----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 22:39:34]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [3 1 2] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 24 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.710223510002970 0.000000000000000 0.000000000000000 b 0.000000000000000 10.813810429999998 0.000000000000000 c -0.580180170467019 0.000000000000000 5.537881321597433 Atomic positions (fractional): *1 O 0.79614847511964 0.05123795505048 0.13231014631406 15.999 2 O 0.20385152488035 0.55123795505048 0.36768985368594 15.999 3 O 0.20385152488035 0.94876204494952 0.86768985368594 15.999 4 O 0.79614847511964 0.44876204494952 0.63231014631406 15.999 *5 O 0.87670005581066 0.31596955914071 0.04084426355392 15.999 6 O 0.12329994418934 0.81596955914071 0.45915573644608 15.999 7 O 0.12329994418934 0.68403044085929 0.95915573644608 15.999 8 O 0.87670005581066 0.18403044085929 0.54084426355392 15.999 *9 O 0.50000000000000 0.00000000000000 0.50000000000000 15.999 10 O 0.50000000000000 0.50000000000000 0.00000000000000 15.999 *11 O 0.37943906533187 0.29695277280914 0.74546105713671 15.999 12 O 0.62056093466813 0.79695277280914 0.75453894286329 15.999 13 O 0.62056093466813 0.70304722719086 0.25453894286329 15.999 14 O 0.37943906533187 0.20304722719086 0.24546105713671 15.999 *15 Si 0.63975629140086 0.11288240067318 0.35500878785284 28.085 16 Si 0.36024370859914 0.61288240067318 0.14499121214716 28.085 17 Si 0.36024370859914 0.88711759932682 0.64499121214716 28.085 18 Si 0.63975629140086 0.38711759932682 0.85500878785284 28.085 *19 Y 0.11086447402643 0.34950950363156 0.40594697486038 88.906 20 Y 0.88913552597357 0.84950950363156 0.09405302513962 88.906 21 Y 0.88913552597357 0.65049049636844 0.59405302513962 88.906 22 Y 0.11086447402643 0.15049049636844 0.90594697486038 88.906 -------------------------------- unit cell --------------------------------- Lattice vectors: a 4.710223510002970 0.000000000000000 0.000000000000000 b 0.000000000000000 10.813810429999998 0.000000000000000 c -0.580180170467019 0.000000000000000 5.537881321597433 Atomic positions (fractional): *1 O 0.79614847511965 0.05123795505048 0.13231014631406 15.999 > 1 2 O 0.20385152488035 0.55123795505048 0.36768985368594 15.999 > 2 3 O 0.20385152488035 0.94876204494952 0.86768985368594 15.999 > 3 4 O 0.79614847511965 0.44876204494952 0.63231014631406 15.999 > 4 *5 O 0.87670005581066 0.31596955914071 0.04084426355392 15.999 > 5 6 O 0.12329994418934 0.81596955914071 0.45915573644608 15.999 > 6 7 O 0.12329994418934 0.68403044085929 0.95915573644608 15.999 > 7 8 O 0.87670005581066 0.18403044085929 0.54084426355392 15.999 > 8 *9 O 0.50000000000000 0.00000000000000 0.50000000000000 15.999 > 9 10 O 0.50000000000000 0.50000000000000 0.00000000000000 15.999 > 10 *11 O 0.37943906533187 0.29695277280914 0.74546105713671 15.999 > 11 12 O 0.62056093466813 0.79695277280914 0.75453894286329 15.999 > 12 13 O 0.62056093466813 0.70304722719086 0.25453894286329 15.999 > 13 14 O 0.37943906533187 0.20304722719086 0.24546105713671 15.999 > 14 *15 Si 0.63975629140086 0.11288240067318 0.35500878785284 28.085 > 15 16 Si 0.36024370859914 0.61288240067318 0.14499121214716 28.085 > 16 17 Si 0.36024370859914 0.88711759932682 0.64499121214716 28.085 > 17 18 Si 0.63975629140086 0.38711759932682 0.85500878785284 28.085 > 18 *19 Y 0.11086447402643 0.34950950363156 0.40594697486038 88.906 > 19 20 Y 0.88913552597357 0.84950950363156 0.09405302513962 