640 26.751 ( -7.282 3.036 -16.175) 17.997 26.854 ( -2.590 -1.915 -18.529) 18.807 28.548 ( 0.844 1.839 -1.518) 2.530 28.585 ( 2.964 0.968 0.456) 3.151 28.863 ( -3.544 2.702 -0.878) 4.542 28.925 ( 0.048 -0.978 -0.428) 1.068 29.584 ( -0.016 11.617 1.792) 11.755 30.010 ( 12.621 -9.259 2.058) 15.788 30.277 ( -4.170 -1.299 -4.227) 6.078 30.294 ( -1.909 -1.986 -0.682) 2.838 31.169 ( -0.875 4.095 7.131) 8.269 31.346 ( 0.155 -1.367 3.820) 4.060 31.404 ( 4.681 4.122 2.161) 6.601 31.691 ( 9.607 -6.552 -0.517) 11.640 31.812 ( -6.351 4.734 7.677) 11.031 31.934 ( -4.925 1.820 0.488) 5.273 32.220 ( -5.375 -1.059 9.330) 10.819 32.328 ( -8.843 -3.514 -1.321) 9.606 ======================= Grid point 152 (85/104) ======================= q-point: (-0.60 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.943 ( -2.637 3.749 11.717) 12.582 3.350 ( 4.458 0.804 -5.761) 7.328 3.368 ( -8.603 6.858 5.310) 12.217 3.562 ( 0.972 1.021 -3.702) 3.961 3.663 ( 3.207 -5.290 5.396) 8.209 3.842 ( -5.790 10.666 17.880) 21.610 4.048 ( -8.675 2.786 0.911) 9.157 4.245 ( -6.003 1.607 8.964) 10.907 4.424 ( 1.883 5.010 6.123) 8.132 4.643 ( 6.164 -12.784 2.709) 14.449 4.731 ( 13.205 -1.398 9.100) 16.098 4.940 ( -1.742 -14.714 9.387) 17.541 5.193 ( -14.438 12.806 -3.438) 19.603 5.380 ( 0.305 6.597 -12.178) 13.854 5.623 ( -3.835 -3.588 -0.470) 5.273 5.947 ( 2.157 -1.560 3.111) 4.095 5.972 ( -2.504 -0.211 -1.276) 2.818 6.032 ( 2.479 1.759 1.057) 3.218 6.144 ( 5.708 -0.489 -4.047) 7.015 6.452 ( 1.957 -4.705 -13.932) 14.835 6.739 ( -1.743 9.175 19.778) 21.872 6.828 ( 2.469 9.168 19.455) 21.648 7.014 ( 3.403 -3.925 14.505) 15.407 7.105 ( -0.733 -2.862 12.295) 12.645 7.202 ( 2.397 7.841 -1.470) 8.330 7.346 ( 0.951 10.131 -2.856) 10.569 7.431 ( 4.872 1.008 14.735) 15.553 7.442 ( -3.116 8.916 12.205) 15.433 7.568 ( 1.092 3.834 11.466) 12.139 7.680 ( -6.957 6.041 11.822) 14.989 7.814 ( -4.138 -4.320 2.110) 6.343 7.871 ( -2.902 1.712 6.197) 7.054 7.962 ( -6.173 -2.251 19.862) 20.921 8.112 ( 0.816 -2.045 -4.472) 4.984 8.241 ( -2.147 -4.825 2.220) 5.729 8.327 ( -7.446 -2.652 1.358) 8.020 8.431 ( 4.229 3.223 -0.719) 5.365 8.474 ( 7.910 3.539 5.120) 10.065 8.556 ( 5.043 1.933 -1.014) 5.495 8.676 ( -8.134 2.230 -0.354) 8.441 8.781 ( 0.644 -5.384 -1.624) 5.661 8.803 ( 1.877 2.820 -7.400) 8.139 8.857 ( 0.195 -0.518 -3.539) 3.582 9.018 ( 1.300 -0.682 -1.953) 2.443 9.130 ( 5.047 -2.154 -11.595) 12.828 9.189 ( -2.799 -6.840 -14.478) 16.255 9.439 ( -1.316 -4.001 -5.796) 7.164 9.515 ( -9.265 -1.616 -6.730) 11.565 9.546 ( -0.536 -0.843 -0.043) 1.000 9.852 ( 10.923 -6.823 -13.269) 18.491 9.919 ( -3.195 2.414 -1.213) 4.184 10.072 ( -7.450 -3.745 -3.972) 9.236 10.338 ( 0.397 11.288 2.169) 11.501 10.551 ( 1.849 -0.873 0.420) 2.088 10.645 ( -2.695 1.946 -2.943) 4.440 10.699 ( 0.617 -0.201 1.237) 1.397 10.818 ( 6.602 -6.840 0.755) 9.536 10.908 ( -3.281 -2.222 -3.592) 5.348 11.002 ( 0.316 -1.775 -3.781) 4.189 11.052 ( 1.804 -4.186 -3.092) 5.508 11.522 ( 0.671 -0.778 -1.106) 1.510 11.636 ( -4.809 -6.752 1.459) 8.417 11.777 ( -0.339 -1.395 -2.840) 3.183 11.913 ( 0.708 -8.333 -7.885) 11.494 12.366 ( 1.243 5.163 8.576) 10.087 12.428 ( 3.540 1.915 9.617) 10.425 12.717 ( -0.388 5.443 -2.876) 6.168 12.852 ( 1.326 2.954 -4.334) 5.410 13.036 ( -6.391 -2.814 8.862) 11.282 13.151 ( 7.671 -4.459 -4.007) 9.736 13.202 ( 5.077 -2.069 -7.163) 9.020 13.282 ( -7.717 -3.862 2.237) 8.914 13.826 ( -3.835 3.013 7.425) 8.883 13.977 ( -0.323 -0.382 6.022) 6.043 14.243 ( 6.371 9.235 -16.851) 20.244 14.589 ( 6.254 -2.412 4.467) 8.055 14.645 ( -1.593 0.503 -10.314) 10.449 14.877 ( 13.628 -8.266 6.851) 17.349 15.300 ( -8.666 4.349 -11.008) 14.669 15.433 ( -10.505 -0.845 -4.817) 11.588 16.012 ( 4.521 3.690 3.277) 6.692 16.045 ( 2.932 0.598 2.729) 4.050 16.192 ( -3.288 0.765 4.827) 5.891 16.244 ( -1.463 -1.643 7.715) 8.022 16.502 ( -0.018 4.682 0.714) 4.736 16.754 ( 4.455 -9.764 4.111) 11.493 16.888 ( -2.803 -1.434 1.880) 3.667 16.982 ( -5.593 -6.365 1.297) 8.572 19.271 ( -5.849 7.793 35.464) 36.778 19.391 ( -9.690 2.002 26.440) 28.231 20.178 ( -6.652 -1.062 21.677) 22.699 20.286 ( -2.660 -6.359 22.279) 23.321 20.687 ( 9.829 9.880 -36.453) 39.026 20.962 ( 2.270 -3.741 -36.403) 36.665 21.232 ( 6.970 4.662 -31.440) 32.539 21.459 ( 5.054 -6.034 -29.609) 30.637 25.413 ( 5.201 2.515 7.951) 9.828 25.534 ( 4.881 -3.422 8.158) 10.103 25.958 ( 4.046 2.218 -8.275) 9.475 26.086 ( 6.181 -3.810 -11.224) 13.368 26.112 ( -5.149 2.699 8.211) 10.061 26.236 ( -5.963 -3.652 9.982) 12.187 26.559 ( 0.046 3.387 -13.960) 14.365 26.706 ( -0.457 -4.050 -16.502) 16.997 28.594 ( 3.748 1.738 -0.332) 4.145 28.681 ( 5.017 -2.189 2.811) 6.153 28.757 ( -5.205 4.765 -2.265) 7.412 28.903 ( -1.813 -2.559 -1.954) 3.695 29.630 ( 1.966 15.273 3.120) 15.712 30.058 ( -5.726 4.500 -7.947) 10.779 30.199 ( -2.666 -8.878 8.131) 12.331 30.407 ( 10.967 -7.551 -3.942) 13.887 31.161 ( -2.638 3.617 6.882) 8.210 31.347 ( -1.336 -5.051 6.897) 8.652 31.434 ( -5.347 7.855 -6.929) 11.760 31.662 ( -6.056 -2.316 -8.235) 10.481 31.771 ( -0.667 3.197 12.017) 12.453 31.975 ( 2.314 -1.756 7.115) 7.685 32.125 ( -1.937 0.320 8.250) 8.480 32.296 ( 4.308 -3.908 2.489) 6.327 ======================= Grid point 153 (86/104) ======================= q-point: (-0.40 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.916 ( -5.312 6.801 14.041) 16.481 3.131 ( -12.572 11.408 7.196) 18.439 3.421 ( 3.456 -1.471 -8.396) 9.198 3.546 ( -4.966 2.928 7.531) 9.484 3.742 ( 2.974 1.170 6.386) 7.141 3.837 ( -1.819 11.122 10.064) 15.110 4.013 ( 0.484 8.549 10.576) 13.608 4.080 ( -7.098 -5.397 7.320) 11.537 4.430 ( 0.279 6.227 -5.834) 8.537 4.792 ( 9.098 -4.637 -5.658) 11.674 4.943 ( -1.384 -4.392 7.360) 8.682 5.007 ( 0.556 -5.022 13.216) 14.149 5.208 ( 10.186 -6.891 4.138) 12.976 5.363 ( 3.971 -0.272 -3.915) 5.583 5.529 ( -0.513 0.646 -6.525) 6.577 5.881 ( -4.712 -3.734 1.186) 6.128 5.979 ( 0.039 -0.410 -0.031) 0.413 6.048 ( -1.492 0.020 -0.081) 1.494 6.217 ( 3.389 1.244 -8.811) 9.522 6.417 ( 2.926 -9.403 -18.415) 20.883 6.729 ( -6.993 8.186 20.573) 23.220 6.935 ( -5.005 3.973 14.998) 16.302 6.987 ( -8.425 4.764 22.503) 24.496 7.209 ( -1.228 6.117 9.464) 11.335 7.242 ( 1.303 2.705 -1.103) 3.199 7.274 ( -5.099 7.041 7.540) 11.508 7.421 ( -5.211 7.509 22.233) 24.039 7.487 ( -10.659 6.269 12.874) 17.851 7.566 ( -1.913 3.068 1.134) 3.789 7.668 ( 3.010 -1.366 5.068) 6.051 7.734 ( -6.132 4.374 4.669) 8.862 7.828 ( 0.143 1.394 7.427) 7.558 7.885 ( -6.366 1.419 15.258) 16.593 8.113 ( -1.522 -6.258 -0.988) 6.516 8.182 ( -0.996 -0.520 -0.333) 1.172 8.243 ( -3.499 1.196 7.885) 8.709 8.466 ( -6.499 1.590 -0.326) 6.699 8.470 ( -4.659 -0.091 7.843) 9.123 8.585 ( 5.571 3.202 -2.633) 6.944 8.719 ( 1.331 -5.272 -2.544) 6.003 8.754 ( 2.912 1.823 -1.167) 3.628 8.811 ( 1.718 0.676 -5.759) 6.048 8.886 ( 4.529 -5.532 -9.887) 12.201 9.024 ( -2.729 -5.970 -9.494) 11.542 9.098 ( 0.565 -1.365 3.330) 3.643 9.194 ( -2.918 -4.998 -10.395) 11.898 9.297 ( -0.929 -1.624 -8.489) 8.693 9.372 ( -1.295 -4.549 -3.563) 5.922 9.522 ( 4.946 4.917 -3.288) 7.711 9.806 ( -4.733 -8.090 2.304) 9.651 10.024 ( 8.436 3.943 -3.931) 10.108 10.182 ( 14.797 -4.602 -15.829) 22.152 10.359 ( 0.286 10.290 2.951) 10.709 10.575 ( 1.110 1.573 0.495) 1.988 10.631 ( -1.575 1.980 -2.144) 3.316 10.711 ( 2.498 0.132 0.054) 2.502 10.834 ( 0.530 -1.183 -8.477) 8.576 10.952 ( -0.774 -2.306 -3.158) 3.987 10.994 ( 4.122 -7.230 2.586) 8.715 11.099 ( 4.497 -5.748 -5.914) 9.394 11.581 ( 3.986 -1.553 -1.407) 4.504 11.593 ( 2.700 -5.132 0.561) 5.826 11.802 ( 3.153 -3.369 -5.353) 7.067 11.897 ( -0.047 -7.425 -5.600) 9.301 12.334 ( -6.555 6.749 10.601) 14.174 12.457 ( -4.509 3.232 8.207) 9.906 12.653 ( -10.327 -0.198 3.415) 10.879 12.721 ( -4.981 -2.062 0.686) 5.435 13.054 ( 4.408 3.644 -2.214) 6.132 13.154 ( -1.480 -1.551 -2.822) 3.543 13.322 ( 7.752 -3.957 -4.145) 9.640 13.403 ( 13.323 -5.478 -5.364) 15.371 13.703 ( -7.813 5.830 6.254) 11.582 14.071 ( 2.860 -7.325 12.082) 14.416 14.359 ( 9.600 4.566 -16.945) 20.003 14.480 ( 0.798 2.349 -15.517) 15.714 14.825 ( -6.217 8.956 0.456) 10.912 14.978 ( 3.517 3.720 -2.346) 5.631 15.088 ( -9.117 1.030 -1.554) 9.305 15.364 ( 11.176 -8.468 -2.416) 14.229 16.072 ( -0.409 3.675 4.476) 5.806 16.108 ( -0.762 1.413 4.860) 5.118 16.174 ( 1.198 0.871 2.643) 3.030 16.274 ( 0.854 -0.959 3.589) 3.811 16.448 ( -6.582 3.804 5.283) 9.258 16.774 ( -4.276 -7.806 1.423) 9.013 16.823 ( -0.381 0.026 -0.847) 0.929 16.984 ( 3.531 -13.630 4.312) 14.726 19.263 ( -7.467 7.589 28.411) 30.340 19.459 ( 1.275 -1.862 36.375) 36.445 20.143 ( -5.753 1.958 21.516) 22.357 20.325 ( -3.270 -6.579 21.754) 22.961 20.758 ( 12.051 7.514 -35.120) 37.883 20.833 ( 2.474 3.863 -38.785) 39.055 21.269 ( 9.524 0.454 -31.068) 32.498 21.423 ( 4.407 -6.418 -29.887) 30.884 25.551 ( 2.256 1.764 9.919) 10.324 25.619 ( -1.510 -1.564 9.531) 9.776 25.809 ( -11.534 2.666 -11.654) 16.612 25.939 ( -13.026 -3.721 -11.434) 17.727 26.046 ( -3.144 1.123 8.685) 9.304 26.120 ( -5.330 -2.525 12.488) 13.810 26.683 ( 13.476 1.502 -15.629) 20.691 26.781 ( 11.305 -3.730 -14.593) 18.833 28.613 ( -4.378 5.018 -0.664) 6.693 28.716 ( 4.874 1.947 -0.965) 5.336 28.803 ( 3.732 -3.818 2.506) 5.898 28.829 ( -2.895 -3.813 -3.990) 6.232 29.626 ( -4.074 10.592 4.809) 12.325 29.978 ( 0.059 8.847 -4.499) 9.925 30.102 ( -6.008 0.159 2.756) 6.612 30.622 ( 9.320 -10.643 -5.480) 15.171 31.094 ( -6.808 4.138 9.914) 12.719 31.279 ( -7.345 -2.293 8.197) 11.242 31.332 ( -4.826 1.201 1.936) 5.337 31.478 ( -2.357 -3.104 3.390) 5.166 31.868 ( 0.698 2.873 7.045) 7.641 32.006 ( -1.361 -1.557 5.817) 6.174 32.162 ( 4.449 6.340 -0.391) 7.755 32.495 ( 11.223 -7.949 -4.913) 14.604 ======================= Grid point 154 (87/104) ======================= q-point: (-0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.890 ( -2.323 6.332 18.490) 19.681 2.950 ( -7.235 6.487 8.550) 12.944 3.410 ( -0.490 -4.836 -6.899) 8.440 3.483 ( -4.992 2.772 15.417) 16.441 3.731 ( -8.190 -10.818 16.050) 21.016 3.873 ( 1.960 -2.790 6.083) 6.974 4.050 ( 5.087 16.652 -6.914) 18.734 4.160 ( 2.827 10.956 14.267) 18.209 4.441 ( 3.727 3.724 -6.717) 8.536 4.831 ( -9.161 -15.199 -5.170) 18.484 4.926 ( 2.563 -0.658 -2.581) 3.696 5.129 ( 2.141 -5.360 8.178) 10.009 5.224 ( 3.195 -4.060 0.200) 5.170 5.504 ( 4.633 -4.867 -0.005) 6.720 5.658 ( 10.333 19.186 2.608) 21.947 5.820 ( -4.886 -0.170 10.680) 11.745 5.974 ( -3.226 -2.036 0.037) 3.815 6.041 ( 5.983 -3.083 -1.630) 6.926 6.191 ( -1.782 0.998 -10.808) 11.000 6.353 ( -2.981 -8.043 -16.311) 18.429 6.634 ( -8.085 4.248 15.841) 18.286 6.758 ( -12.801 -2.322 16.359) 20.902 6.960 ( -3.421 7.910 6.689) 10.909 7.015 ( -9.361 5.034 -3.171) 11.092 7.180 ( -7.572 1.066 15.202) 17.017 7.283 ( -6.654 1.990 12.955) 14.699 7.402 ( 2.162 12.194 17.070) 21.089 7.470 ( -3.524 5.032 24.617) 25.372 7.519 ( -1.597 3.438 -4.859) 6.163 7.658 ( -2.123 9.729 2.397) 10.242 7.738 ( -4.626 3.889 17.844) 18.840 7.768 ( -1.353 3.546 1.054) 3.939 7.946 ( 2.819 -0.106 6.495) 7.081 8.017 ( -5.012 -3.050 0.189) 5.870 8.156 ( -4.920 -0.733 2.884) 5.750 8.202 ( -1.921 0.791 6.206) 6.545 8.362 ( -4.618 2.840 2.096) 5.813 8.438 ( -0.159 0.957 8.209) 8.266 8.612 ( -0.425 2.543 -7.617) 8.042 8.747 ( 3.515 0.881 -3.194) 4.831 8.788 ( 0.755 -4.690 -2.059) 5.177 8.846 ( 2.614 -0.290 -0.098) 2.631 8.912 ( 2.536 -4.048 -12.409) 13.296 8.992 ( 4.324 -4.469 -10.534) 12.232 9.050 ( -1.507 -4.686 -6.988) 8.548 9.135 ( 0.570 -5.871 -3.655) 6.939 9.312 ( 2.710 -3.741 -4.753) 6.628 9.347 ( 1.955 -8.357 -3.402) 9.232 9.712 ( 9.114 0.448 0.258) 9.129 9.807 ( 1.849 -5.180 2.839) 6.190 10.180 ( 6.443 6.831 -0.829) 9.427 10.316 ( 3.572 1.467 -6.344) 7.427 10.476 ( 9.249 2.408 -2.905) 9.989 10.524 ( -4.200 -0.633 1.504) 4.506 10.621 ( 1.085 4.008 -4.583) 6.184 10.734 ( 0.632 -6.048 -1.453) 6.252 10.838 ( -2.338 0.980 -6.342) 6.830 10.954 ( 6.399 0.101 -3.744) 7.414 11.027 ( -1.891 -3.684 0.554) 4.178 11.148 ( 0.845 -3.046 -5.582) 6.415 11.636 ( 3.892 -2.284 -3.248) 