88.906 > 20 21 Y 0.88913552597357 0.65049049636844 0.59405302513962 88.906 > 21 22 Y 0.11086447402643 0.15049049636844 0.90594697486038 88.906 > 22 -------------------------------- super cell -------------------------------- Lattice vectors: a 14.130670530008910 0.000000000000000 0.000000000000000 b 0.000000000000000 10.813810429999998 0.000000000000000 c -1.160360340934038 0.000000000000000 11.075762643194865 Atomic positions (fractional): *1 O 0.26538282503988 0.05123795505048 0.06615507315703 15.999 > 1 2 O 0.59871615837322 0.05123795505048 0.06615507315703 15.999 > 1 3 O 0.93204949170655 0.05123795505048 0.06615507315703 15.999 > 1 4 O 0.26538282503988 0.05123795505048 0.56615507315703 15.999 > 1 5 O 0.59871615837322 0.05123795505048 0.56615507315703 15.999 > 1 6 O 0.93204949170655 0.05123795505048 0.56615507315703 15.999 > 1 7 O 0.06795050829345 0.55123795505048 0.18384492684297 15.999 > 2 8 O 0.40128384162678 0.55123795505048 0.18384492684297 15.999 > 2 9 O 0.73461717496012 0.55123795505048 0.18384492684297 15.999 > 2 10 O 0.06795050829345 0.55123795505048 0.68384492684297 15.999 > 2 11 O 0.40128384162678 0.55123795505048 0.68384492684297 15.999 > 2 12 O 0.73461717496012 0.55123795505048 0.68384492684297 15.999 > 2 13 O 0.06795050829345 0.94876204494952 0.43384492684297 15.999 > 3 14 O 0.40128384162678 0.94876204494952 0.43384492684297 15.999 > 3 15 O 0.73461717496012 0.94876204494952 0.43384492684297 15.999 > 3 16 O 0.06795050829345 0.94876204494952 0.93384492684297 15.999 > 3 17 O 0.40128384162678 0.94876204494952 0.93384492684297 15.999 > 3 18 O 0.73461717496012 0.94876204494952 0.93384492684297 15.999 > 3 19 O 0.26538282503988 0.44876204494952 0.31615507315703 15.999 > 4 20 O 0.59871615837322 0.44876204494952 0.31615507315703 15.999 > 4 21 O 0.93204949170655 0.44876204494952 0.31615507315703 15.999 > 4 22 O 0.26538282503988 0.44876204494952 0.81615507315703 15.999 > 4 23 O 0.59871615837322 0.44876204494952 0.81615507315703 15.999 > 4 24 O 0.93204949170655 0.44876204494952 0.81615507315703 15.999 > 4 *25 O 0.29223335193689 0.31596955914071 0.02042213177696 15.999 > 5 26 O 0.62556668527022 0.31596955914071 0.02042213177696 15.999 > 5 27 O 0.95890001860355 0.31596955914071 0.02042213177696 15.999 > 5 28 O 0.29223335193689 0.31596955914071 0.52042213177696 15.999 > 5 29 O 0.62556668527022 0.31596955914071 0.52042213177696 15.999 > 5 30 O 0.95890001860355 0.31596955914071 0.52042213177696 15.999 > 5 31 O 0.04109998139645 0.81596955914071 0.22957786822304 15.999 > 6 32 O 0.37443331472978 0.81596955914071 0.22957786822304 15.999 > 6 33 O 0.70776664806311 0.81596955914071 0.22957786822304 15.999 > 6 34 O 0.04109998139645 0.81596955914071 0.72957786822304 15.999 > 6 35 O 0.37443331472978 0.81596955914071 0.72957786822304 15.999 > 6 36 O 0.70776664806311 0.81596955914071 0.72957786822304 15.999 > 6 37 O 0.04109998139645 0.68403044085929 0.47957786822304 15.999 > 7 38 O 0.37443331472978 0.68403044085929 0.47957786822304 15.999 > 7 39 O 0.70776664806311 0.68403044085929 0.47957786822304 15.999 > 7 40 O 0.04109998139645 0.68403044085929 0.97957786822304 15.999 > 7 41 O 0.37443331472978 0.68403044085929 0.97957786822304 15.999 > 7 42 O 0.70776664806311 0.68403044085929 0.97957786822304 15.999 > 7 43 O 0.29223335193689 0.18403044085929 0.27042213177696 15.999 > 8 44 O 0.62556668527022 0.18403044085929 0.27042213177696 15.999 > 8 45 O 0.95890001860355 0.18403044085929 0.27042213177696 15.999 > 8 46 O 0.29223335193689 0.18403044085929 0.77042213177696 15.999 > 8 47 O 0.62556668527022 0.18403044085929 0.77042213177696 15.999 > 8 48 O 0.95890001860355 0.18403044085929 0.77042213177696 15.999 > 8 *49 O 0.16666666666667 0.00000000000000 0.25000000000000 15.999 > 9 50 O 0.50000000000000 0.00000000000000 0.25000000000000 15.999 > 9 51 O 0.83333333333333 0.00000000000000 0.25000000000000 15.999 > 9 52 O 0.16666666666667 0.00000000000000 0.75000000000000 15.999 > 9 53 O 0.50000000000000 0.00000000000000 0.75000000000000 15.999 > 9 54 O 0.83333333333333 0.00000000000000 0.75000000000000 15.999 > 9 55 O 0.16666666666667 0.50000000000000 0.00000000000000 15.999 > 10 56 O 0.50000000000000 0.50000000000000 0.00000000000000 15.999 > 10 57 O 0.83333333333333 0.50000000000000 0.00000000000000 15.999 > 10 58 O 0.16666666666667 0.50000000000000 0.50000000000000 15.999 > 10 59 O 0.50000000000000 0.50000000000000 0.50000000000000 15.999 > 10 60 O 0.83333333333333 0.50000000000000 0.50000000000000 15.999 > 10 *61 O 0.12647968844396 0.29695277280914 0.37273052856836 15.999 > 11 62 O 0.45981302177729 0.29695277280914 0.37273052856836 15.999 > 11 63 O 0.79314635511062 0.29695277280914 0.37273052856836 15.999 > 11 64 O 0.12647968844396 0.29695277280914 0.87273052856836 15.999 > 11 65 O 0.45981302177729 0.29695277280914 0.87273052856836 15.999 > 11 66 O 0.79314635511062 0.29695277280914 0.87273052856836 15.999 > 11 67 O 0.20685364488938 0.79695277280914 0.37726947143164 15.999 > 12 68 O 0.54018697822271 0.79695277280914 0.37726947143164 15.999 > 12 69 O 0.87352031155604 0.79695277280914 0.37726947143164 15.999 > 12 70 O 0.20685364488938 0.79695277280914 0.87726947143164 15.999 > 12 71 O 0.54018697822271 0.79695277280914 0.87726947143164 15.999 > 12 72 O 0.87352031155604 0.79695277280914 0.87726947143164 15.999 > 12 73 O 0.20685364488938 0.70304722719086 0.12726947143164 15.999 > 13 74 O 0.54018697822271 0.70304722719086 0.12726947143164 15.999 > 13 75 O 0.87352031155604 0.70304722719086 0.12726947143164 15.999 > 13 76 O 0.20685364488938 0.70304722719086 0.62726947143164 15.999 > 13 77 O 0.54018697822271 0.70304722719086 0.62726947143164 15.999 > 13 78 O 0.87352031155604 0.70304722719086 0.62726947143164 15.999 > 13 79 O 0.12647968844396 0.20304722719086 0.12273052856836 15.999 > 14 80 O 0.45981302177729 0.20304722719086 0.12273052856836 15.999 > 14 81 O 0.79314635511062 0.20304722719086 0.12273052856836 15.999 > 14 82 O 0.12647968844396 0.20304722719086 0.62273052856836 15.999 > 14 83 O 0.45981302177729 0.20304722719086 0.62273052856836 15.999 > 14 84 O 0.79314635511062 0.20304722719086 0.62273052856836 15.999 > 14 *85 Si 0.21325209713362 0.11288240067318 0.17750439392642 28.085 > 15 86 Si 0.54658543046695 0.11288240067318 0.17750439392642 28.085 > 15 87 Si 0.87991876380029 0.11288240067318 0.17750439392642 28.085 > 15 88 Si 0.21325209713362 0.11288240067318 0.67750439392642 28.085 > 15 89 Si 0.54658543046695 0.11288240067318 0.67750439392642 28.085 > 15 90 Si 0.87991876380029 0.11288240067318 0.67750439392642 28.085 > 15 91 Si 0.12008123619971 0.61288240067318 0.07249560607358 28.085 > 16 92 Si 0.45341456953305 0.61288240067318 0.07249560607358 28.085 > 16 93 Si 0.78674790286638 0.61288240067318 0.07249560607358 28.085 > 16 94 Si 0.12008123619971 0.61288240067318 0.57249560607358 28.085 > 16 95 Si 0.45341456953305 0.61288240067318 0.57249560607358 28.085 > 16 96 Si 0.78674790286638 0.61288240067318 