5.560 11.720 ( -1.107 -6.205 -0.393) 6.315 11.836 ( 6.601 0.450 2.301) 7.005 11.921 ( 5.064 -6.852 0.265) 8.524 12.241 ( -6.270 5.789 6.372) 10.651 12.377 ( -3.275 0.734 0.245) 3.365 12.439 ( -5.538 -1.922 -3.267) 6.711 12.582 ( -10.151 -5.915 0.889) 11.782 13.084 ( 1.952 6.075 -2.879) 7.000 13.181 ( 1.651 0.497 -4.888) 5.183 13.482 ( 5.719 5.313 4.524) 9.022 13.612 ( -1.195 0.981 3.252) 3.601 13.648 ( 10.331 -4.205 -2.626) 11.459 14.129 ( -1.571 -11.580 8.082) 14.209 14.318 ( -10.754 11.919 -9.475) 18.641 14.491 ( -5.046 6.507 -11.601) 14.226 14.568 ( 0.505 -2.824 -4.773) 5.568 14.826 ( -3.553 -9.440 -6.386) 11.938 15.341 ( 18.098 7.118 1.352) 19.495 15.588 ( 8.043 -4.929 -1.920) 9.627 16.068 ( -0.043 6.008 2.804) 6.630 16.081 ( -4.483 3.988 5.501) 8.140 16.186 ( -3.749 -0.683 0.135) 3.813 16.224 ( -5.273 4.978 3.693) 8.138 16.386 ( 1.091 -2.049 1.292) 2.657 16.620 ( -6.695 -5.415 -0.136) 8.612 16.921 ( 5.028 -4.484 2.585) 7.216 17.066 ( 1.976 -13.046 4.370) 13.899 19.251 ( -5.563 10.862 26.716) 29.371 19.659 ( -0.079 -9.791 33.211) 34.625 20.139 ( -3.856 3.313 23.615) 24.156 20.336 ( -5.394 -6.238 23.030) 24.462 20.734 ( 5.148 9.261 -39.727) 41.115 20.872 ( 13.063 4.281 -34.377) 37.024 21.341 ( 9.501 -2.365 -30.176) 31.725 21.384 ( 5.371 -5.283 -30.325) 31.247 25.520 ( -10.142 0.575 -4.228) 11.003 25.553 ( -5.699 0.622 2.570) 6.283 25.580 ( -10.109 -1.406 -3.381) 10.752 25.587 ( -3.882 -0.562 2.908) 4.882 26.095 ( 2.314 1.294 13.474) 13.733 26.133 ( -0.864 -0.463 14.127) 14.161 26.865 ( 10.105 1.056 -19.297) 21.808 26.932 ( 7.340 -2.782 -14.146) 16.178 28.533 ( -1.972 5.362 -0.952) 5.792 28.709 ( -4.563 -2.640 -5.820) 7.852 28.825 ( 4.624 0.975 0.354) 4.739 28.890 ( 2.055 -2.159 1.761) 3.462 29.596 ( 1.364 6.931 3.416) 7.846 29.836 ( -11.411 -5.566 6.020) 14.051 30.122 ( 5.712 15.937 -5.575) 17.824 30.674 ( -2.424 -10.558 -9.434) 14.365 31.035 ( -2.608 4.238 12.812) 13.744 31.210 ( 0.371 -3.918 14.655) 15.175 31.303 ( -1.211 3.704 3.660) 5.346 31.483 ( -1.766 -4.637 7.507) 8.999 31.881 ( -1.570 2.409 5.747) 6.426 32.010 ( 0.540 -2.895 5.430) 6.177 32.252 ( 3.399 9.277 -5.892) 11.504 32.634 ( 3.808 -9.072 -9.409) 13.614 ======================= Grid point 155 (88/104) ======================= q-point: ( 0.00 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.005 ( 1.261 -6.580 4.639) 8.149 3.005 ( 1.261 6.580 4.639) 8.149 3.261 ( -3.251 -7.816 7.159) 11.087 3.261 ( -3.251 7.816 7.159) 11.087 3.790 ( -0.699 -7.670 14.572) 16.482 3.790 ( -0.699 7.670 14.572) 16.482 4.255 ( -4.407 -7.668 -1.640) 8.995 4.255 ( -4.407 7.668 -1.640) 8.995 4.526 ( -0.965 -5.041 1.239) 5.280 4.526 ( -0.965 5.041 1.239) 5.280 4.988 ( -0.573 -2.615 -2.556) 3.702 4.988 ( -0.573 2.615 -2.556) 3.702 5.564 ( 8.764 -5.494 7.747) 12.923 5.564 ( 8.764 5.494 7.747) 12.923 5.715 ( -8.719 -6.855 1.184) 11.155 5.715 ( -8.719 6.855 1.184) 11.155 5.981 ( -5.736 -1.898 -7.212) 9.408 5.981 ( -5.736 1.898 -7.212) 9.408 6.275 ( 8.990 -3.843 2.086) 9.997 6.275 ( 8.990 3.843 2.086) 9.997 6.641 ( 0.062 -0.800 12.837) 12.862 6.641 ( 0.062 0.800 12.837) 12.862 6.900 ( -7.045 -6.190 -3.752) 10.101 6.900 ( -7.045 6.190 -3.752) 10.101 7.233 ( -2.681 -5.616 18.613) 19.626 7.233 ( -2.681 5.616 18.613) 19.626 7.530 ( -0.317 -2.436 10.389) 10.676 7.530 ( -0.317 2.436 10.389) 10.676 7.721 ( -2.651 -6.298 4.691) 8.288 7.721 ( -2.651 6.298 4.691) 8.288 7.778 ( -0.950 -4.455 10.540) 11.482 7.778 ( -0.950 4.455 10.540) 11.482 7.957 ( 0.804 -4.440 9.602) 10.609 7.957 ( 0.804 4.440 9.602) 10.609 8.141 ( -0.233 -4.535 -1.773) 4.875 8.141 ( -0.233 4.535 -1.773) 4.875 8.408 ( -3.059 -7.714 3.200) 8.894 8.408 ( -3.059 7.714 3.200) 8.894 8.647 ( 2.933 -5.413 -4.970) 7.913 8.647 ( 2.933 5.413 -4.970) 7.913 8.842 ( -3.409 -2.442 1.212) 4.365 8.842 ( -3.409 2.442 1.212) 4.365 8.951 ( 8.348 -3.164 -8.177) 12.107 8.951 ( 8.348 3.164 -8.177) 12.107 9.031 ( 2.933 -6.376 -9.700) 11.973 9.031 ( 2.933 6.376 -9.700) 11.973 9.314 ( 3.601 -3.855 -7.797) 9.414 9.314 ( 3.601 3.855 -7.797) 9.414 9.794 ( -1.834 -0.258 3.625) 4.071 9.794 ( -1.834 0.258 3.625) 4.071 10.342 ( 0.843 -3.331 -3.446) 4.866 10.342 ( 0.843 3.331 -3.446) 4.866 10.551 ( -0.242 -5.120 -1.098) 5.242 10.551 ( -0.242 5.120 -1.098) 5.242 10.653 ( 0.589 -5.276 -2.056) 5.693 10.653 ( 0.589 5.276 -2.056) 5.693 10.838 ( -2.695 -5.201 -2.377) 6.322 10.838 ( -2.695 5.201 -2.377) 6.322 11.076 ( -0.946 -1.905 -1.589) 2.655 11.076 ( -0.946 1.905 -1.589) 2.655 11.608 ( -0.998 -3.519 -2.816) 4.616 11.608 ( -0.998 3.519 -2.816) 4.616 12.034 ( 4.254 -2.156 7.844) 9.180 12.034 ( 4.254 2.156 7.844) 9.180 12.184 ( -6.909 -3.885 -2.290) 8.250 12.184 ( -6.909 3.885 -2.290) 8.250 12.454 ( 9.651 -0.989 -10.175) 14.058 12.454 ( 9.651 0.989 -10.175) 14.058 13.155 ( -1.882 -1.824 -2.040) 3.321 13.155 ( -1.882 1.824 -2.040) 3.321 13.610 ( -5.700 -1.384 6.861) 9.026 13.610 ( -5.700 1.384 6.861) 9.026 13.888 ( 2.572 -11.790 6.297) 13.611 13.888 ( 2.572 11.790 6.297) 13.611 14.225 ( -5.695 -6.910 -3.800) 9.727 14.225 ( -5.695 6.910 -3.800) 9.727 14.664 ( 1.881 -8.527 -7.728) 11.661 14.664 ( 1.881 8.527 -7.728) 11.661 15.659 ( 4.318 -0.550 -4.769) 6.457 15.659 ( 4.318 0.550 -4.769) 6.457 16.018 ( -6.669 -1.642 1.401) 7.010 16.018 ( -6.669 1.642 1.401) 7.010 16.190 ( -0.181 -4.275 6.325) 7.636 16.190 ( -0.181 4.275 6.325) 7.636 16.472 ( 2.921 -4.609 -3.020) 6.236 16.472 ( 2.921 4.609 -3.020) 6.236 16.979 ( 0.864 -3.740 4.300) 5.764 16.979 ( 0.864 3.740 4.300) 5.764 19.497 ( -6.568 -12.523 29.320) 32.552 19.497 ( -6.568 12.523 29.320) 32.552 20.211 ( -6.475 -3.791 24.476) 25.601 20.211 ( -6.475 3.791 24.476) 25.601 20.885 ( 7.729 -9.160 -36.632) 38.543 20.885 ( 7.729 9.160 -36.632) 38.543 21.352 ( 7.961 -3.687 -30.651) 31.882 21.352 ( 7.961 3.687 -30.651) 31.882 25.351 ( -4.094 -1.039 -0.579) 4.264 25.351 ( -4.094 1.039 -0.579) 4.264 25.608 ( 5.944 -0.697 -1.456) 6.160 25.608 ( 5.944 0.697 -1.456) 6.160 26.190 ( -0.802 -1.471 14.813) 14.907 26.190 ( -0.802 1.471 14.813) 14.907 26.929 ( 1.568 -0.575 -17.029) 17.111 26.929 ( 1.568 0.575 -17.029) 17.111 28.589 ( -0.908 -2.047 -2.218) 3.151 28.589 ( -0.908 2.047 -2.218) 3.151 28.901 ( 1.136 -0.629 0.564) 1.416 28.901 ( 1.136 0.629 0.564) 1.416 29.700 ( 1.539 -2.879 4.080) 5.225 29.700 ( 1.539 2.879 4.080) 5.225 30.358 ( -2.948 -8.290 -6.712) 11.066 30.358 ( -2.948 8.290 -6.712) 11.066 31.231 ( 2.842 -7.557 12.066) 14.518 31.231 ( 2.842 7.557 12.066) 14.518 31.382 ( 1.132 -5.277 4.459) 7.001 31.382 ( 1.132 5.277 4.459) 7.001 31.967 ( -1.072 -5.004 6.357) 8.161 31.967 ( -1.072 5.004 6.357) 8.161 32.397 ( -4.517 -9.166 -6.768) 12.257 32.397 ( -4.517 9.166 -6.768) 12.257 ======================= Grid point 157 (89/104) ======================= q-point: ( 0.20 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.054 ( 1.722 -11.363 1.721) 11.621 3.054 ( 1.722 11.363 1.721) 11.621 3.359 ( 7.661 -1.894 11.288) 13.773 3.359 ( 7.661 1.894 11.288) 13.773 3.826 ( -3.180 -4.654 7.333) 9.249 3.826 ( -3.180 4.654 7.333) 9.249 4.233 ( 4.633 -3.647 5.528) 8.082 4.233 ( 4.633 3.647 5.528) 8.082 4.445 ( -7.659 -7.178 3.502) 11.065 4.445 ( -7.659 7.178 3.502) 11.065 4.857 ( -9.633 -7.182 -1.141) 12.070 4.857 ( -9.633 7.182 -1.141) 12.070 5.560 ( -4.894 -9.951 4.779) 12.075 5.560 ( -4.894 9.951 4.779) 12.075 5.708 ( -0.637 -6.020 -3.612) 7.049 5.708 ( -0.637 6.020 -3.612) 7.049 5.951 ( 6.044 -3.709 -0.207) 7.095 5.951 ( 6.044 3.709 -0.207) 7.095 6.353 ( -1.994 -9.708 -6.376) 11.784 6.353 ( -1.994 9.708 -6.376) 11.784 6.745 ( 2.629 -3.501 13.347) 14.046 6.745 ( 2.629 3.501 13.347) 14.046 6.869 ( 5.548 -6.099 4.211) 9.258 6.869 ( 5.548 6.099 4.211) 9.258 7.286 ( 0.380 -6.591 16.804) 18.055 7.286 ( 0.380 6.591 16.804) 18.055 7.521 ( -4.374 -0.853 8.178) 9.314 7.521 ( -4.374 0.853 8.178) 9.314 7.682 ( 0.630 -11.636 0.116) 11.653 7.682 ( 0.630 11.636 0.116) 11.653 7.829 ( -4.148 -4.533 19.699) 20.635 7.829 ( -4.148 4.533 19.699) 20.635 8.006 ( 0.413 -6.792 6.307) 9.278 8.006 ( 0.413 6.792 6.307) 9.278 8.255 ( 10.306 -3.043 -3.525) 11.309 8.255 ( 10.306 3.043 -3.525) 11.309 8.354 ( -1.610 -7.858 -0.013) 8.022 8.354 ( -1.610 7.858 -0.013) 8.022 8.671 ( -3.801 -7.943 3.511) 9.480 8.671 ( -3.801 7.943 3.511) 9.480 8.781 ( 1.742 -1.620 -4.045) 4.692 8.781 ( 1.742 1.620 -4.045) 4.692 8.992 ( -1.608 -7.268 -5.099) 9.023 8.992 ( -1.608 7.268 -5.099) 9.023 9.121 ( 7.004 -2.493 -15.082) 16.814 9.121 ( 7.004 2.493 -15.082) 16.814 9.352 ( 5.906 -2.497 -8.601) 10.728 9.352 ( 5.906 2.497 -8.601) 10.728 9.724 ( -4.661 -2.607 1.463) 5.538 9.724 ( -4.661 2.607 1.463) 5.538 10.230 ( -11.153 -6.915 -2.413) 13.343 10.230 ( -11.153 6.915 -2.413) 13.343 10.545 ( -0.731 -5.646 -1.325) 5.845 10.545 ( -0.731 5.646 -1.325) 5.845 10.591 ( -0.798 -4.086 1.466) 4.414 10.591 ( -0.798 4.086 1.466) 4.414 10.838 ( 0.093 -5.618 0.833) 5.680 10.838 ( 0.093 5.618 0.833) 5.680 11.032 ( -0.252 -1.481 -6.484) 6.656 11.032 ( -0.252 1.481 -6.484) 6.656 11.583 ( -1.076 -5.248 -0.630) 5.394 11.583 ( -1.076 5.248 -0.630) 5.394 11.906 ( -8.393 -2.132 -1.868) 8.859 11.906 ( -8.393 2.132 -1.868) 8.859 12.271 ( 7.594 -1.576 2.031) 8.017 12.271 ( 7.594 1.576 2.031) 8.017 12.690 ( 13.855 -4.288 -7.306) 16.240 12.690 ( 13.855 4.288 -7.306) 16.240 13.075 ( -4.458 -5.339 -1.266) 7.069 13.075 ( -4.458 5.339 -1.266) 7.069 13.416 ( -12.902 -3.368 8.107) 15.606 13.416 ( -12.902 3.368 8.107) 15.606 13.911 ( -0.808 -5.689 3.663) 6.814 13.911 ( -0.808 5.689 3.663) 6.814 14.332 ( 10.913 -0.674 2.778) 11.281 14.332 ( 10.913 0.674 2.778) 11.281 14.610 ( -2.253 -10.002 -6.415) 12.094 14.610 ( -2.253 10.002 -6.415) 12.094 15.600 ( -5.959 -4.698 -7.588) 10.731 15.600 ( -5.959 4.698 -7.588) 10.731 15.979 ( 1.608 -1.736 2.773) 3.645 15.979 ( 1.608 1.736 2.773) 3.645 16.215 ( -0.820 -0.979 7.866) 7.969 16.215 ( -0.820 0.979 7.866) 7.969 16.532 ( 3.792 -1.749 -3.844) 5.675 16.532 ( 3.792 1.749 -3.844) 5.675 16.974 ( -2.831 -3.539 3.057) 5.467 16.974 ( -2.831 3.539 3.057) 5.467 19.450 ( -9.995 -8.577 30.257) 33.000 19.450 ( -9.995 8.577 30.257) 33.000 20.188 ( -5.618 -0.954 23.729) 24.403 20.188 ( -5.618 0.954 23.729) 24.403 20.873 ( 6.922 -10.163 -36.715) 38.719 20.873 ( 6.922 10.163 -36.715) 38.719 21.364 ( 6.118 -5.843 -30.721) 31.865 21.364 ( 6.118 5.843 -30.721) 31.865 25.346 ( 2.685 -2.544 3.452) 5.059 25.346 ( 2.685 2.544 3.452) 5.059 25.816 ( 13.849 -2.501 -7.167) 15.793 25.816 ( 13.849 2.501 -7.167) 15.793 26.207 ( -3.666 -3.306 13.742) 14.602 26.207 ( -3.666 3.306 13.742) 14.602 26.808 ( -5.132 -2.913 -16.767) 17.775 26.808 ( -5.132 2.913 -16.767) 17.775 28.580 ( 0.974 -1.304 -0.466) 1.693 28.580 ( 0.974 1.304 -0.466) 1.693 28.903 ( -1.087 -1.595 -0.839) 2.104 28.903 ( -1.087 1.595 -0.839) 2.104 29.808 ( 6.021 -11.970 3.430) 13.831 29.808 ( 6.021 11.970 3.430) 13.831 30.270 ( -2.575 -0.535 -3.988) 4.777 30.270 ( -2.575 0.535 -3.988) 4.777 31.259 ( -2.276 -5.355 7.060) 9.149 31.259 ( -2.276 5.355 7.060) 9.149 31.546 ( 10.087 -8.421 0.729) 13.160 31.546 ( 10.087 8.421 0.729) 13.160 31.906 ( -7.572 -4.351 5.069) 10.098 31.906 ( -7.572 4.351 5.069) 10.098 32.253 ( -5.916 -3.930 1.600) 7.280 32.253 ( -5.916 3.930 1.600) 7.280 ======================= Grid point 159 (90/104) ======================= q-point: (-0.60 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.105 ( 1.201 -12.976 3.684) 13.543 3.105 ( 1.201 12.976 3.684) 13.543 3.551 ( 3.771 -5.058 -2.490) 6.783 3.551 ( 3.771 5.059 -2.490) 6.783 3.765 ( -2.664 -15.060 13.820) 20.613 3.765 ( -2.664 15.060 13.820) 20.613 4.276 ( -8.501 -17.319 8.191) 20.960 4.276 ( -8.501 17.319 8.191) 20.960 4.427 ( 2.732 -9.134 11.574) 14.995 4.427 ( 2.732 9.134 11.574) 14.995 4.746 ( 6.106 -3.637 -0.393) 7.118 4.746 ( 6.106 3.637 -0.393) 7.118 5.399 ( -11.002 -7.634 -1.653) 13.493 5.399 ( -11.002 7.634 -1.653) 13.493 5.689 ( 1.718 -13.627 -9.063) 16.456 5.689 ( 1.718 13.627 -9.063) 16.456 6.064 ( 1.551 -2.176 4.165) 4.949 6.064 ( 1.551 2.176 4.165) 4.949 6.254 ( 0.454 -12.820 -14.228) 19.157 6.254 ( 0.454 12.820 -14.228) 19.157 6.889 ( 0.110 -6.303 19.239) 20.245 6.889 ( 0.110 6.303 19.239) 20.245 7.017 ( 4.433 -6.427 18.330) 19.924 7.017 ( 4.433 6.427 18.330) 19.924 7.370 ( -0.483 -7.379 4.551) 8.683 7.370 ( -0.483 7.379 4.551) 8.683 7.509 ( 1.307 -4.067 9.166) 10.113 7.509 ( 1.308 4.067 9.166) 10.113 7.714 ( -0.526 -8.209 2.980) 8.748 7.714 ( -0.526 8.209 2.980) 8.748 7.779 ( -6.663 -6.606 18.453) 20.701 7.779 ( -6.663 6.606 18.453) 20.701 8.030 ( -0.950 -7.584 3.408) 8.369 8.030 ( -0.950 7.584 3.408) 8.369 8.243 ( -4.953 -6.488 0.704) 8.193 8.243 ( -4.953 6.488 0.704) 8.193 8.475 ( 5.035 -2.077 0.319) 5.456 8.475 ( 5.035 2.077 0.319) 5.456 8.602 ( -0.978 -3.956 -0.383) 4.093 8.602 ( -0.978 3.956 -0.383) 4.093 8.810 ( 0.280 -4.291 -6.965) 8.185 8.810 ( 0.280 4.291 -6.965) 8.185 8.944 ( -0.337 -8.460 -0.313) 8.472 8.944 ( -0.337 8.460 -0.313) 8.472 9.100 ( 1.736 -1.800 -12.794) 13.036 9.100 ( 1.736 1.800 -12.794) 13.036 9.436 ( -3.635 -3.490 -3.531) 6.153 9.436 ( -3.635 3.490 -3.531) 6.153 9.673 ( 3.408 -10.331 -5.931) 12.391 9.673 ( 3.408 10.331 -5.931) 12.391 9.984 ( -4.907 -4.534 -4.929) 8.302 9.984 ( -4.907 4.534 -4.929) 8.302 10.532 ( -0.629 -5.199 1.505) 5.449 10.532 ( -0.629 5.199 1.505) 5.449 10.655 ( 5.551 -6.028 2.253) 8.499 10.655 ( 5.551 6.028 2.253) 8.499 10.806 ( -2.263 -7.250 -1.819) 7.809 10.806 ( -2.263 7.250 -1.819) 7.809 11.007 ( 0.375 -1.513 -7.917) 8.069 11.007 ( 0.375 1.513 -7.917) 8.069 11.546 ( -1.510 -3.090 -0.300) 3.453 11.546 ( -1.510 3.090 -0.300) 3.453 11.795 ( -0.090 -3.634 -7.335) 8.186 11.795 ( -0.090 3.634 -7.335) 8.186 12.428 ( 3.510 -1.669 9.167) 9.957 12.428 ( 3.510 1.669 9.167) 9.957 12.824 ( -3.139 -5.267 -2.043) 6.463 12.824 ( -3.139 5.267 -2.043) 6.463 13.054 ( 6.016 -4.621 -0.430) 7.598 13.054 ( 6.016 4.621 -0.430) 7.598 13.223 ( -5.247 -2.867 0.152) 5.982 13.223 ( -5.247 2.867 0.152) 5.982 13.906 ( -2.602 -5.318 7.405) 9.481 13.906 ( -2.602 5.318 7.405) 9.481 14.435 ( 1.265 -10.502 -12.214) 16.158 14.435 ( 1.265 10.502 -12.214) 16.158 14.739 ( 14.283 -6.706 5.997) 16.880 14.739 ( 14.283 6.706 5.997) 16.880 15.386 ( -10.573 -4.004 -8.028) 13.867 15.386 ( -10.573 4.004 -8.028) 13.867 16.056 ( 3.856 -0.258 2.150) 4.423 16.056 ( 3.856 0.258 2.150) 4.423 16.223 ( -1.334 -2.296 5.898) 6.469 16.223 ( -1.334 2.296 5.898) 6.469 16.585 ( 0.965 -6.541 2.971) 7.249 16.585 ( 0.965 6.541 2.971) 7.249 16.897 ( -4.311 -2.628 -0.301) 5.058 16.897 ( -4.311 2.628 -0.301) 5.058 19.384 ( -8.740 -3.460 32.511) 33.842 19.384 ( -8.740 3.460 32.511) 33.842 20.191 ( -4.110 -3.053 22.621) 23.193 20.191 ( -4.110 3.053 22.621) 23.193 20.855 ( 7.342 -7.697 -37.031) 38.529 20.855 ( 7.342 7.697 -37.031) 38.529 21.340 ( 5.085 -6.494 -31.178) 32.251 21.340 ( 5.085 6.494 -31.178) 32.251 25.469 ( 5.335 -3.408 7.947) 10.160 25.469 ( 5.335 3.408 7.947) 10.160 26.013 ( 4.398 -3.652 -8.450) 10.202 26.013 ( 4.398 3.652 -8.450) 10.202 26.170 ( -4.907 -3.355 7.692) 9.721 26.170 ( -4.907 3.355 7.692) 9.721 26.630 ( -0.904 -4.090 -14.949) 15.524 26.630 ( -0.904 4.090 -14.949) 15.524 28.635 ( 3.876 -2.505 1.219) 4.774 28.635 ( 3.876 2.505 1.219) 4.774 28.842 ( -3.725 -4.079 -2.681) 6.140 28.842 ( -3.725 4.079 -2.681) 6.140 29.912 ( -0.573 -14.424 6.447) 15.810 29.912 ( -0.573 14.424 6.447) 15.810 30.251 ( 4.353 -8.617 -6.392) 11.579 30.251 ( 4.353 8.617 -6.392) 11.579 31.247 ( -2.133 -5.310 7.738) 9.624 31.247 ( -2.133 5.310 7.738) 9.624 31.571 ( -8.401 -6.527 -7.813) 13.200 31.571 ( -8.401 6.527 -7.813) 13.200 31.874 ( 3.274 -6.702 12.399) 14.469 31.874 ( 3.274 6.702 12.399) 14.469 32.203 ( 1.090 -5.659 2.134) 6.145 32.203 ( 1.090 5.659 2.134) 6.145 ======================= Grid point 161 (91/104) ======================= q-point: (-0.40 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.093 ( -4.395 -10.762 5.090) 12.690 3.093 ( -4.395 10.762 5.090) 12.690 3.499 ( -3.869 -7.767 -5.432) 10.237 3.499 ( -3.869 7.767 -5.432) 10.237 3.794 ( -4.206 -6.796 16.694) 18.508 3.794 ( -4.206 6.796 16.694) 18.508 4.243 ( 1.555 -3.806 8.575) 9.509 4.243 ( 1.555 3.806 8.575) 9.509 4.462 ( 0.239 -15.041 9.473) 17.777 4.462 ( 0.239 15.041 9.473) 17.777 5.016 ( 8.165 -8.350 1.226) 11.742 5.016 ( 8.165 8.350 1.226) 11.742 5.173 ( -3.099 -8.388 -6.050) 10.797 5.173 ( -3.099 8.388 -6.050) 10.797 5.701 ( 5.944 -11.696 -8.509) 15.637 5.701 ( 5.944 11.696 -8.509) 15.637 6.043 ( -4.685 -2.864 3.533) 6.529 6.043 ( -4.685 2.864 3.533) 6.530 6.261 ( 3.981 -5.368 -12.698) 14.349 6.261 ( 3.981 5.368 -12.698) 14.349 6.865 ( -9.966 -6.076 22.142) 25.030 6.865 ( -9.966 6.076 22.142) 25.030 7.209 ( 1.211 -7.964 19.448) 21.050 7.209 ( 1.211 7.964 19.448) 21.050 7.286 ( -6.738 -3.655 1.079) 7.741 7.286 ( -6.738 3.655 1.079) 7.741 7.530 ( -9.595 -3.743 17.155) 20.009 7.530 ( -9.595 3.743 17.155) 20.009 7.626 ( -0.034 -4.419 5.755) 7.256 7.626 ( -0.034 4.419 5.755) 7.256 7.840 ( 2.340 -5.539 5.357) 8.053 7.840 ( 2.340 5.539 5.357) 8.053 7.971 ( -5.544 -6.601 4.407) 9.682 7.971 ( -5.544 6.601 4.407) 9.682 8.184 ( -1.779 -3.896 6.943) 8.158 8.184 ( -1.779 3.896 6.943) 8.158 8.490 ( -3.247 -0.666 -1.630) 3.693 8.490 ( -3.247 0.666 -1.630) 3.693 8.631 ( 4.845 -3.259 -0.199) 5.842 8.631 ( 4.845 3.259 -0.199) 5.842 8.797 ( 1.856 -3.373 -7.731) 8.637 8.797 ( 1.856 3.373 -7.731) 8.637 8.899 ( -0.507 -6.918 -9.484) 11.750 8.899 ( -0.507 6.918 -9.484) 11.750 9.106 ( -2.734 -2.898 0.263) 3.993 9.106 ( -2.734 2.898 0.263) 3.993 9.305 ( -2.145 -2.552 -5.445) 6.385 9.305 ( -2.145 2.552 -5.445) 6.385 9.648 ( -0.432 -8.154 -0.949) 8.220 9.648 ( -0.432 8.154 -0.949) 8.220 10.096 ( 13.048 -4.199 -9.731) 16.810 10.096 ( 13.048 4.199 -9.731) 16.810 10.514 ( -1.396 -5.724 2.964) 6.596 10.514 ( -1.396 5.724 2.964) 6.596 10.722 ( -2.957 -2.679 -4.380) 5.925 10.722 ( -2.957 2.679 -4.380) 5.925 10.845 ( 8.424 -6.007 0.114) 10.347 10.845 ( 8.424 6.007 0.114) 10.347 10.986 ( 1.457 -5.406 -6.650) 8.693 10.986 ( 1.457 5.406 -6.650) 8.693 11.558 ( 3.369 -0.656 -1.431) 3.719 11.558 ( 3.369 0.656 -1.431) 3.719 11.794 ( 2.368 -2.825 -7.726) 8.561 11.794 ( 2.368 2.825 -7.726) 8.561 12.440 ( -6.084 -4.420 9.680) 12.257 12.440 ( -6.084 4.420 9.680) 12.257 12.678 ( -9.496 -2.855 4.085) 10.725 12.678 ( -9.496 2.855 4.085) 10.725 13.122 ( 2.775 -2.498 -4.523) 5.865 13.122 ( 2.775 2.498 -4.523) 5.865 13.313 ( 11.110 -3.109 -3.175) 11.966 13.313 ( 11.110 3.109 -3.175) 11.966 13.866 ( -4.396 -11.392 10.311) 15.982 13.866 ( -4.396 11.392 10.311) 15.982 14.455 ( 6.940 -4.314 -15.692) 17.692 14.455 ( 6.940 4.314 -15.692) 17.692 14.966 ( -8.267 -5.085 -2.822) 10.108 14.966 ( -8.267 5.085 -2.822) 10.108 15.196 ( 7.953 -9.163 -0.530) 12.145 15.196 ( 7.953 9.163 -0.530) 12.145 16.138 ( 2.426 -1.373 0.606) 2.852 16.138 ( 2.426 1.373 0.606) 2.852 16.216 ( -0.950 -5.025 3.218) 6.042 16.216 ( -0.950 5.025 3.218) 6.042 16.565 ( -6.238 -10.665 9.276) 15.450 16.565 ( -6.238 10.665 9.276) 15.450 16.845 ( 1.162 -3.264 -1.815) 3.911 16.845 ( 1.162 3.264 -1.815) 3.911 19.392 ( -4.661 -5.570 33.272) 34.056 19.392 ( -4.661 5.570 33.272) 34.056 20.210 ( -3.902 -5.227 22.473) 23.400 20.210 ( -3.902 5.227 22.473) 23.400 20.855 ( 8.505 -2.183 -36.945) 37.974 20.855 ( 8.505 2.183 -36.945) 37.974 21.313 ( 6.072 -4.570 -31.375) 32.283 21.313 ( 6.072 4.570 -31.375) 32.283 25.586 ( 0.558 -1.917 9.623) 9.828 25.586 ( 0.558 1.917 9.623) 9.828 25.868 ( -12.646 -3.631 -11.913) 17.749 25.868 ( -12.646 3.631 -11.913) 17.749 26.076 ( -3.616 -2.093 11.067) 11.830 26.076 ( -3.616 2.093 11.067) 11.830 26.721 ( 12.266 -2.637 -14.988) 19.546 26.721 ( 12.266 2.637 -14.988) 19.546 28.709 ( -1.513 -4.910 -0.488) 5.161 28.709 ( -1.513 4.910 -0.488) 5.161 28.769 ( 2.169 -2.528 -1.321) 3.583 28.769 ( 2.169 2.528 -1.321) 3.583 29.839 ( -7.461 -11.732 7.075) 15.600 29.839 ( -7.461 11.732 7.075) 15.600 30.369 ( 7.799 -16.215 -9.356) 20.280 30.369 ( 7.799 16.215 -9.356) 20.280 31.186 ( -8.012 -5.513 10.773) 14.514 31.186 ( -8.012 5.513 10.773) 14.514 31.406 ( -3.064 -4.495 2.187) 5.863 31.406 ( -3.064 4.495 2.187) 5.863 31.937 ( -1.672 -4.319 8.667) 9.827 31.937 ( -1.672 4.319 8.667) 9.827 32.327 ( 8.994 -9.720 -4.970) 14.144 32.327 ( 8.994 9.720 -4.970) 14.144 ======================= Grid point 163 (92/104) ======================= q-point: (-0.20 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.010 ( -4.008 -2.973 4.878) 6.979 3.010 ( -4.008 2.973 4.878) 6.979 3.368 ( -7.081 -6.946 2.016) 10.121 3.368 ( -7.081 6.946 2.016) 10.121 3.774 ( -4.103 -7.436 16.633) 18.676 3.774 ( -4.103 7.436 16.633) 18.676 4.312 ( 0.263 -7.892 3.151) 8.501 4.312 ( 0.263 7.892 3.151) 8.501 4.514 ( 1.163 -14.405 1.015) 14.488 4.514 ( 1.163 14.405 1.015) 14.488 4.979 ( -0.567 -6.342 -2.518) 6.847 4.979 ( -0.567 6.342 -2.518) 6.847 5.324 ( 10.468 -10.557 -0.141) 14.868 5.324 ( 10.468 10.557 -0.141) 14.868 5.889 ( -1.288 -5.141 3.607) 6.411 5.889 ( -1.288 5.141 3.607) 6.411 5.948 ( 5.635 -9.040 3.630) 11.254 5.948 ( 5.635 9.040 3.630) 11.254 6.224 ( -2.058 -4.082 -15.607) 16.263 6.224 ( -2.058 4.082 -15.607) 16.263 6.704 ( -11.348 -3.312 16.657) 20.425 6.704 ( -11.348 3.312 16.657) 20.425 7.076 ( -9.146 -1.974 2.691) 9.736 7.076 ( -9.146 1.974 2.691) 9.736 7.245 ( -5.470 -5.989 15.192) 17.222 7.245 ( -5.470 5.989 15.192) 17.222 7.492 ( -2.827 -0.995 19.669) 19.896 7.492 ( -2.827 0.995 19.669) 19.896 7.675 ( 1.728 -6.220 3.603) 7.393 7.675 ( 1.728 6.220 3.603) 7.393 7.850 ( -4.379 -6.258 3.986) 8.616 7.850 ( -4.379 6.258 3.986) 8.616 7.906 ( -1.106 -4.830 9.477) 10.694 7.906 ( -1.106 4.830 9.477) 10.694 8.183 ( -2.435 -3.053 5.528) 6.768 8.183 ( -2.435 3.053 5.528) 6.768 8.437 ( -0.863 -2.776 0.019) 2.907 8.437 ( -0.863 2.776 0.019) 2.907 8.672 ( -2.106 -6.222 -3.892) 7.635 8.672 ( -2.106 6.222 -3.892) 7.635 8.810 ( 4.337 -3.777 -3.543) 6.755 8.810 ( 4.337 3.777 -3.543) 6.755 8.895 ( 3.081 -4.986 -11.035) 12.495 8.895 ( 3.081 4.986 -11.035) 12.495 9.034 ( -1.618 -3.665 -2.703) 4.833 9.034 ( -1.618 3.665 -2.703) 4.833 9.271 ( 1.897 -0.100 -4.785) 5.149 9.271 ( 1.897 0.100 -4.785) 5.149 9.736 ( 5.430 -2.365 1.693) 6.160 9.736 ( 5.430 2.365 1.693) 6.160 10.286 ( 6.860 -4.060 -6.148) 10.067 10.286 ( 6.860 4.060 -6.148) 10.067 10.536 ( 2.202 -2.646 2.853) 4.471 10.536 ( 2.202 2.646 2.853) 4.471 10.635 ( -1.594 -2.277 -5.494) 6.157 10.635 ( -1.594 2.277 -5.494) 6.157 10.920 ( -1.053 -5.381 -3.875) 6.714 10.920 ( -1.053 5.381 -3.875) 6.714 11.045 ( 4.680 -6.656 -2.728) 8.582 11.045 ( 4.680 6.656 -2.728) 8.582 11.632 ( 2.064 -2.469 -4.117) 5.225 11.632 ( 2.064 2.469 -4.117) 5.225 11.849 ( 6.425 -1.485 0.640) 6.626 11.849 ( 6.425 1.485 0.640) 6.626 12.345 ( -4.711 -4.593 3.346) 7.381 12.345 ( -4.711 4.593 3.346) 7.381 12.469 ( -9.167 -5.192 -0.820) 10.567 12.469 ( -9.167 5.192 -0.820) 10.567 13.166 ( 2.277 -2.405 -4.823) 5.851 13.166 ( 2.277 2.405 -4.823) 5.851 13.538 ( 9.229 -3.909 0.259) 10.026 13.538 ( 9.229 3.909 0.259) 10.026 13.834 ( -2.611 -16.267 11.103) 19.868 13.834 ( -2.611 16.267 11.103) 19.868 14.506 ( -6.396 -5.959 -8.529) 12.213 14.506 ( -6.396 5.959 -8.529) 12.213 14.641 ( -4.002 -9.359 -11.228) 15.155 14.641 ( -4.002 9.359 -11.228) 15.155 15.481 ( 12.479 -6.939 0.022) 14.278 15.481 ( 12.479 6.939 0.022) 14.278 16.144 ( -2.059 -1.781 -0.291) 2.738 16.144 ( -2.059 1.781 -0.291) 2.738 16.198 ( -3.484 -6.214 5.035) 8.724 16.198 ( -3.484 6.214 5.035) 8.724 16.463 ( -3.021 -9.293 1.914) 9.957 16.463 ( -3.021 9.293 1.914) 9.957 16.910 ( 3.331 -4.045 3.439) 6.268 16.910 ( 3.331 4.045 3.439) 6.268 19.462 ( -3.452 -11.270 31.240) 33.390 19.462 ( -3.452 11.270 31.240) 33.390 20.224 ( -4.871 -5.579 23.745) 24.873 20.224 ( -4.871 5.579 23.745) 24.873 20.875 ( 8.788 -4.545 -36.786) 38.093 20.875 ( 8.788 4.545 -36.786) 38.093 21.320 ( 7.836 -1.038 -31.060) 32.050 21.320 ( 7.836 1.038 -31.060) 32.050 25.537 ( -11.914 -1.388 -5.439) 13.170 25.537 ( -11.914 1.388 -5.439) 13.170 25.580 ( -2.664 -0.714 4.413) 5.204 25.580 ( -2.664 0.714 4.413) 5.204 26.118 ( 0.943 -1.104 13.436) 13.514 26.118 ( 0.943 1.104 13.436) 13.514 26.891 ( 8.975 -1.715 -16.381) 18.757 26.891 ( 8.975 1.715 -16.381) 18.757 28.634 ( -2.325 -5.121 -3.285) 6.513 28.634 ( -2.325 5.121 -3.285) 6.513 28.852 ( 3.146 -1.806 1.344) 3.868 28.852 ( 3.146 1.806 1.344) 3.868 29.721 ( -5.286 -6.550 5.776) 10.208 29.721 ( -5.286 6.550 5.776) 10.208 30.427 ( 1.307 -15.618 -10.612) 18.927 30.427 ( 1.307 15.618 -10.612) 18.927 31.124 ( -1.257 -5.016 14.215) 15.126 31.124 ( -1.257 5.016 14.215) 15.126 31.389 ( -2.012 -5.210 6.307) 8.424 31.389 ( -2.012 5.210 6.307) 8.424 31.943 ( -0.422 -3.874 6.662) 7.718 31.943 ( -0.422 3.874 6.662) 7.718 32.445 ( 3.792 -10.818 -8.602) 14.332 32.445 ( 3.792 10.818 -8.602) 14.332 ======================= Grid point 175 (93/104) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 52 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.331 ( -1.823 0.000 -21.534) 21.611 3.331 ( 1.823 0.000 21.534) 21.611 3.580 ( 6.132 0.000 -13.495) 14.823 3.580 ( -6.132 0.000 13.495) 14.823 3.899 ( -1.413 0.000 -7.816) 7.943 3.899 ( 1.413 0.000 7.816) 7.943 4.143 ( -12.012 0.000 -26.447) 29.047 4.143 ( 12.012 0.000 26.447) 29.047 4.492 ( 3.907 0.000 -6.760) 7.808 4.492 ( -3.907 0.000 6.760) 7.808 5.142 ( -2.693 0.000 -19.341) 19.527 5.142 ( 2.693 0.000 19.341) 19.527 5.393 ( -9.751 0.000 -10.937) 14.652 5.393 ( 9.751 0.000 10.937) 14.652 5.468 ( -11.870 0.000 -3.289) 12.317 5.468 ( 11.870 0.000 3.289) 12.317 5.944 ( -8.412 0.000 2.553) 8.791 5.944 ( 8.412 0.000 -2.553) 8.791 6.207 ( -2.356 0.000 -2.575) 3.490 6.207 ( 2.356 0.000 2.575) 3.490 6.733 ( -2.652 0.000 -9.116) 9.494 6.733 ( 2.652 0.000 9.116) 9.494 6.886 ( 6.705 0.000 -11.167) 13.025 6.886 ( -6.705 0.000 11.167) 13.025 7.097 ( 7.592 0.000 -18.955) 20.419 7.097 ( -7.592 0.000 18.955) 20.419 7.291 ( -1.257 0.000 -0.671) 1.425 7.291 ( 1.257 0.000 0.671) 1.425 7.552 ( -1.909 0.000 -4.231) 4.642 7.552 ( 1.909 0.000 4.231) 4.642 7.751 ( 5.015 0.000 -15.392) 16.188 7.751 ( -5.015 0.000 15.392) 16.188 8.074 ( -5.347 0.000 -10.284) 11.591 8.074 ( 5.347 0.000 10.284) 11.591 8.202 ( 2.430 0.000 -13.884) 14.095 8.202 ( -2.430 0.000 13.884) 14.095 8.436 ( 1.000 0.000 -25.514) 25.533 8.436 ( -1.000 0.000 25.514) 25.533 8.636 ( 1.454 0.000 -12.609) 12.692 8.636 ( -1.454 0.000 12.609) 12.692 8.856 ( 2.701 0.000 -5.948) 6.533 8.856 ( -2.701 0.000 5.948) 6.533 8.923 ( 0.267 0.000 -11.420) 11.423 8.923 ( -0.267 0.000 11.420) 11.423 9.104 ( 4.795 0.000 -15.259) 15.995 9.104 ( -4.795 0.000 15.259) 15.995 9.521 ( -1.665 0.000 -6.763) 6.965 9.521 ( 1.665 0.000 6.763) 6.965 9.884 ( 2.561 0.000 -4.721) 5.371 9.884 ( -2.561 0.000 4.721) 5.371 10.246 ( -1.293 0.000 -10.618) 10.697 10.246 ( 1.293 0.000 10.618) 10.697 10.565 ( -5.541 0.000 -6.535) 8.568 10.565 ( 5.541 0.000 6.535) 8.568 10.678 ( 13.453 0.000 -11.463) 17.675 10.678 ( -13.453 0.000 11.463) 17.675 10.897 ( -3.280 0.000 -2.820) 4.326 10.897 ( 3.280 0.000 2.820) 4.326 10.951 ( -7.394 0.000 1.958) 7.649 10.951 ( 7.394 0.000 -1.958) 7.649 11.761 ( 3.084 0.000 -1.997) 3.674 11.761 ( -3.084 0.000 1.997) 3.674 12.174 ( 2.063 0.000 -6.210) 6.544 12.174 ( -2.063 0.000 6.210) 6.544 12.327 ( 14.350 0.000 -6.429) 15.724 12.327 ( -14.350 0.000 6.429) 15.724 12.446 ( 1.212 0.000 -10.920) 10.987 12.446 ( -1.212 0.000 10.920) 10.987 12.963 ( -2.975 0.000 -1.730) 3.442 12.963 ( 2.975 0.000 1.730) 3.442 13.511 ( -1.287 0.000 -16.981) 17.030 13.511 ( 1.287 0.000 16.981) 17.030 13.772 ( 8.689 0.000 -9.665) 12.997 13.772 ( -8.689 0.000 9.665) 12.997 14.126 ( -3.843 0.000 -4.655) 6.037 14.126 ( 3.843 0.000 4.655) 6.037 15.246 ( -12.948 0.000 -5.450) 14.048 15.246 ( 12.948 0.000 5.450) 14.048 15.500 ( -5.597 0.000 -11.757) 13.021 15.500 ( 5.597 0.000 11.757) 13.021 15.835 ( -21.303 0.000 6.098) 22.158 15.835 ( 21.303 0.000 -6.098) 22.158 16.121 ( 3.301 0.000 -7.279) 7.992 16.121 ( -3.301 0.000 7.279) 7.992 16.535 ( -7.170 0.000 -2.161) 7.488 16.535 ( 7.170 0.000 2.161) 7.488 17.361 ( -4.470 0.000 -4.719) 6.500 17.361 ( 4.470 0.000 4.719) 6.500 19.563 ( 5.462 0.000 -38.771) 39.154 19.563 ( -5.462 0.000 38.771) 39.154 20.273 ( 17.212 0.000 -30.148) 34.716 20.273 ( -17.212 0.000 30.148) 34.716 20.890 ( -0.586 0.000 -27.976) 27.982 20.890 ( 0.586 0.000 27.976) 27.982 20.951 ( 10.593 0.000 -28.881) 30.762 20.951 ( -10.593 0.000 28.881) 30.762 25.433 ( 5.204 0.000 -4.415) 6.825 25.433 ( -5.204 0.000 4.415) 6.825 25.500 ( 6.530 0.000 -2.783) 7.098 25.500 ( -6.530 0.000 2.783) 7.098 26.482 ( 4.262 0.000 -20.101) 20.548 26.482 ( -4.262 0.000 20.101) 20.548 26.611 ( -4.881 0.000 -18.792) 19.416 26.611 ( 4.881 0.000 18.792) 19.416 28.471 ( -2.548 0.000 -3.931) 4.685 28.471 ( 2.548 0.000 3.931) 4.685 28.894 ( -3.683 0.000 0.559) 3.725 28.894 ( 3.683 0.000 -0.559) 3.725 29.638 ( -19.455 0.000 2.760) 19.650 29.638 ( 19.455 0.000 -2.760) 19.650 30.416 ( -10.968 0.000 -14.612) 18.270 30.416 ( 10.968 0.000 14.612) 18.270 31.153 ( -0.978 0.000 -6.567) 6.639 31.153 ( 0.978 0.000 6.567) 6.639 31.633 ( -7.602 0.000 0.386) 7.611 31.633 ( 7.602 0.000 -0.386) 7.611 31.832 ( -2.367 0.000 -0.029) 2.367 31.832 ( 2.367 0.000 0.029) 2.367 32.493 ( -5.488 0.000 -12.628) 13.769 32.493 ( 5.488 0.000 12.628) 13.769 ======================= Grid point 177 (94/104) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.159 ( -3.805 0.000 -20.525) 20.875 3.302 ( -13.780 0.000 10.098) 17.084 3.451 ( -7.810 0.000 17.869) 19.502 3.487 ( -3.774 0.000 -21.334) 21.665 3.767 ( -6.692 0.000 -25.022) 25.902 3.923 ( 3.628 0.000 -6.783) 7.693 4.003 ( 3.213 0.000 3.753) 4.941 4.133 ( -11.683 0.000 -4.537) 12.533 4.519 ( 1.329 0.000 12.974) 13.042 4.799 ( 13.029 0.000 16.415) 20.957 5.015 ( -1.123 0.000 0.450) 1.210 5.019 ( -10.211 0.000 -3.131) 10.680 5.195 ( -6.591 0.000 -15.399) 16.750 5.409 ( 4.060 0.000 14.174) 14.743 5.757 ( 11.801 0.000 16.513) 20.296 5.780 ( -6.060 0.000 8.695) 10.598 5.793 ( 15.149 0.000 -9.958) 18.129 6.030 ( 1.726 0.000 6.141) 6.379 6.117 ( -5.362 0.000 -0.184) 5.365 6.251 ( 0.079 0.000 7.823) 7.823 6.715 ( 4.384 0.000 -11.297) 12.118 6.802 ( -3.431 0.000 17.902) 18.228 6.925 ( 8.007 0.000 4.631) 9.250 7.009 ( 8.339 0.000 -5.644) 10.070 7.085 ( -2.175 0.000 9.677) 9.919 7.226 ( 5.872 0.000 -13.141) 14.394 7.266 ( -0.559 0.000 -7.076) 7.098 7.350 ( 4.134 0.000 -9.112) 10.006 7.562 ( 9.101 0.000 -8.510) 12.460 7.642 ( 4.916 0.000 5.084) 7.072 7.775 ( -0.275 0.000 14.985) 14.988 7.825 ( 4.661 0.000 -6.202) 7.758 7.951 ( 0.456 0.000 -17.433) 17.439 8.172 ( -2.756 0.000 8.673) 9.100 8.209 ( 5.977 0.000 -14.306) 15.504 8.291 ( 6.605 0.000 11.875) 13.589 8.371 ( 3.731 0.000 -20.818) 21.150 8.531 ( -0.356 0.000 20.551) 20.554 8.610 ( 1.731 0.000 -10.987) 11.123 8.655 ( -2.118 0.000 16.540) 16.675 8.820 ( -2.308 0.000 4.870) 5.389 8.852 ( -0.621 0.000 -6.502) 6.532 8.886 ( 2.027 0.000 -9.518) 9.731 8.933 ( -4.336 0.000 14.280) 14.923 9.072 ( -5.061 0.000 13.081) 14.026 9.143 ( 5.703 0.000 -21.440) 22.185 9.441 ( -0.450 0.000 -15.031) 15.038 9.526 ( -5.430 0.000 3.344) 6.377 9.798 ( -3.223 0.000 1.733) 3.659 9.813 ( -6.845 0.000 -1.863) 7.094 10.122 ( -5.533 0.000 -9.092) 10.644 10.262 ( -6.019 0.000 15.222) 16.369 10.320 ( -17.810 0.000 9.478) 20.175 10.363 ( -6.997 0.000 -8.678) 11.147 10.729 ( -1.260 0.000 5.436) 5.580 10.810 ( -2.919 0.000 -0.987) 3.081 10.846 ( 2.191 0.000 5.054) 5.508 10.907 ( 8.486 0.000 -5.095) 9.898 11.025 ( 3.930 0.000 3.209) 5.073 11.111 ( 6.248 0.000 -2.319) 6.665 11.745 ( 1.374 0.000 0.346) 1.416 11.826 ( 2.940 0.000 -1.519) 3.309 11.982 ( -9.534 0.000 3.670) 10.216 12.168 ( 1.342 0.000 -8.195) 8.304 12.290 ( 0.571 0.000 12.598) 12.611 12.403 ( 1.171 0.000 -13.272) 13.323 12.470 ( -0.891 0.000 9.893) 9.933 12.565 ( 4.738 0.000 -6.341) 7.916 12.972 ( 5.098 0.000 0.393) 5.113 13.079 ( 6.662 0.000 3.392) 7.476 13.453 ( 4.517 0.000 -13.306) 14.052 13.530 ( -9.066 0.000 13.310) 16.104 13.700 ( 0.636 0.000 14.523) 14.536 13.823 ( -2.336 0.000 -5.733) 6.191 14.091 ( 4.623 0.000 -8.243) 9.451 14.177 ( -3.888 0.000 6.953) 7.966 15.058 ( 0.153 0.000 -7.125) 7.126 15.207 ( -24.171 0.000 1.115) 24.197 15.265 ( -10.424 0.000 -12.915) 16.597 15.545 ( -5.076 0.000 9.493) 10.765 15.759 ( 19.322 0.000 5.989) 20.229 16.092 ( 6.120 0.000 -5.113) 7.975 16.124 ( -0.779 0.000 10.354) 10.384 16.205 ( 5.870 0.000 -4.274) 7.261 16.436 ( -1.958 0.000 -3.842) 4.313 16.787 ( 15.209 0.000 -2.731) 15.452 17.151 ( -13.415 0.000 -3.001) 13.747 17.392 ( -3.557 0.000 6.460) 7.374 19.547 ( 9.102 0.000 -36.756) 37.866 19.673 ( -1.130 0.000 41.569) 41.584 20.020 ( -19.064 0.000 32.063) 37.303 20.457 ( 12.446 0.000 -30.166) 32.632 20.660 ( -7.735 0.000 -31.391) 32.330 20.835 ( -11.878 0.000 28.587) 30.956 20.981 ( -3.496 0.000 28.297) 28.512 21.024 ( 8.268 0.000 -28.544) 29.717 25.403 ( 1.034 0.000 6.850) 6.928 25.550 ( 8.337 0.000 4.017) 9.254 25.593 ( 10.869 0.000 -5.364) 12.121 25.714 ( 12.984 0.000 -7.918) 15.208 26.360 ( -6.753 0.000 -16.595) 17.916 26.439 ( -7.911 0.000 19.374) 20.927 26.479 ( 1.630 0.000 -19.608) 19.676 26.720 ( -3.441 0.000 17.215) 17.555 28.454 ( 2.134 0.000 -2.627) 3.384 28.606 ( 7.680 0.000 6.036) 9.768 28.798 ( -5.139 0.000 0.790) 5.199 28.943 ( 1.147 0.000 -0.811) 1.405 29.324 ( -9.603 0.000 1.122) 9.668 30.060 ( -1.084 0.000 -11.282) 11.333 30.077 ( 7.314 0.000 -9.739) 12.180 30.655 ( 4.284 0.000 14.809) 15.416 31.118 ( 0.792 0.000 -6.865) 6.911 31.201 ( 0.621 0.000 3.521) 3.575 31.477 ( -3.634 0.000 -5.014) 6.192 31.644 ( -3.376 0.000 -1.926) 3.887 31.882 ( 0.099 0.000 3.135) 3.136 31.921 ( 7.074 0.000 -0.372) 7.084 32.289 ( -6.865 0.000 -6.397) 9.384 32.589 ( -2.463 0.000 13.799) 14.017 ======================= Grid point 178 (95/104) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.033 ( 0.694 0.000 -16.189) 16.204 3.072 ( -8.907 0.000 9.408) 12.956 3.346 ( 0.477 0.000 -19.290) 19.295 3.351 ( -6.710 0.000 13.614) 15.178 3.648 ( 0.464 0.000 -2.267) 2.314 3.773 ( -9.704 0.000 -8.262) 12.745 4.030 ( 1.531 0.000 -0.786) 1.721 4.045 ( -0.084 0.000 1.813) 1.815 4.679 ( 8.399 0.000 6.955) 10.904 4.837 ( -5.711 0.000 6.990) 9.026 4.879 ( -2.130 0.000 1.211) 2.450 4.975 ( -5.813 0.000 -18.639) 19.525 5.251 ( 8.327 0.000 19.181) 20.911 5.436 ( -3.284 0.000 -6.010) 6.849 5.806 ( 3.930 0.000 7.157) 8.165 5.922 ( -0.417 0.000 -3.287) 3.313 5.970 ( 2.564 0.000 5.171) 5.772 5.995 ( -2.421 0.000 -4.322) 4.953 6.216 ( 10.229 0.000 1.682) 10.367 6.307 ( -0.890 0.000 15.217) 15.243 6.783 ( 6.124 0.000 -12.950) 14.325 6.816 ( -2.513 0.000 10.056) 10.365 7.075 ( 0.258 0.000 -9.169) 9.173 7.084 ( -3.463 0.000 8.680) 9.346 7.109 ( 6.758 0.000 8.196) 10.622 7.234 ( 3.497 0.000 -7.361) 8.149 7.258 ( 0.240 0.000 1.875) 1.891 7.291 ( -3.530 0.000 -10.758) 11.323 7.725 ( 6.563 0.000 -12.575) 14.185 7.761 ( 2.523 0.000 2.963) 3.892 7.806 ( -3.905 0.000 16.652) 17.104 7.840 ( -0.173 0.000 -7.624) 7.626 7.992 ( 10.650 0.000 -15.181) 18.544 8.123 ( -6.108 0.000 11.339) 12.879 8.313 ( 6.345 0.000 -13.507) 14.923 8.380 ( -3.469 0.000 8.356) 9.047 8.475 ( 11.981 0.000 -14.207) 18.584 8.574 ( -3.754 0.000 13.807) 14.308 8.641 ( 5.789 0.000 -9.255) 10.917 8.722 ( -3.528 0.000 12.042) 12.548 8.811 ( -1.430 0.000 7.449) 7.586 8.823 ( 1.192 0.000 -8.844) 8.924 8.945 ( 8.758 0.000 -1.705) 8.923 8.948 ( 3.129 0.000 22.216) 22.435 9.058 ( -1.037 0.000 21.361) 21.386 9.099 ( -0.843 0.000 -19.647) 19.665 9.298 ( -13.383 0.000 -5.823) 14.595 9.331 ( -4.939 0.000 -24.911) 25.396 9.710 ( 3.276 0.000 -2.691) 4.239 9.816 ( 1.867 0.000 -0.054) 1.868 9.967 ( -4.706 0.000 -7.299) 8.684 9.969 ( -17.015 0.000 18.987) 25.496 10.214 ( -3.531 0.000 6.595) 7.481 10.226 ( -1.997 0.000 -7.624) 7.881 10.719 ( 0.359 0.000 2.451) 2.478 10.755 ( -1.979 0.000 -0.818) 2.141 10.939 ( 2.182 0.000 4.597) 5.088 10.979 ( 0.728 0.000 -3.950) 4.016 11.100 ( 2.441 0.000 5.117) 5.670 11.162 ( -0.404 0.000 -3.010) 3.037 11.797 ( 3.008 0.000 -1.299) 3.276 11.847 ( -1.066 0.000 0.024) 1.066 11.982 ( 6.518 0.000 4.461) 7.898 12.135 ( -2.678 0.000 -5.334) 5.969 12.314 ( -4.195 0.000 15.883) 16.428 12.336 ( -0.490 0.000 -16.990) 16.997 12.514 ( 0.172 0.000 9.671) 9.673 12.546 ( 0.296 0.000 -8.375) 8.381 13.132 ( 8.826 0.000 -1.933) 9.036 13.256 ( 3.957 0.000 2.591) 4.730 13.380 ( -3.878 0.000 8.868) 9.679 13.524 ( -1.975 0.000 -5.628) 5.964 13.762 ( 7.349 0.000 -9.021) 11.635 13.859 ( 6.475 0.000 16.764) 17.971 14.008 ( -13.723 0.000 9.821) 16.875 14.094 ( -3.904 0.000 -14.411) 14.931 14.826 ( -5.913 0.000 4.186) 7.245 14.957 ( -9.928 0.000 -11.391) 15.110 15.194 ( 11.319 0.000 -7.013) 13.315 15.414 ( -10.962 0.000 8.524) 13.886 16.151 ( 2.291 0.000 -4.839) 5.354 16.154 ( -0.645 0.000 7.645) 7.672 16.223 ( 15.073 0.000 9.881) 18.023 16.286 ( 3.304 0.000 -3.179) 4.585 16.414 ( 5.718 0.000 -7.350) 9.312 16.775 ( -20.082 0.000 -0.264) 20.084 17.083 ( 13.408 0.000 -7.513) 15.370 17.287 ( -9.022 0.000 7.865) 11.969 19.618 ( 12.958 0.000 -35.371) 37.670 19.776 ( -16.543 0.000 35.078) 38.783 19.910 ( 4.556 0.000 41.862) 42.109 20.262 ( -9.654 0.000 -40.492) 41.627 20.601 ( 10.919 0.000 -27.800) 29.867 20.713 ( -11.585 0.000 28.426) 30.696 21.023 ( -4.555 0.000 28.663) 29.022 21.044 ( 5.904 0.000 -28.617) 29.220 25.540 ( 7.085 0.000 10.153) 12.381 25.710 ( -0.683 0.000 -10.444) 10.466 25.790 ( 8.318 0.000 10.611) 13.483 25.882 ( 5.961 0.000 -13.366) 14.635 26.237 ( 3.300 0.000 -12.480) 12.909 26.330 ( -9.487 0.000 16.230) 18.799 26.463 ( 6.591 0.000 -16.096) 17.393 26.619 ( -11.588 0.000 14.393) 18.478 28.527 ( 5.306 0.000 -1.673) 5.563 28.648 ( -5.955 0.000 1.151) 6.066 28.846 ( 6.505 0.000 5.659) 8.622 28.936 ( -1.296 0.000 -1.792) 2.211 29.297 ( 7.180 0.000 5.795) 9.227 29.640 ( -17.451 0.000 -13.628) 22.141 30.458 ( 16.923 0.000 -8.541) 18.957 30.683 ( -7.828 0.000 12.118) 14.427 31.132 ( 2.949 0.000 -4.697) 5.546 31.187 ( -2.903 0.000 1.997) 3.524 31.485 ( 5.398 0.000 -1.714) 5.664 31.587 ( -2.298 0.000 -0.889) 2.464 31.862 ( -1.779 0.000 0.323) 1.808 31.895 ( -5.711 0.000 -1.002) 5.799 32.323 ( 10.188 0.000 -4.505) 11.139 32.514 ( -9.323 0.000 10.392) 13.961 ======================= Grid point 181 (96/104) ======================= q-point: ( 0.00 0.17 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.250 ( -0.046 -7.629 -17.923) 19.479 3.250 ( 0.046 -7.629 17.923) 19.479 3.571 ( -3.064 -2.242 -13.109) 13.648 3.571 ( 3.064 -2.242 13.109) 13.648 3.919 ( -6.777 0.743 -11.182) 13.097 3.919 ( 6.777 0.743 11.182) 13.097 4.191 ( -2.561 2.876 -15.413) 15.886 4.191 ( 2.561 2.876 15.413) 15.886 4.339 ( -1.010 -5.088 -14.212) 15.129 4.339 ( 1.010 -5.088 14.212) 15.129 5.128 ( -9.852 -8.052 -4.350) 13.447 5.128 ( 9.852 -8.052 4.350) 13.447 5.487 ( -0.856 10.677 -7.141) 12.873 5.487 ( 0.856 10.677 7.141) 12.873 5.635 ( -11.894 16.064 -7.137) 21.224 5.635 ( 11.894 16.064 7.137) 21.224 5.941 ( 3.046 -1.273 -2.269) 4.006 5.941 ( -3.046 -1.273 2.269) 4.006 6.147 ( -1.706 -5.678 -2.873) 6.589 6.147 ( 1.706 -5.678 2.873) 6.589 6.733 ( -3.169 0.665 -3.836) 5.020 6.733 ( 3.169 0.665 3.836) 5.020 6.908 ( 1.027 -5.513 -7.540) 9.397 6.908 ( -1.027 -5.513 7.540) 9.397 7.054 ( 8.336 9.871 -15.802) 20.412 7.054 ( -8.336 9.871 15.802) 20.412 7.490 ( -3.774 12.099 -1.668) 12.783 7.490 ( 3.774 12.099 1.668) 12.783 7.580 ( -0.184 2.973 -6.918) 7.533 7.580 ( 0.184 2.973 6.918) 7.533 7.742 ( 4.606 0.715 -12.905) 13.721 7.742 ( -4.606 0.715 12.905) 13.721 8.076 ( -3.235 0.658 -5.071) 6.050 8.076 ( 3.235 0.658 5.071) 6.050 8.234 ( 1.551 2.011 -11.647) 11.921 8.234 ( -1.551 2.011 11.647) 11.921 8.432 ( 2.346 -0.281 -15.095) 15.279 8.432 ( -2.346 -0.281 15.095) 15.279 8.633 ( 0.041 -0.293 -2.881) 2.896 8.633 ( -0.041 -0.293 2.881) 2.896 8.843 ( 2.284 -1.728 -6.946) 7.513 8.843 ( -2.284 -1.728 6.946) 7.513 8.900 ( -0.601 -1.679 -7.726) 7.929 8.900 ( 0.601 -1.679 7.726) 7.929 9.071 ( 3.412 -3.480 -12.013) 12.964 9.071 ( -3.412 -3.480 12.013) 12.964 9.476 ( 0.045 -5.488 -5.828) 8.005 9.476 ( -0.045 -5.488 5.828) 8.005 9.866 ( 2.517 -1.557 -2.958) 4.185 9.866 ( -2.517 -1.557 2.958) 4.185 10.270 ( -0.904 3.198 -9.100) 9.688 10.270 ( 0.904 3.198 9.100) 9.688 10.557 ( 5.295 -7.183 -8.436) 12.280 10.557 ( -5.295 -7.183 8.436) 12.280 10.607 ( -5.832 1.342 -6.556) 8.877 10.607 ( 5.832 1.342 6.556) 8.877 10.900 ( -6.086 -1.552 -2.816) 6.883 10.900 ( 6.086 -1.552 2.816) 6.883 10.995 ( 3.347 4.051 -2.705) 5.910 10.995 ( -3.347 4.051 2.705) 5.910 11.733 ( 6.439 -3.361 -3.824) 8.208 11.733 ( -6.439 -3.361 3.824) 8.208 12.141 ( -5.847 -3.291 -3.104) 7.392 12.141 ( 5.847 -3.291 3.104) 7.392 12.305 ( 1.913 -2.240 -2.023) 3.574 12.305 ( -1.913 -2.240 2.023) 3.574 12.377 ( -9.999 -4.557 -3.883) 11.654 12.377 ( 9.999 -4.557 3.883) 11.654 13.031 ( -1.112 4.995 -3.011) 5.937 13.031 ( 1.112 4.995 3.011) 5.937 13.582 ( 1.030 7.043 -16.292) 17.779 13.582 ( -1.030 7.043 16.292) 17.779 13.788 ( 7.399 1.285 -6.084) 9.665 13.788 ( -7.399 1.285 6.084) 9.665 14.137 ( -3.399 1.472 -4.833) 6.089 14.137 ( 3.399 1.472 4.833) 6.089 15.008 ( 4.613 -17.808 -7.587) 19.899 15.008 ( -4.613 -17.808 7.587) 19.899 15.574 ( -7.509 3.037 -1.274) 8.199 15.574 ( 7.509 3.037 1.274) 8.199 15.930 ( 13.348 7.643 -4.919) 16.149 15.930 ( -13.348 7.643 4.919) 16.149 16.132 ( 2.250 1.334 -6.491) 6.998 16.132 ( -2.250 1.334 6.491) 6.998 16.527 ( -6.214 -0.935 -2.863) 6.906 16.527 ( 6.214 -0.935 2.863) 6.906 17.263 ( -3.605 -9.143 -4.186) 10.683 17.263 ( 3.605 -9.143 4.186) 10.683 19.661 ( 5.792 9.724 -38.095) 39.741 19.661 ( -5.792 9.724 38.095) 39.741 20.292 ( 15.823 1.616 -29.990) 33.947 20.292 ( -15.823 1.616 29.990) 33.947 20.838 ( -0.055 -5.086 -28.502) 28.953 20.838 ( 0.055 -5.086 28.502) 28.953 20.926 ( 10.232 -2.562 -28.492) 30.382 20.926 ( -10.232 -2.562 28.492) 30.382 25.398 ( 2.427 -2.553 -2.342) 4.230 25.398 ( -2.427 -2.553 2.342) 4.230 25.537 ( 0.428 2.618 -0.508) 2.701 25.537 ( -0.428 2.618 0.508) 2.701 26.454 ( 3.580 -2.248 -11.802) 12.537 26.454 ( -3.580 -2.248 11.802) 12.537 26.640 ( -4.313 2.381 -10.595) 11.685 26.640 ( 4.313 2.381 10.595) 11.685 28.493 ( -2.551 2.162 -3.308) 4.704 28.493 ( 2.551 2.162 3.308) 4.704 28.903 ( -2.948 0.723 -0.116) 3.038 28.903 ( 2.948 0.723 0.116) 3.038 29.658 ( -16.578 2.193 3.085) 17.005 29.658 ( 16.578 2.193 -3.085) 17.005 30.385 ( -9.726 -3.144 -13.588) 17.003 30.385 ( 9.726 -3.144 13.588) 17.003 31.184 ( -1.131 3.221 -6.069) 6.963 31.184 ( 1.131 3.221 6.069) 6.963 31.600 ( -6.556 -3.417 -0.330) 7.401 31.600 ( 6.556 -3.417 0.330) 7.401 31.872 ( -1.204 4.069 -2.823) 5.096 31.872 ( 1.204 4.069 2.823) 5.096 32.463 ( -4.983 -3.069 -11.875) 13.238 32.463 ( 4.983 -3.069 11.875) 13.238 ======================= Grid point 183 (97/104) ======================= q-point: ( 0.20 0.17 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.157 ( -0.428 -0.805 -16.909) 16.934 3.299 ( -2.117 -9.694 12.052) 15.611 3.325 ( -8.961 -0.890 -9.216) 12.885 3.581 ( -9.204 9.229 2.299) 13.235 3.733 ( -1.270 -1.726 -11.173) 11.377 4.006 ( -1.051 2.221 -8.225) 8.585 4.083 ( -2.710 4.516 -5.788) 7.825 4.149 ( -3.840 6.102 -0.858) 7.261 4.362 ( 3.362 -8.496 1.559) 9.269 4.687 ( 16.509 -9.082 24.563) 30.957 4.941 ( -7.036 -3.872 -0.101) 8.032 5.193 ( -10.362 1.619 -5.429) 11.810 5.284 ( -12.131 18.310 -4.422) 22.405 5.400 ( 7.028 -8.831 14.737) 18.562 5.637 ( 2.875 0.218 -5.228) 5.970 5.843 ( -1.869 4.887 5.986) 7.950 5.985 ( 7.772 8.524 -5.029) 12.584 6.017 ( 6.045 -1.535 5.627) 8.401 6.118 ( -0.534 0.295 4.226) 4.269 6.196 ( 0.410 -4.366 6.929) 8.200 6.747 ( 5.325 2.859 -5.111) 7.915 6.898 ( 1.851 3.369 1.311) 4.062 6.929 ( 6.300 1.342 1.789) 6.685 6.975 ( 0.210 1.219 13.321) 13.378 7.027 ( 6.885 -7.041 -2.088) 10.067 7.104 ( 1.337 6.956 -6.303) 9.482 7.429 ( -1.315 8.249 -5.512) 10.008 7.545 ( 1.653 12.355 -6.815) 14.207 7.613 ( 5.706 4.210 -3.710) 8.003 7.654 ( 4.105 1.620 5.000) 6.669 7.738 ( 2.367 -1.268 2.543) 3.699 7.899 ( 7.436 6.474 -1.155) 9.927 8.005 ( 0.436 5.212 -12.782) 13.811 8.164 ( -1.544 -1.220 5.299) 5.652 8.223 ( 6.859 1.357 -12.771) 14.559 8.296 ( 5.126 0.921 7.348) 9.007 8.389 ( -0.862 -0.520 -3.828) 3.958 8.467 ( 2.860 -2.521 -5.126) 6.388 8.608 ( -2.567 -2.190 10.391) 10.925 8.683 ( 0.783 1.859 9.642) 9.851 8.802 ( -2.734 -0.709 1.220) 3.077 8.814 ( -3.492 -3.725 2.569) 5.716 8.870 ( 2.538 -2.035 -7.899) 8.542 8.921 ( -1.878 -1.308 1.724) 2.865 9.058 ( -3.185 -1.520 10.742) 11.307 9.108 ( 5.072 -3.602 -16.701) 17.823 9.415 ( 0.577 -3.410 -10.666) 11.212 9.488 ( -3.119 -4.955 -0.220) 5.859 9.730 ( -8.858 -3.409 -0.067) 9.492 9.838 ( -3.357 -0.409 1.656) 3.766 10.145 ( -7.252 2.443 -4.526) 8.891 10.266 ( -5.829 2.813 12.146) 13.763 10.297 ( -13.744 -1.193 4.296) 14.450 10.458 ( -5.420 7.031 -5.605) 10.499 10.711 ( 0.629 -4.400 4.034) 6.002 10.752 ( 7.288 -6.996 -4.164) 10.927 10.796 ( -2.365 -2.670 0.251) 3.575 10.872 ( -0.995 1.420 2.705) 3.213 11.036 ( 3.730 -1.540 4.627) 6.140 11.129 ( 4.029 0.982 -2.620) 4.905 11.645 ( -2.947 -6.482 3.609) 7.983 11.869 ( 5.939 -0.897 -3.194) 6.803 11.927 ( -10.290 -5.097 -0.146) 11.484 12.086 ( -6.779 -8.017 -0.886) 10.536 12.283 ( 0.168 -1.139 2.385) 2.648 12.367 ( 8.737 -1.417 6.540) 11.006 12.399 ( 6.313 -0.397 -7.930) 10.144 12.669 ( 8.699 3.356 -3.464) 9.946 12.979 ( 0.611 1.438 0.846) 1.777 13.109 ( 3.168 2.113 0.953) 3.926 13.486 ( -4.655 1.761 -2.485) 5.563 13.556 ( -8.264 2.986 4.491) 9.868 13.642 ( -1.503 -1.098 3.892) 4.314 13.924 ( 2.772 6.310 4.511) 8.237 14.164 ( 7.076 6.500 -5.482) 11.062 14.202 ( -1.756 3.639 6.118) 7.332 14.907 ( -0.969 -13.143 -2.147) 13.353 15.027 ( -5.434 -16.773 -6.288) 18.719 15.279 ( -14.836 4.034 -3.459) 15.759 15.596 ( -7.111 1.231 2.502) 7.638 15.867 ( 9.000 9.347 6.085) 14.332 16.089 ( 2.708 -0.025 2.678) 3.808 16.152 ( 1.645 2.019 2.551) 3.646 16.238 ( 6.636 2.835 -5.073) 8.821 16.428 ( -2.022 -0.532 -3.526) 4.099 16.751 ( 13.272 -3.874 -1.420) 13.899 17.083 ( -11.281 -6.071 -2.781) 13.109 17.294 ( -2.752 -9.527 4.889) 11.056 19.643 ( 8.221 9.527 -34.652) 36.866 19.753 ( -1.916 8.032 39.102) 39.964 20.064 ( -17.758 4.389 31.440) 36.374 20.444 ( 10.098 -1.991 -30.566) 32.252 20.641 ( -4.630 -1.303 -30.324) 30.703 20.820 ( -11.273 -1.591 27.606) 29.861 20.926 ( -3.402 -5.632 28.416) 29.168 20.991 ( 7.776 -3.446 -28.254) 29.506 25.399 ( 2.228 -0.297 6.413) 6.796 25.524 ( 8.848 -2.433 4.017) 10.017 25.614 ( 9.485 1.860 -5.181) 10.966 25.715 ( 11.956 0.018 -7.622) 14.179 26.344 ( -5.712 -0.927 -8.975) 10.679 26.452 ( 1.322 -2.202 -14.411) 14.638 26.483 ( -8.826 3.399 9.824) 13.637 26.711 ( -4.128 -1.040 13.672) 14.320 28.474 ( 1.872 2.067 -1.954) 3.405 28.616 ( 6.821 0.794 5.062) 8.532 28.810 ( -5.319 1.269 0.005) 5.469 28.938 ( 0.234 -0.764 -0.463) 0.923 29.412 ( -6.466 9.016 1.705) 11.225 30.037 ( 16.115 -2.944 -6.738) 17.714 30.079 ( -9.800 0.936 -12.350) 15.793 30.598 ( 3.403 -5.957 14.442) 15.988 31.144 ( 0.537 2.710 -5.708) 6.341 31.241 ( 1.386 4.132 1.617) 4.649 31.455 ( -3.281 -2.308 -4.642) 6.135 31.646 ( -2.082 -0.351 -3.769) 4.320 31.911 ( 1.946 0.993 3.392) 4.035 31.921 ( 3.251 2.341 1.198) 4.181 32.275 ( -6.498 -1.413 -5.897) 8.888 32.551 ( -2.513 -4.077 12.917) 13.776 ======================= Grid point 184 (98/104) ======================= q-point: ( 0.40 0.17 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.113 ( 2.881 6.236 -10.922) 12.902 3.172 ( -4.062 8.198 -1.049) 9.209 3.300 ( 0.240 -4.204 3.283) 5.339 3.385 ( -7.832 5.555 3.120) 10.096 3.693 ( 1.679 4.530 -4.707) 6.745 3.813 ( -8.804 3.213 -6.860) 11.615 4.064 ( -0.079 4.677 4.242) 6.315 4.096 ( -0.780 7.184 -5.471) 9.064 4.521 ( 10.472 -12.228 2.113) 16.238 4.769 ( -10.575 -8.758 0.295) 13.733 4.950 ( 1.915 2.874 -4.568) 5.726 5.033 ( -7.929 9.723 2.505) 12.794 5.202 ( 8.936 -4.693 16.824) 19.620 5.435 ( -5.898 -1.497 -6.588) 8.968 5.800 ( 9.974 -13.043 11.567) 20.084 5.908 ( 3.258 7.811 3.813) 9.282 5.978 ( -0.310 -0.826 -0.882) 1.248 6.073 ( -2.540 5.432 -10.397) 12.002 6.151 ( 2.433 -5.727 -2.518) 6.713 6.231 ( -3.580 -5.644 7.722) 10.213 6.838 ( 4.760 5.590 -10.250) 12.609 6.861 ( -2.174 5.933 9.647) 11.532 7.046 ( 2.638 1.245 4.986) 5.777 7.101 ( 1.097 5.837 3.386) 6.836 7.183 ( 9.595 2.196 3.333) 10.392 7.204 ( 7.192 -1.271 -3.651) 8.165 7.356 ( -2.646 10.679 -3.306) 11.488 7.451 ( -6.500 11.394 -6.636) 14.700 7.706 ( 3.086 -0.954 0.157) 3.234 7.756 ( -1.846 -0.887 4.924) 5.333 7.824 ( 5.748 3.271 1.775) 6.848 7.915 ( -1.273 5.044 -11.007) 12.174 8.003 ( 6.440 1.666 -10.766) 12.655 8.118 ( -6.332 -0.805 10.026) 11.885 8.333 ( 2.721 1.102 -7.933) 8.459 8.368 ( -1.887 -0.662 1.444) 2.467 8.469 ( 10.362 -0.692 -4.887) 11.477 8.538 ( 2.972 -1.883 -2.143) 4.120 8.629 ( 0.602 -1.906 9.309) 9.521 8.726 ( -3.899 -0.612 2.893) 4.894 8.778 ( 0.001 -3.857 3.035) 4.908 8.795 ( 0.401 -1.921 -1.863) 2.706 8.877 ( 2.731 -5.908 12.725) 14.293 8.955 ( 9.134 -0.126 -5.068) 10.447 9.043 ( -2.906 -1.559 5.519) 6.429 9.117 ( 2.162 0.942 -2.185) 3.215 9.296 ( -11.113 1.135 -4.117) 11.905 9.349 ( -6.802 0.834 -16.746) 18.094 9.625 ( 6.559 -6.281 -8.331) 12.324 9.803 ( -6.309 -3.411 9.482) 11.889 9.956 ( -6.818 1.333 7.541) 10.254 10.034 ( -8.330 2.525 -1.772) 8.883 10.244 ( 0.273 5.546 3.304) 6.461 10.322 ( -4.954 8.322 -3.697) 10.366 10.706 ( -0.105 -1.634 2.377) 2.886 10.737 ( -2.163 -1.965 -0.681) 3.001 10.882 ( 5.731 -6.171 -4.089) 9.362 10.927 ( 0.589 -2.844 4.439) 5.305 11.096 ( 0.862 -2.303 4.068) 4.754 11.140 ( -1.162 -2.696 -2.554) 3.891 11.651 ( 2.457 -9.826 1.038) 10.181 11.742 ( -6.031 -8.799 1.154) 10.730 11.947 ( 2.176 -7.275 -3.851) 8.514 11.991 ( -3.523 -10.594 2.751) 11.499 12.356 ( 6.319 6.704 0.030) 9.212 12.462 ( 0.354 6.643 -4.506) 8.035 12.562 ( 5.052 5.870 5.475) 9.484 12.655 ( -3.813 7.668 -3.517) 9.257 13.103 ( 8.799 -2.790 -2.672) 9.610 13.196 ( 5.046 -5.129 -0.702) 7.229 13.327 ( -9.355 -5.356 8.208) 13.549 13.400 ( -7.996 -7.589 0.685) 11.045 13.758 ( 12.607 3.509 -8.129) 15.405 14.014 ( -9.588 4.026 9.291) 13.945 14.052 ( 1.783 8.672 11.674) 14.652 14.256 ( -3.506 13.063 -11.955) 18.051 14.761 ( 0.245 -5.781 3.581) 6.805 14.973 ( -11.368 1.627 -9.221) 14.728 15.144 ( 12.466 -4.349 -2.490) 13.436 15.405 ( -11.814 -1.326 3.342) 12.349 16.123 ( 6.801 -3.274 1.688) 7.734 16.143 ( 0.839 -0.758 5.077) 5.201 16.202 ( 3.271 1.183 2.491) 4.278 16.292 ( -0.964 -1.842 -3.644) 4.196 16.459 ( 9.684 4.413 -2.520) 10.936 16.767 ( -15.930 -0.566 -0.954) 15.969 17.021 ( 11.848 -6.445 -5.930) 14.734 17.204 ( -7.795 -8.382 6.020) 12.933 19.700 ( 11.902 8.182 -34.090) 37.023 19.840 ( -15.202 6.213 34.699) 38.389 19.957 ( 2.664 4.850 39.689) 40.073 20.259 ( -7.139 -0.441 -39.773) 40.411 20.604 ( 9.768 0.425 -26.127) 27.897 20.705 ( -10.885 -0.722 26.786) 28.922 20.973 ( -4.194 -5.192 28.412) 29.185 21.001 ( 5.423 -4.396 -28.275) 29.124 25.549 ( 7.371 1.056 9.987) 12.458 25.713 ( 0.027 0.032 -7.762) 7.762 25.776 ( 8.202 -1.186 7.755) 11.350 25.873 ( 5.418 -1.028 -12.763) 13.903 26.244 ( 3.128 0.664 -11.761) 12.188 26.340 ( -9.478 0.920 13.738) 16.715 26.439 ( 5.533 -2.143 -12.990) 14.281 26.591 ( -11.474 -2.752 12.613) 17.272 28.546 ( 5.178 1.966 -0.977) 5.624 28.668 ( -5.938 2.123 0.411) 6.319 28.811 ( 6.078 -3.128 4.930) 8.428 28.914 ( -2.120 -2.220 -1.915) 3.618 29.425 ( 6.630 12.355 4.934) 14.864 29.708 ( -14.599 7.179 -10.981) 19.628 30.401 ( 16.083 -5.923 -8.662) 19.204 30.617 ( -7.768 -7.016 12.266) 16.125 31.162 ( 3.069 3.083 -3.500) 5.584 31.226 ( -2.899 4.048 0.237) 4.984 31.465 ( 5.244 -2.082 -1.505) 5.839 31.581 ( -3.226 -0.998 -2.610) 4.268 31.884 ( -2.337 2.197 4.028) 5.150 31.922 ( -3.503 3.184 -2.970) 5.588 32.294 ( 9.216 -2.980 -3.962) 10.465 32.475 ( -8.960 -4.121 9.636) 13.789 ======================= Grid point 187 (99/104) ======================= q-point: ( 0.00 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.108 ( 1.718 -6.336 -10.381) 12.282 3.108 ( -1.718 -6.336 10.381) 12.282 3.449 ( -6.302 -8.568 -10.617) 15.028 3.449 ( 6.302 -8.568 10.617) 15.028 3.966 ( 1.465 3.299 -9.926) 10.562 3.966 ( -1.465 3.299 9.926) 10.562 4.145 ( 1.627 -2.243 -13.442) 13.725 4.145 ( -1.627 -2.243 13.442) 13.725 4.470 ( 1.656 11.045 -8.552) 14.066 4.470 ( -1.656 11.045 8.552) 14.066 4.992 ( -3.391 -5.194 -2.219) 6.588 4.992 ( 3.391 -5.194 2.219) 6.588 5.595 ( -16.236 3.808 -2.305) 16.835 5.595 ( 16.236 3.808 2.305) 16.835 5.815 ( -3.852 -3.510 -8.527) 9.994 5.815 ( 3.852 -3.510 8.527) 9.994 5.919 ( 3.421 -5.752 -6.532) 9.352 5.919 ( -3.421 -5.752 6.532) 9.352 6.145 ( -11.766 13.404 -6.555) 19.002 6.145 ( 11.766 13.404 6.555) 19.002 6.756 ( -1.938 1.258 -2.160) 3.163 6.756 ( 1.938 1.258 2.160) 3.163 6.844 ( -0.303 -1.754 -8.863) 9.040 6.844 ( 0.303 -1.754 8.863) 9.040 7.262 ( 3.794 10.261 -9.178) 14.280 7.262 ( -3.794 10.261 9.178) 14.280 7.592 ( 0.472 -1.304 -9.670) 9.769 7.592 ( -0.472 -1.304 9.670) 9.769 7.722 ( 4.235 13.481 -4.036) 14.696 7.722 ( -4.235 13.481 4.036) 14.696 7.832 ( 1.978 6.651 -9.516) 11.778 7.832 ( -1.978 6.651 9.516) 11.778 8.090 ( -0.494 0.046 -1.557) 1.634 8.090 ( 0.494 0.046 1.557) 1.634 8.236 ( 0.993 -1.772 -8.350) 8.593 8.236 ( -0.993 -1.772 8.350) 8.593 8.429 ( 2.685 -0.067 -7.779) 8.230 8.429 ( -2.685 -0.067 7.779) 8.230 8.638 ( 0.537 1.197 -12.287) 12.357 8.638 ( -0.537 1.197 12.287) 12.357 8.773 ( 4.411 -5.306 -13.466) 15.131 8.773 ( -4.411 -5.306 13.466) 15.131 8.891 ( -0.181 0.447 -1.325) 1.410 8.891 ( 0.181 0.447 1.325) 1.410 8.987 ( 0.845 -5.039 -6.309) 8.118 8.987 ( -0.845 -5.039 6.309) 8.118 9.318 ( 2.728 -9.790 -5.352) 11.486 9.318 ( -2.728 -9.790 5.352) 11.486 9.849 ( -1.908 -0.038 0.049) 1.909 9.849 ( 1.908 -0.038 -0.049) 1.909 10.336 ( -3.057 0.262 -3.724) 4.825 10.336 ( 3.057 0.262 3.724) 4.825 10.452 ( -0.498 0.889 -7.691) 7.758 10.452 ( 0.498 0.889 7.691) 7.758 10.649 ( -1.343 1.300 -3.393) 3.874 10.649 ( 1.343 1.300 3.393) 3.874 10.845 ( -5.123 -3.813 -4.369) 7.738 10.845 ( 5.123 -3.813 4.369) 7.738 11.057 ( -0.016 2.341 -1.868) 2.995 11.057 ( 0.016 2.341 1.868) 2.995 11.636 ( 5.200 -6.065 -3.771) 8.834 11.636 ( -5.200 -6.065 3.771) 8.834 12.099 ( -8.664 -0.173 -2.597) 9.047 12.099 ( 8.664 -0.173 2.597) 9.047 12.248 ( -1.515 -3.690 -9.190) 10.019 12.248 ( 1.515 -3.690 9.190) 10.019 12.326 ( 10.781 -1.212 -5.891) 12.345 12.326 ( -10.781 -1.212 5.891) 12.345 13.108 ( -0.321 3.197 -1.429) 3.516 13.108 ( 0.321 3.197 1.429) 3.516 13.684 ( 2.727 0.936 -3.274) 4.363 13.684 ( -2.727 0.936 3.274) 4.363 13.849 ( -7.800 6.981 -7.262) 12.740 13.849 ( 7.800 6.981 7.262) 12.740 14.178 ( -2.509 2.069 -4.105) 5.237 14.178 ( 2.509 2.069 4.105) 5.237 14.709 ( 4.639 -12.678 -9.234) 16.356 14.709 ( -4.639 -12.678 9.234) 16.356 15.602 ( -5.767 0.532 0.302) 5.799 15.602 ( 5.767 0.532 -0.302) 5.799 16.033 ( 2.167 3.063 -2.699) 4.622 16.033 ( -2.167 3.063 2.699) 4.622 16.168 ( -1.538 1.752 -1.700) 2.886 16.168 ( 1.538 1.752 1.700) 2.886 16.501 ( -3.435 -1.630 -2.496) 4.548 16.501 ( 3.435 -1.630 2.496) 4.548 17.093 ( -1.055 -7.332 -3.025) 8.001 17.093 ( 1.055 -7.332 3.025) 8.001 19.878 ( 5.729 12.178 -33.906) 36.480 19.878 ( -5.729 12.178 33.906) 36.480 20.309 ( 11.173 -0.660 -27.990) 30.145 20.309 ( -11.173 -0.660 27.990) 30.145 20.732 ( 1.373 -5.215 -23.663) 24.270 20.732 ( -1.373 -5.215 23.663) 24.270 20.868 ( 7.752 -3.216 -22.584) 24.093 20.868 ( -7.752 -3.216 22.584) 24.093 25.358 ( 1.052 -1.576 -1.028) 2.156 25.358 ( -1.052 -1.576 1.028) 2.156 25.577 ( -0.020 1.603 -0.269) 1.625 25.577 ( 0.020 1.603 0.269) 1.625 26.418 ( 1.995 -1.392 -4.654) 5.251 26.418 ( -1.995 -1.392 4.654) 5.251 26.679 ( -2.539 1.559 -3.878) 4.891 26.679 ( 2.539 1.559 3.878) 4.891 28.540 ( -2.020 2.544 -1.790) 3.709 28.540 ( 2.020 2.544 1.790) 3.709 28.910 ( -1.328 -0.102 -0.528) 1.432 28.910 ( 1.328 -0.102 0.528) 1.432 29.713 ( 1.720 3.265 -1.303) 3.913 29.713 ( -1.720 3.265 1.303) 3.913 30.315 ( -5.965 -3.804 -9.423) 11.784 30.315 ( 5.965 -3.804 9.423) 11.784 31.268 ( -1.568 5.622 -4.885) 7.611 31.268 ( 1.568 5.622 4.885) 7.611 31.512 ( -4.267 -5.819 -1.878) 7.456 31.512 ( 4.267 -5.819 1.878) 7.456 31.967 ( -1.226 5.444 -4.227) 7.000 31.967 ( 1.226 5.444 4.227) 7.000 32.388 ( -3.432 -4.490 -8.911) 10.552 32.388 ( 3.432 -4.490 8.911) 10.552 ======================= Grid point 189 (100/104) ======================= q-point: ( 0.20 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.101 ( 0.883 -4.628 -2.738) 5.449 3.143 ( 3.472 -5.628 -1.896) 6.879 3.322 ( -0.719 1.838 -7.954) 8.195 3.619 ( 5.385 -9.780 1.363) 11.247 3.830 ( -10.630 13.270 9.157) 19.311 4.023 ( 2.931 0.665 -7.392) 7.980 4.115 ( 2.886 2.484 -14.266) 14.766 4.213 ( -1.701 1.043 11.332) 11.507 4.451 ( -0.474 10.896 -9.434) 14.420 4.570 ( 9.068 -2.712 18.566) 20.840 4.865 ( -7.971 -3.066 2.828) 8.996 5.134 ( 5.967 -14.802 10.993) 19.379 5.244 ( -11.269 5.113 -6.833) 14.136 5.599 ( -13.897 3.035 -3.832) 14.731 5.678 ( -12.059 7.548 -4.039) 14.789 5.873 ( 3.852 -7.148 2.774) 8.581 5.929 ( 1.125 2.714 -4.116) 5.057 6.034 ( 3.109 -1.835 4.268) 5.590 6.061 ( 9.091 -2.934 10.912) 14.503 6.244 ( -2.261 1.918 -10.985) 11.379 6.809 ( 6.967 3.616 -2.060) 8.116 6.910 ( 10.264 -1.692 -1.195) 10.471 6.929 ( 8.481 3.798 3.377) 9.888 6.957 ( 7.461 0.329 4.568) 8.755 7.205 ( -4.827 13.764 9.923) 17.642 7.283 ( 1.304 10.881 -3.984) 11.660 7.582 ( 3.042 -0.313 -2.893) 4.210 7.634 ( 0.600 6.927 -7.077) 9.922 7.667 ( -0.705 3.167 6.810) 7.544 7.734 ( 0.466 5.087 2.484) 5.680 7.848 ( 2.144 9.870 -5.986) 11.741 7.995 ( 4.606 2.394 -0.708) 5.239 8.120 ( 0.674 1.956 -7.567) 7.845 8.132 ( 3.579 1.990 1.013) 4.218 8.245 ( 5.338 0.092 -3.359) 6.308 8.289 ( 4.715 -2.575 2.045) 5.748 8.377 ( -1.446 2.476 3.219) 4.311 8.435 ( -0.102 -2.006 -1.843) 2.726 8.600 ( 0.260 2.070 -6.083) 6.431 8.669 ( -3.258 -2.141 11.040) 11.708 8.734 ( -2.994 -4.389 6.216) 8.178 8.803 ( 2.783 -4.446 -10.876) 12.075 8.823 ( -1.485 1.442 -1.703) 2.680 8.881 ( -2.189 -3.330 -2.631) 4.775 9.017 ( -0.304 -2.722 8.023) 8.477 9.025 ( 4.399 -4.510 -8.189) 10.332 9.299 ( 2.046 -7.629 -2.125) 8.180 9.348 ( 2.717 -8.382 -5.657) 10.471 9.715 ( -9.923 1.482 -0.113) 10.034 9.806 ( -5.402 -2.370 2.817) 6.537 10.186 ( -10.767 1.360 3.783) 11.492 10.280 ( -9.954 -1.381 -2.878) 10.454 10.391 ( -1.468 8.933 3.854) 9.839 10.498 ( 2.423 -1.278 0.716) 2.832 10.653 ( 2.957 -0.401 -4.607) 5.489 10.713 ( 0.081 -3.233 3.285) 4.610 10.728 ( -3.001 1.093 0.618) 3.253 10.902 ( -2.365 1.256 -0.030) 2.678 10.979 ( 0.596 -3.471 4.247) 5.517 11.105 ( -1.376 -3.964 0.760) 4.264 11.553 ( -3.142 -2.551 3.508) 5.356 11.728 ( 1.533 -10.282 -1.019) 10.445 11.872 ( -10.622 -1.691 -1.503) 10.861 11.937 ( -10.218 -6.488 -1.587) 12.207 12.297 ( 5.442 2.069 2.436) 6.311 12.358 ( 9.619 -1.033 5.153) 10.961 12.440 ( 12.539 4.892 -8.350) 15.839 12.654 ( 14.953 -4.043 -5.250) 16.355 13.031 ( -4.505 3.629 2.572) 6.331 13.127 ( -0.994 -0.414 0.607) 1.236 13.496 ( -13.705 0.195 4.329) 14.373 13.553 ( -11.646 -2.023 4.902) 12.796 13.771 ( 3.643 11.477 -10.114) 15.725 14.009 ( 3.540 2.184 9.424) 10.301 14.257 ( -1.680 5.214 5.525) 7.780 14.338 ( 12.868 7.952 0.488) 15.134 14.639 ( -2.246 -14.213 -5.317) 15.340 14.732 ( 3.205 -13.882 0.791) 14.269 15.377 ( -11.977 6.470 -3.316) 14.011 15.579 ( -6.643 -2.736 -1.514) 7.343 16.023 ( 0.984 6.394 6.897) 9.456 16.094 ( 0.985 0.537 6.101) 6.203 16.188 ( 3.059 1.934 -0.806) 3.708 16.261 ( 4.453 -0.982 -5.779) 7.361 16.440 ( 0.244 2.184 -2.345) 3.213 16.643 ( 8.574 -7.479 0.308) 11.381 16.985 ( -6.748 -3.265 -2.922) 8.046 17.099 ( -2.173 -9.629 0.736) 9.898 19.855 ( 5.497 11.855 -26.766) 29.785 19.932 ( -3.402 9.593 31.460) 33.066 20.157 ( -13.431 4.747 26.168) 29.794 20.364 ( 4.755 -6.401 -29.112) 30.184 20.639 ( 0.401 1.082 -19.255) 19.290 20.788 ( -7.293 -3.258 21.871) 23.284 20.795 ( -3.675 -5.366 21.588) 22.546 20.907 ( 5.797 -5.200 -24.631) 25.832 25.400 ( 4.434 0.612 5.663) 7.218 25.472 ( 8.207 -2.899 4.428) 9.766 25.653 ( 8.446 2.140 -5.428) 10.265 25.710 ( 10.098 -0.702 -6.902) 12.252 26.339 ( -4.081 0.392 -5.871) 7.161 26.402 ( -0.485 -2.717 -10.095) 10.466 26.555 ( -8.659 4.039 7.037) 11.867 26.680 ( -5.774 -2.323 8.573) 10.594 28.527 ( 1.457 3.375 -0.390) 3.697 28.622 ( 4.294 -0.536 3.227) 5.398 28.842 ( -4.410 2.070 -1.166) 5.009 28.914 ( -0.921 -1.606 -0.823) 2.026 29.620 ( -0.324 12.095 1.193) 12.158 29.955 ( 13.775 -5.748 -5.985) 16.082 30.125 ( -7.709 4.515 -6.051) 10.790 30.445 ( 0.968 -9.914 12.120) 15.688 31.213 ( -0.093 4.486 -4.068) 6.057 31.343 ( 2.403 5.924 -1.392) 6.543 31.397 ( -1.982 -3.182 -4.429) 5.803 31.603 ( 1.504 -4.595 -5.712) 7.484 31.936 ( 0.576 2.786 1.765) 3.348 31.991 ( -0.998 3.192 4.340) 5.479 32.254 ( -5.113 0.180 -2.958) 5.910 32.446 ( -2.650 -6.869 10.199) 12.578 ======================= Grid point 190 (101/104) ======================= q-point: ( 0.40 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.148 ( 4.942 -1.102 -3.817) 6.341 3.218 ( -0.780 -2.782 5.242) 5.986 3.330 ( 7.554 6.605 -10.615) 14.607 3.535 ( -12.287 3.352 4.459) 13.494 3.791 ( 3.936 9.114 4.695) 10.982 3.929 ( -6.379 10.930 -5.378) 13.751 4.229 ( 0.580 6.532 14.576) 15.984 4.280 ( 15.758 -0.117 -13.342) 20.648 4.350 ( -3.560 8.719 -11.849) 15.136 4.594 ( -16.310 -5.275 7.623) 18.761 4.963 ( 14.457 -6.267 8.803) 18.049 5.136 ( 4.434 3.147 -6.684) 8.616 5.230 ( -13.022 4.176 9.816) 16.834 5.306 ( -6.990 -10.257 7.799) 14.659 5.522 ( 6.318 -12.114 -5.543) 14.744 5.803 ( -11.430 -17.509 -5.994) 21.752 6.002 ( 4.252 2.541 -0.615) 4.991 6.069 ( -1.672 3.445 1.956) 4.300 6.148 ( 3.458 -1.259 -7.933) 8.745 6.199 ( -1.106 -0.774 5.659) 5.818 6.967 ( 5.655 8.118 1.451) 9.999 7.034 ( 1.138 8.518 -4.127) 9.533 7.124 ( 6.772 3.535 6.657) 10.133 7.192 ( 7.391 0.134 0.323) 7.399 7.238 ( 5.147 8.171 8.584) 12.921 7.281 ( 0.255 11.549 -2.978) 11.929 7.594 ( -1.479 5.048 -6.656) 8.484 7.604 ( -3.622 9.719 0.340) 10.378 7.692 ( 4.228 0.204 3.935) 5.779 7.800 ( -3.127 5.759 1.633) 6.754 7.850 ( 6.100 0.017 0.557) 6.125 7.990 ( -0.754 1.493 -14.253) 14.351 8.069 ( -0.816 4.866 -4.329) 6.564 8.098 ( -5.681 -0.221 7.470) 9.387 8.299 ( 0.033 -3.835 2.122) 4.383 8.354 ( -1.965 -2.924 -4.923) 6.054 8.481 ( 7.555 2.928 2.077) 8.364 8.528 ( 5.342 -0.170 -3.471) 6.372 8.598 ( -0.455 -0.165 6.042) 6.062 8.646 ( 1.001 -7.106 -1.540) 7.339 8.697 ( -0.476 -3.535 -1.488) 3.865 8.761 ( -5.542 -3.441 1.843) 6.779 8.794 ( 0.649 -2.058 6.256) 6.617 8.874 ( 2.207 -7.123 -11.097) 13.369 9.047 ( 4.614 1.750 2.389) 5.482 9.119 ( 4.559 -1.033 5.329) 7.089 9.321 ( -5.095 0.314 -1.434) 5.302 9.349 ( -3.544 -0.921 -11.534) 12.101 9.550 ( 5.742 -0.055 -9.198) 10.843 9.718 ( -6.575 -5.066 11.650) 14.304 9.963 ( -7.861 -0.439 4.937) 9.293 10.038 ( -9.509 -2.103 -2.278) 10.001 10.409 ( 2.408 10.768 2.347) 11.280 10.495 ( -3.333 8.499 -1.315) 9.224 10.670 ( -0.407 -1.492 3.472) 3.800 10.697 ( -1.700 -0.464 -1.044) 2.048 10.772 ( 8.023 -5.386 -3.752) 10.366 10.888 ( -1.522 -1.171 1.817) 2.644 11.001 ( -0.696 -6.831 3.655) 7.778 11.032 ( -3.940 -9.105 -0.641) 9.942 11.530 ( 0.092 -2.684 2.438) 3.627 11.607 ( -6.578 -4.868 -2.007) 8.426 11.782 ( 0.154 -8.037 -1.389) 8.158 11.811 ( -3.280 -8.058 1.430) 8.817 12.473 ( 9.320 4.992 -0.441) 10.582 12.558 ( 5.154 2.585 0.041) 5.766 12.663 ( 7.795 5.053 0.284) 9.294 12.769 ( -2.370 3.565 -4.707) 6.362 13.055 ( 6.554 -2.033 -1.918) 7.125 13.109 ( 3.101 -4.086 -0.366) 5.142 13.227 ( -12.238 -1.960 6.109) 13.818 13.320 ( -11.699 -3.097 2.877) 12.439 13.877 ( 10.226 8.806 -9.353) 16.419 14.086 ( -11.423 5.026 8.698) 15.212 14.151 ( 4.753 0.109 10.995) 11.979 14.377 ( -9.737 -3.989 -12.763) 16.541 14.722 ( 15.027 4.822 7.317) 17.396 14.972 ( 6.851 -4.074 2.412) 8.328 15.123 ( -4.389 4.801 -6.352) 9.092 15.355 ( -12.814 -4.100 -2.203) 13.633 16.102 ( 3.284 1.308 2.724) 4.463 16.134 ( 0.215 0.100 3.945) 3.952 16.225 ( 0.256 0.869 0.865) 1.252 16.256 ( -1.663 -1.297 -3.288) 3.906 16.541 ( 9.116 4.202 0.392) 10.045 16.755 ( -7.146 -1.947 -1.562) 7.569 16.871 ( 6.077 -7.469 -2.833) 10.037 17.015 ( -5.942 -10.524 1.017) 12.129 19.880 ( 8.535 9.861 -26.967) 29.955 19.969 ( -10.686 6.324 30.585) 33.010 20.068 ( -1.861 6.155 30.409) 31.082 20.235 ( -1.644 -2.555 -34.018) 34.153 20.628 ( 5.512 2.482 -15.349) 16.496 20.700 ( -7.430 0.856 15.820) 17.499 20.845 ( -2.968 -7.863 25.518) 26.867 20.892 ( 3.734 -6.866 -25.372) 26.549 25.580 ( 7.894 2.239 9.509) 12.560 25.689 ( 5.533 -2.684 4.787) 7.793 25.773 ( 4.005 1.166 -5.202) 6.668 25.845 ( 4.139 -1.877 -11.350) 12.226 26.263 ( 2.708 1.442 -10.186) 10.638 26.341 ( -2.876 -1.623 -1.152) 3.497 26.418 ( -3.177 0.934 2.239) 3.998 26.528 ( -11.016 -3.705 9.898) 15.266 28.597 ( 4.861 3.467 0.637) 6.004 28.722 ( -5.842 3.443 -1.237) 6.894 28.745 ( 5.234 -3.851 3.844) 7.550 28.860 ( -3.594 -3.408 -2.559) 5.575 29.700 ( 6.809 15.999 1.190) 17.428 29.892 ( -9.400 11.971 -3.568) 15.633 30.247 ( 13.393 -10.160 -8.221) 18.713 30.433 ( -7.460 -12.289 11.433) 18.368 31.237 ( 3.557 4.701 -1.871) 6.185 31.325 ( -3.396 6.177 -2.526) 7.488 31.410 ( 4.818 -3.770 -1.370) 6.269 31.538 ( -4.706 -3.817 -4.436) 7.509 31.944 ( 0.670 4.275 3.953) 5.861 32.006 ( -1.731 4.852 -0.618) 5.189 32.227 ( 5.246 -3.366 -2.022) 6.553 32.369 ( -7.806 -6.924 7.329) 12.751 ======================= Grid point 193 (102/104) ======================= q-point: ( 0.00 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 52 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.045 ( -0.000 0.000 0.000) 0.000 3.045 ( -0.000 0.000 0.000) 0.000 3.357 ( -0.000 0.000 0.000) 0.000 3.357 ( 0.000 0.000 0.000) 0.000 3.992 ( 0.000 0.000 0.000) 0.000 3.992 ( -0.000 0.000 0.000) 0.000 4.138 ( -0.000 0.000 0.000) 0.000 4.138 ( 0.000 0.000 0.000) 0.000 4.594 ( 0.000 0.000 0.000) 0.000 4.594 ( -0.000 0.000 0.000) 0.000 4.944 ( 0.000 0.000 0.000) 0.000 4.944 ( -0.000 0.000 0.000) 0.000 5.654 ( -0.000 -0.000 0.000) 0.000 5.654 ( 0.000 -0.000 0.000) 0.000 5.738 ( 0.000 0.000 0.000) 0.000 5.738 ( 0.000 0.000 0.000) 0.000 5.830 ( -0.000 -0.000 0.000) 0.000 5.830 ( -0.000 0.000 0.000) 0.000 6.322 ( -0.000 0.000 0.000) 0.000 6.322 ( -0.000 0.000 0.000) 0.000 6.771 ( -0.000 0.000 0.000) 0.000 6.771 ( 0.000 0.000 0.000) 0.000 6.815 ( 0.000 -0.000 0.000) 0.000 6.815 ( 0.000 0.000 0.000) 0.000 7.390 ( -0.000 0.000 0.000) 0.000 7.390 ( -0.000 0.000 0.000) 0.000 7.564 ( -0.000 -0.000 0.000) 0.000 7.564 ( -0.000 0.000 0.000) 0.000 7.880 ( -0.000 0.000 0.000) 0.000 7.880 ( 0.000 0.000 0.000) 0.000 7.908 ( -0.000 0.000 0.000) 0.000 7.908 ( -0.000 0.000 0.000) 0.000 8.081 ( -0.000 0.000 0.000) 0.000 8.081 ( -0.000 0.000 0.000) 0.000 8.206 ( 0.000 0.000 0.000) 0.000 8.206 ( 0.000 0.000 0.000) 0.000 8.433 ( 0.000 0.000 0.000) 0.000 8.433 ( -0.000 0.000 0.000) 0.000 8.663 ( -0.000 0.000 0.000) 0.000 8.663 ( -0.000 0.000 0.000) 0.000 8.699 ( 0.000 0.000 -0.000) 0.000 8.699 ( -0.000 0.000 -0.000) 0.000 8.908 ( 0.000 -0.000 -0.000) 0.000 8.908 ( -0.000 0.000 -0.000) 0.000 8.915 ( -0.000 -0.000 0.000) 0.000 8.915 ( 0.000 0.000 0.000) 0.000 9.210 ( 0.000 -0.000 0.000) 0.000 9.210 ( 0.000 0.000 0.000) 0.000 9.852 ( -0.000 0.000 0.000) 0.000 9.852 ( 0.000 0.000 0.000) 0.000 10.309 ( 0.000 0.000 0.000) 0.000 10.309 ( 0.000 0.000 0.000) 0.000 10.524 ( -0.000 0.000 0.000) 0.000 10.524 ( 0.000 0.000 0.000) 0.000 10.637 ( 0.000 -0.000 0.000) 0.000 10.637 ( 0.000 0.000 0.000) 0.000 10.802 ( -0.000 0.000 0.000) 0.000 10.802 ( 0.000 0.000 0.000) 0.000 11.080 ( -0.000 -0.000 0.000) 0.000 11.080 ( -0.000 0.000 0.000) 0.000 11.568 ( 0.000 -0.000 0.000) 0.000 11.568 ( -0.000 0.000 0.000) 0.000 12.114 ( -0.000 -0.000 0.000) 0.000 12.114 ( -0.000 0.000 0.000) 0.000 12.198 ( 0.000 0.000 0.000) 0.000 12.198 ( 0.000 0.000 0.000) 0.000 12.316 ( 0.000 0.000 0.000) 0.000 12.316 ( -0.000 0.000 0.000) 0.000 13.141 ( -0.000 -0.000 0.000) 0.000 13.141 ( -0.000 0.000 0.000) 0.000 13.673 ( 0.000 -0.000 0.000) 0.000 13.673 ( 0.000 0.000 0.000) 0.000 13.950 ( -0.000 -0.000 0.000) 0.000 13.950 ( -0.000 0.000 0.000) 0.000 14.189 ( -0.000 -0.000 0.000) 0.000 14.189 ( -0.000 0.000 0.000) 0.000 14.585 ( -0.000 -0.000 0.000) 0.000 14.585 ( 0.000 0.000 0.000) 0.000 15.606 ( 0.000 0.000 0.000) 0.000 15.606 ( 0.000 0.000 0.000) 0.000 16.060 ( -0.000 0.000 0.000) 0.000 16.060 ( 0.000 0.000 0.000) 0.000 16.180 ( -0.000 0.000 0.000) 0.000 16.180 ( 0.000 0.000 0.000) 0.000 16.483 ( -0.000 0.000 0.000) 0.000 16.483 ( -0.000 0.000 0.000) 0.000 17.024 ( 0.000 0.000 0.000) 0.000 17.024 ( -0.000 0.000 0.000) 0.000 20.027 ( -0.000 -0.000 0.000) 0.000 20.027 ( -0.000 0.000 0.000) 0.000 20.277 ( 0.000 0.000 -0.000) 0.000 20.277 ( 0.000 0.000 -0.000) 0.000 20.681 ( -0.000 0.000 0.000) 0.000 20.681 ( -0.000 -0.000 0.000) 0.000 20.832 ( 0.000 0.000 -0.000) 0.000 20.832 ( 0.000 0.000 -0.000) 0.000 25.343 ( -0.000 0.000 0.000) 0.000 25.343 ( 0.000 0.000 0.000) 0.000 25.593 ( -0.000 0.000 0.000) 0.000 25.593 ( -0.000 0.000 0.000) 0.000 26.405 ( -0.000 0.000 0.000) 0.000 26.405 ( 0.000 0.000 0.000) 0.000 26.694 ( -0.000 0.000 0.000) 0.000 26.694 ( 0.000 0.000 0.000) 0.000 28.568 ( -0.000 0.000 0.000) 0.000 28.568 ( 0.000 0.000 0.000) 0.000 28.907 ( -0.000 0.000 0.000) 0.000 28.907 ( 0.000 0.000 0.000) 0.000 29.750 ( -0.000 -0.000 0.000) 0.000 29.750 ( -0.000 0.000 0.000) 0.000 30.273 ( 0.000 0.000 0.000) 0.000 30.273 ( 0.000 0.000 0.000) 0.000 31.366 ( 0.000 -0.000 0.000) 0.000 31.366 ( 0.000 0.000 0.000) 0.000 31.412 ( -0.000 -0.000 0.000) 0.000 31.412 ( -0.000 0.000 0.000) 0.000 32.031 ( -0.000 0.000 0.000) 0.000 32.031 ( -0.000 0.000 0.000) 0.000 32.334 ( 0.000 0.000 0.000) 0.000 32.334 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 197 (103/104) ======================= q-point: ( 0.20 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.069 ( 2.968 -1.729 -0.737) 3.513 3.069 ( 2.968 1.729 -0.737) 3.513 3.424 ( 4.903 -9.021 -2.780) 10.636 3.424 ( 4.903 9.021 -2.780) 10.636 4.002 ( -0.363 -4.657 2.973) 5.537 4.002 ( -0.363 4.657 2.973) 5.537 4.193 ( 4.179 -3.826 -1.048) 5.762 4.193 ( 4.179 3.826 -1.048) 5.762 4.558 ( -1.724 -0.896 4.049) 4.491 4.558 ( -1.724 0.896 4.049) 4.491 4.904 ( -3.781 -8.532 4.751) 10.472 4.904 ( -3.781 8.532 4.751) 10.472 5.423 ( -7.777 -13.379 -11.051) 19.016 5.423 ( -7.777 13.379 -11.051) 19.016 5.786 ( -6.610 -2.555 8.510) 11.074 5.786 ( -6.610 2.555 8.510) 11.074 5.999 ( 6.786 -2.400 4.465) 8.470 5.999 ( 6.786 2.400 4.465) 8.470 6.144 ( -5.136 -10.581 -10.535) 15.790 6.144 ( -5.136 10.581 -10.535) 15.790 6.869 ( 9.300 -2.749 -1.508) 9.814 6.869 ( 9.300 2.749 -1.508) 9.814 6.977 ( 9.081 -0.768 7.603) 11.868 6.977 ( 9.081 0.768 7.603) 11.868 7.399 ( 1.395 -3.917 -1.627) 4.465 7.399 ( 1.395 3.917 -1.627) 4.465 7.583 ( 0.793 -4.634 1.129) 4.835 7.583 ( 0.793 4.634 1.129) 4.835 7.799 ( -2.216 -1.430 2.155) 3.406 7.799 ( -2.216 1.430 2.155) 3.406 7.969 ( 2.252 -4.507 -8.095) 9.535 7.969 ( 2.252 4.507 -8.095) 9.535 8.145 ( 0.087 -3.228 0.717) 3.308 8.145 ( 0.087 3.228 0.717) 3.308 8.245 ( 5.308 -1.483 4.145) 6.896 8.245 ( 5.308 1.483 4.145) 6.896 8.433 ( 0.607 -1.223 0.469) 1.444 8.433 ( 0.607 1.223 0.469) 1.444 8.642 ( -1.186 -1.239 -1.919) 2.574 8.642 ( -1.186 1.239 -1.919) 2.574 8.700 ( -0.080 -3.895 -3.170) 5.023 8.700 ( -0.080 3.895 -3.170) 5.023 8.840 ( -2.703 -0.604 -4.852) 5.586 8.840 ( -2.703 0.604 -4.852) 5.586 8.977 ( 3.017 -0.462 2.659) 4.048 8.977 ( 3.017 0.462 2.659) 4.048 9.237 ( 4.455 -2.083 -2.684) 5.603 9.237 ( 4.455 2.083 -2.684) 5.603 9.759 ( -8.062 -2.676 0.549) 8.513 9.759 ( -8.062 2.676 0.549) 8.513 10.221 ( -9.192 -3.118 1.215) 9.782 10.221 ( -9.192 3.118 1.215) 9.782 10.545 ( 1.203 -3.606 2.138) 4.362 10.545 ( 1.203 3.606 2.138) 4.362 10.593 ( -0.370 -3.545 -1.622) 3.916 10.593 ( -0.370 3.545 -1.622) 3.916 10.851 ( 1.968 -6.287 1.637) 6.789 10.851 ( 1.968 6.287 1.637) 6.789 11.002 ( -6.576 -5.483 2.146) 8.827 11.002 ( -6.576 5.483 2.146) 8.827 11.576 ( -0.478 -5.124 0.810) 5.209 11.576 ( -0.478 5.124 0.810) 5.209 11.865 ( -11.098 -1.360 -1.580) 11.293 11.865 ( -11.098 1.360 -1.580) 11.293 12.332 ( 7.840 -1.631 3.141) 8.601 12.332 ( 7.840 1.631 3.141) 8.601 12.551 ( 15.561 -6.339 -6.936) 18.178 12.551 ( 15.561 6.339 -6.936) 18.178 13.095 ( -4.499 -2.858 2.671) 5.962 13.095 ( -4.499 2.858 2.671) 5.962 13.514 ( -12.043 -1.784 2.770) 12.485 13.514 ( -12.043 1.784 2.770) 12.485 13.965 ( 2.537 -7.460 -0.505) 7.895 13.965 ( 2.537 7.460 -0.505) 7.895 14.379 ( 3.922 -7.331 3.374) 8.973 14.379 ( 3.922 7.331 3.374) 8.973 14.526 ( 3.649 -7.307 -0.072) 8.168 14.526 ( 3.649 7.307 -0.072) 8.168 15.499 ( -8.411 -5.815 -2.671) 10.569 15.499 ( -8.411 5.815 -2.671) 10.569 16.093 ( 0.384 -1.400 7.419) 7.560 16.093 ( 0.384 1.400 7.419) 7.560 16.226 ( 3.474 -2.139 -2.978) 5.051 16.226 ( 3.474 2.139 -2.978) 5.051 16.509 ( 3.681 -5.671 -1.482) 6.922 16.509 ( 3.681 5.671 -1.482) 6.922 16.980 ( -3.568 -2.924 -2.316) 5.162 16.980 ( -3.568 2.924 -2.316) 5.162 20.018 ( -1.256 -3.026 3.082) 4.498 20.018 ( -1.256 3.026 3.082) 4.498 20.240 ( -2.593 -5.592 -2.986) 6.849 20.240 ( -2.593 5.592 -2.986) 6.849 20.677 ( -2.077 -3.759 10.582) 11.420 20.677 ( -2.077 3.759 10.582) 11.420 20.817 ( 0.689 -3.734 -10.301) 10.978 20.817 ( 0.689 3.734 -10.301) 10.979 25.425 ( 6.556 -2.003 4.973) 8.469 25.425 ( 6.556 2.003 4.973) 8.469 25.688 ( 8.722 -1.591 -6.047) 10.732 25.688 ( 8.722 1.591 -6.047) 10.732 26.359 ( -2.392 -1.768 -6.624) 7.261 26.359 ( -2.392 1.768 -6.624) 7.261 26.626 ( -7.502 -3.427 6.345) 10.406 26.626 ( -7.502 3.427 6.345) 10.406 28.589 ( 1.930 -2.909 1.411) 3.765 28.589 ( 1.930 2.909 1.411) 3.765 28.881 ( -2.343 -1.983 -1.462) 3.400 28.881 ( -2.343 1.983 -1.462) 3.400 29.821 ( 6.870 -8.952 -3.245) 11.742 29.821 ( 6.870 8.952 -3.245) 11.742 30.257 ( -2.826 -9.421 4.879) 10.979 30.257 ( -2.826 9.421 4.879) 10.979 31.303 ( -1.010 -4.938 -3.388) 6.073 31.303 ( -1.010 4.938 -3.388) 6.073 31.487 ( 3.117 -7.305 -4.760) 9.260 31.487 ( 3.117 7.305 -4.760) 9.260 31.995 ( -1.905 -2.551 1.828) 3.671 31.995 ( -1.905 2.551 1.828) 3.671 32.316 ( -3.169 -6.210 4.887) 8.514 32.316 ( -3.169 6.210 4.887) 8.514 ======================= Grid point 199 (104/104) ======================= q-point: ( 0.40 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.159 ( 4.241 -2.629 0.200) 4.994 3.159 ( 4.241 2.629 0.200) 4.994 3.458 ( -0.660 -7.331 -2.730) 7.851 3.458 ( -0.660 7.331 -2.730) 7.851 4.037 ( 2.932 -13.548 4.651) 14.621 4.037 ( 2.932 13.548 4.651) 14.621 4.187 ( -3.534 -13.261 -5.261) 14.698 4.187 ( -3.534 13.261 -5.261) 14.698 4.638 ( 5.103 -12.230 1.909) 13.389 4.638 ( 5.103 12.230 1.909) 13.389 4.896 ( -0.522 -16.787 13.147) 21.329 4.896 ( -0.522 16.787 13.147) 21.329 5.281 ( 1.707 -9.460 -15.111) 17.909 5.281 ( 1.707 9.460 -15.111) 17.909 5.511 ( -16.154 -12.090 3.153) 20.422 5.511 ( -16.154 12.090 3.153) 20.422 6.071 ( 4.266 -4.526 -1.252) 6.344 6.071 ( 4.266 4.526 -1.252) 6.344 6.152 ( -0.351 -3.882 1.182) 4.073 6.152 ( -0.351 3.882 1.182) 4.073 7.077 ( 7.218 -3.313 -0.441) 7.954 7.077 ( 7.218 3.313 -0.441) 7.954 7.173 ( 5.516 -2.787 4.440) 7.609 7.173 ( 5.516 2.787 4.440) 7.609 7.430 ( 1.138 -3.300 0.123) 3.493 7.430 ( 1.138 3.300 0.123) 3.493 7.583 ( -0.768 -3.157 -0.602) 3.305 7.583 ( -0.768 3.157 -0.602) 3.305 7.825 ( 3.407 -4.899 3.640) 6.990 7.825 ( 3.407 4.899 3.640) 6.990 7.937 ( -2.036 -7.245 -8.315) 11.215 7.937 ( -2.036 7.245 -8.315) 11.215 8.121 ( -1.339 -1.809 2.460) 3.334 8.121 ( -1.339 1.809 2.460) 3.334 8.270 ( -3.102 -3.755 0.895) 4.953 8.270 ( -3.102 3.755 0.895) 4.953 8.527 ( 6.449 -2.755 -4.932) 8.574 8.527 ( 6.449 2.755 -4.932) 8.574 8.596 ( -2.741 -3.193 1.895) 4.615 8.596 ( -2.741 3.193 1.895) 4.615 8.662 ( -2.211 -2.640 2.881) 4.490 8.662 ( -2.211 2.640 2.881) 4.490 8.795 ( 0.567 -1.952 -5.632) 5.987 8.795 ( 0.567 1.952 -5.632) 5.987 9.083 ( 6.060 -2.216 4.024) 7.604 9.083 ( 6.060 2.216 4.024) 7.604 9.325 ( 0.051 -0.992 -7.176) 7.244 9.325 ( 0.051 0.992 -7.176) 7.244 9.616 ( -0.591 -5.610 1.431) 5.819 9.616 ( -0.591 5.610 1.431) 5.819 9.980 ( -11.323 -2.830 2.851) 12.015 9.980 ( -11.323 2.830 2.851) 12.015 10.571 ( 0.769 -3.137 -0.026) 3.230 10.571 ( 0.769 3.137 -0.026) 3.230 10.654 ( 5.359 -4.493 0.346) 7.002 10.654 ( 5.359 4.493 0.346) 7.002 10.821 ( -6.890 -10.002 2.716) 12.446 10.821 ( -6.890 10.002 2.716) 12.446 10.909 ( -0.381 -2.433 -0.777) 2.583 10.909 ( -0.381 2.433 -0.777) 2.583 11.538 ( -2.138 -2.795 0.056) 3.519 11.538 ( -2.138 2.795 0.056) 3.519 11.716 ( -2.787 -1.421 -0.127) 3.131 11.716 ( -2.787 1.421 -0.127) 3.131 12.545 ( 9.507 -2.840 0.671) 9.944 12.545 ( 9.507 2.840 0.671) 9.944 12.759 ( 2.604 -4.166 -4.264) 6.505 12.759 ( 2.604 4.166 -4.264) 6.505 13.050 ( 3.636 -1.871 1.667) 4.416 13.050 ( 3.636 1.871 1.667) 4.416 13.258 ( -12.615 -3.497 2.683) 13.363 13.258 ( -12.615 3.497 2.683) 13.363 14.053 ( 5.931 -8.701 -0.295) 10.534 14.053 ( 5.931 8.701 -0.295) 10.534 14.223 ( -9.439 -8.856 -0.595) 12.957 14.223 ( -9.439 8.856 -0.595) 12.957 14.857 ( 15.867 -7.452 6.560) 18.717 14.857 ( 15.867 7.452 6.560) 18.717 15.252 ( -12.317 -6.982 -5.440) 15.168 15.252 ( -12.317 6.982 -5.440) 15.168 16.136 ( 1.107 -1.036 3.655) 3.957 16.136 ( 1.107 1.036 3.655) 3.957 16.238 ( -0.847 -0.859 -1.586) 1.993 16.238 ( -0.847 0.859 -1.586) 1.993 16.638 ( 6.911 -7.101 0.881) 9.948 16.638 ( 6.911 7.101 0.881) 9.948 16.863 ( -5.528 -4.999 -2.746) 7.943 16.863 ( -5.528 4.999 -2.746) 7.943 20.014 ( -0.532 -2.887 3.552) 4.608 20.014 ( -0.532 2.887 3.552) 4.608 20.165 ( -2.004 -4.499 -3.563) 6.079 20.165 ( -2.004 4.499 -3.563) 6.079 20.702 ( -0.707 -5.339 12.310) 13.437 20.702 ( -0.707 5.339 12.310) 13.437 20.770 ( 0.084 -5.127 -12.121) 13.161 20.770 ( 0.084 5.127 -12.121) 13.161 25.631 ( 7.838 -3.157 8.562) 12.029 25.631 ( 7.838 3.157 8.562) 12.029 25.807 ( 3.056 -2.123 -9.557) 10.256 25.807 ( 3.056 2.123 -9.557) 10.256 26.298 ( 1.790 -2.313 -8.248) 8.751 26.298 ( 1.790 2.313 -8.248) 8.751 26.462 ( -9.452 -3.231 8.464) 13.093 26.462 ( -9.452 3.231 8.464) 13.093 28.669 ( 4.618 -4.112 2.350) 6.615 28.669 ( 4.618 4.112 2.350) 6.615 28.792 ( -4.861 -3.848 -2.402) 6.649 28.792 ( -4.861 3.848 -2.402) 6.649 29.976 ( 7.760 -11.663 -4.409) 14.686 29.976 ( 7.760 11.663 -4.409) 14.686 30.188 ( -5.381 -11.965 5.535) 14.239 30.188 ( -5.381 11.965 5.535) 14.239 31.327 ( 4.267 -4.803 -1.245) 6.545 31.327 ( 4.267 4.803 -1.245) 6.545 31.443 ( -4.510 -6.031 -4.290) 8.666 31.443 ( -4.510 6.031 -4.290) 8.666 32.026 ( 3.244 -3.375 1.404) 4.887 32.026 ( 3.244 3.375 1.404) 4.887 32.241 ( -4.683 -5.614 3.159) 7.964 32.241 ( -4.683 5.614 3.159) 7.964 =================== 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 3/36000 10.0 1434.215 3139.250 2444.873 0.000 728.014 0.000 3/36000 20.0 355.747 542.555 392.414 0.000 43.999 0.000 3/36000 30.0 122.434 175.165 167.864 0.000 5.762 0.000 3/36000 40.0 59.785 84.223 96.107 0.000 -0.290 0.000 3/36000 50.0 35.485 49.052 62.634 0.000 -1.443 0.000 3/36000 60.0 23.723 32.158 44.477 0.000 -1.583 0.000 3/36000 70.0 17.183 22.888 33.621 0.000 -1.493 0.000 3/36000 80.0 13.187 17.305 26.637 0.000 -1.361 0.000 3/36000 90.0 10.569 13.696 21.875 0.000 -1.232 0.000 3/36000 100.0 8.759 11.230 18.475 0.000 -1.119 0.000 3/36000 110.0 7.453 9.469 15.954 0.000 -1.022 0.000 3/36000 120.0 6.476 8.163 14.027 0.000 -0.940 0.000 3/36000 130.0 5.723 7.165 12.516 0.000 -0.870 0.000 3/36000 140.0 5.130 6.382 11.305 0.000 -0.810 0.000 3/36000 150.0 4.651 5.754 10.318 0.000 -0.759 0.000 3/36000 160.0 4.259 5.240 9.501 0.000 -0.715 0.000 3/36000 170.0 3.932 4.813 8.815 0.000 -0.678 0.000 3/36000 180.0 3.656 4.453 8.232 0.000 -0.645 0.000 3/36000 190.0 3.419 4.146 7.731 0.000 -0.616 0.000 3/36000 200.0 3.216 3.881 7.297 0.000 -0.590 0.000 3/36000 210.0 3.038 3.649 6.917 0.000 -0.568 0.000 3/36000 220.0 2.881 3.446 6.582 0.000 -0.548 0.000 3/36000 230.0 2.743 3.266 6.285 0.000 -0.529 0.000 3/36000 240.0 2.619 3.105 6.018 0.000 -0.513 0.000 3/36000 250.0 2.508 2.961 5.778 0.000 -0.498 0.000 3/36000 260.0 2.408 2.830 5.561 0.000 -0.484 0.000 3/36000 270.0 2.317 2.712 5.363 0.000 -0.471 0.000 3/36000 280.0 2.234 2.604 5.181 0.000 -0.459 0.000 3/36000 290.0 2.158 2.505 5.015 0.000 -0.448 0.000 3/36000 300.0 2.088 2.414 4.860 0.000 -0.438 0.000 3/36000 310.0 2.023 2.329 4.717 0.000 -0.428 0.000 3/36000 320.0 1.963 2.252 4.584 0.000 -0.419 0.000 3/36000 330.0 1.907 2.179 4.459 0.000 -0.410 0.000 3/36000 340.0 1.855 2.112 4.343 0.000 -0.402 0.000 3/36000 350.0 1.806 2.048 4.233 0.000 -0.394 0.000 3/36000 360.0 1.760 1.989 4.129 0.000 -0.387 0.000 3/36000 370.0 1.716 1.934 4.032 0.000 -0.379 0.000 3/36000 380.0 1.675 1.881 3.939 0.000 -0.373 0.000 3/36000 390.0 1.637 1.832 3.851 0.000 -0.366 0.000 3/36000 400.0 1.600 1.785 3.767 0.000 -0.359 0.000 3/36000 410.0 1.565 1.741 3.688 0.000 -0.353 0.000 3/36000 420.0 1.531 1.699 3.611 0.000 -0.347 0.000 3/36000 430.0 1.500 1.660 3.539 0.000 -0.342 0.000 3/36000 440.0 1.469 1.622 3.469 0.000 -0.336 0.000 3/36000 450.0 1.440 1.586 3.402 0.000 -0.331 0.000 3/36000 460.0 1.412 1.551 3.338 0.000 -0.325 0.000 3/36000 470.0 1.386 1.518 3.276 0.000 -0.320 0.000 3/36000 480.0 1.360 1.487 3.217 0.000 -0.315 0.000 3/36000 490.0 1.335 1.457 3.160 0.000 -0.311 0.000 3/36000 500.0 1.312 1.428 3.105 0.000 -0.306 0.000 3/36000 510.0 1.289 1.400 3.052 0.000 -0.301 0.000 3/36000 520.0 1.267 1.374 3.001 0.000 -0.297 0.000 3/36000 530.0 1.246 1.348 2.951 0.000 -0.293 0.000 3/36000 540.0 1.225 1.323 2.903 0.000 -0.289 0.000 3/36000 550.0 1.205 1.300 2.857 0.000 -0.285 0.000 3/36000 560.0 1.186 1.277 2.812 0.000 -0.281 0.000 3/36000 570.0 1.168 1.255 2.769 0.000 -0.277 0.000 3/36000 580.0 1.150 1.234 2.727 0.000 -0.273 0.000 3/36000 590.0 1.132 1.213 2.686 0.000 -0.269 0.000 3/36000 600.0 1.115 1.193 2.646 0.000 -0.266 0.000 3/36000 610.0 1.099 1.174 2.608 0.000 -0.262 0.000 3/36000 620.0 1.083 1.155 2.570 0.000 -0.259 0.000 3/36000 630.0 1.067 1.137 2.534 0.000 -0.256 0.000 3/36000 640.0 1.052 1.120 2.499 0.000 -0.252 0.000 3/36000 650.0 1.038 1.103 2.464 0.000 -0.249 0.000 3/36000 660.0 1.024 1.087 2.431 0.000 -0.246 0.000 3/36000 670.0 1.010 1.071 2.398 0.000 -0.243 0.000 3/36000 680.0 0.996 1.055 2.366 0.000 -0.240 0.000 3/36000 690.0 0.983 1.040 2.335 0.000 -0.237 0.000 3/36000 700.0 0.970 1.026 2.305 0.000 -0.234 0.000 3/36000 710.0 0.958 1.012 2.276 0.000 -0.232 0.000 3/36000 720.0 0.946 0.998 2.247 0.000 -0.229 0.000 3/36000 730.0 0.934 0.985 2.219 0.000 -0.226 0.000 3/36000 740.0 0.922 0.971 2.192 0.000 -0.224 0.000 3/36000 750.0 0.911 0.959 2.165 0.000 -0.221 0.000 3/36000 760.0 0.900 0.946 2.139 0.000 -0.219 0.000 3/36000 770.0 0.889 0.934 2.114 0.000 -0.216 0.000 3/36000 780.0 0.879 0.923 2.089 0.000 -0.214 0.000 3/36000 790.0 0.869 0.911 2.065 0.000 -0.211 0.000 3/36000 800.0 0.859 0.900 2.041 0.000 -0.209 0.000 3/36000 810.0 0.849 0.889 2.018 0.000 -0.207 0.000 3/36000 820.0 0.839 0.879 1.995 0.000 -0.205 0.000 3/36000 830.0 0.830 0.868 1.973 0.000 -0.203 0.000 3/36000 840.0 0.821 0.858 1.952 0.000 -0.201 0.000 3/36000 850.0 0.812 0.848 1.930 0.000 -0.198 0.000 3/36000 860.0 0.803 0.838 1.910 0.000 -0.196 0.000 3/36000 870.0 0.794 0.829 1.889 0.000 -0.194 0.000 3/36000 880.0 0.786 0.820 1.869 0.000 -0.192 0.000 3/36000 890.0 0.778 0.811 1.850 0.000 -0.191 0.000 3/36000 900.0 0.770 0.802 1.831 0.000 -0.189 0.000 3/36000 910.0 0.762 0.793 1.812 0.000 -0.187 0.000 3/36000 920.0 0.754 0.785 1.794 0.000 -0.185 0.000 3/36000 930.0 0.747 0.776 1.775 0.000 -0.183 0.000 3/36000 940.0 0.739 0.768 1.758 0.000 -0.182 0.000 3/36000 950.0 0.732 0.760 1.741 0.000 -0.180 0.000 3/36000 960.0 0.725 0.753 1.724 0.000 -0.178 0.000 3/36000 970.0 0.718 0.745 1.707 0.000 -0.176 0.000 3/36000 980.0 0.711 0.737 1.691 0.000 -0.175 0.000 3/36000 990.0 0.704 0.730 1.674 0.000 -0.173 0.000 3/36000 1000.0 0.697 0.723 1.659 0.000 -0.172 0.000 3/36000 Thermal conductivity related properties were written into "kappa-m5610.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 21:43:30]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|