0.57249560607358 28.085 > 16 97 Si 0.12008123619971 0.88711759932682 0.32249560607358 28.085 > 17 98 Si 0.45341456953305 0.88711759932682 0.32249560607358 28.085 > 17 99 Si 0.78674790286638 0.88711759932682 0.32249560607358 28.085 > 17 100 Si 0.12008123619971 0.88711759932682 0.82249560607358 28.085 > 17 101 Si 0.45341456953305 0.88711759932682 0.82249560607358 28.085 > 17 102 Si 0.78674790286638 0.88711759932682 0.82249560607358 28.085 > 17 103 Si 0.21325209713362 0.38711759932682 0.42750439392642 28.085 > 18 104 Si 0.54658543046695 0.38711759932682 0.42750439392642 28.085 > 18 105 Si 0.87991876380029 0.38711759932682 0.42750439392642 28.085 > 18 106 Si 0.21325209713362 0.38711759932682 0.92750439392642 28.085 > 18 107 Si 0.54658543046695 0.38711759932682 0.92750439392642 28.085 > 18 108 Si 0.87991876380029 0.38711759932682 0.92750439392642 28.085 > 18 *109 Y 0.03695482467548 0.34950950363156 0.20297348743019 88.906 > 19 110 Y 0.37028815800881 0.34950950363156 0.20297348743019 88.906 > 19 111 Y 0.70362149134214 0.34950950363156 0.20297348743019 88.906 > 19 112 Y 0.03695482467548 0.34950950363156 0.70297348743019 88.906 > 19 113 Y 0.37028815800881 0.34950950363156 0.70297348743019 88.906 > 19 114 Y 0.70362149134214 0.34950950363156 0.70297348743019 88.906 > 19 115 Y 0.29637850865786 0.84950950363156 0.04702651256981 88.906 > 20 116 Y 0.62971184199119 0.84950950363156 0.04702651256981 88.906 > 20 117 Y 0.96304517532452 0.84950950363156 0.04702651256981 88.906 > 20 118 Y 0.29637850865786 0.84950950363156 0.54702651256981 88.906 > 20 119 Y 0.62971184199119 0.84950950363156 0.54702651256981 88.906 > 20 120 Y 0.96304517532452 0.84950950363156 0.54702651256981 88.906 > 20 121 Y 0.29637850865786 0.65049049636844 0.29702651256981 88.906 > 21 122 Y 0.62971184199119 0.65049049636844 0.29702651256981 88.906 > 21 123 Y 0.96304517532452 0.65049049636844 0.29702651256981 88.906 > 21 124 Y 0.29637850865786 0.65049049636844 0.79702651256981 88.906 > 21 125 Y 0.62971184199119 0.65049049636844 0.79702651256981 88.906 > 21 126 Y 0.96304517532452 0.65049049636844 0.79702651256981 88.906 > 21 127 Y 0.03695482467548 0.15049049636844 0.45297348743019 88.906 > 22 128 Y 0.37028815800881 0.15049049636844 0.45297348743019 88.906 > 22 129 Y 0.70362149134214 0.15049049636844 0.45297348743019 88.906 > 22 130 Y 0.03695482467548 0.15049049636844 0.95297348743019 88.906 > 22 131 Y 0.37028815800881 0.15049049636844 0.95297348743019 88.906 > 22 132 Y 0.70362149134214 0.15049049636844 0.95297348743019 88.906 > 22 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.1835526 0.0000000 0.0215674 0.0000000 3.3935919 0.0000000 0.0215670 0.0000000 3.3624375 -------------------------- Born effective charges -------------------------- 1 O -1.9089161 0.1739171 0.6254393 0.1187441 -2.3970325 -0.1713965 0.6476615 -0.2297925 -1.9081627 2 O -1.9089161 -0.1739171 0.6254393 -0.1187441 -2.3970325 0.1713965 0.6476615 0.2297925 -1.9081627 3 O -1.9089161 0.1739171 0.6254393 0.1187441 -2.3970325 -0.1713965 0.6476615 -0.2297925 -1.9081627 4 O -1.9089161 -0.1739171 0.6254393 -0.1187441 -2.3970325 0.1713965 0.6476615 0.2297925 -1.9081627 5 O -1.8981422 0.4467981 -0.5133346 0.5430882 -1.9208887 0.1059453 -0.5458090 -0.0000556 -2.4209793 6 O -1.8981422 -0.4467981 -0.5133346 -0.5430882 -1.9208887 -0.1059453 -0.5458090 0.0000556 -2.4209793 7 O -1.8981422 0.4467981 -0.5133346 0.5430882 -1.9208887 0.1059453 -0.5458090 -0.0000556 -2.4209793 8 O -1.8981422 -0.4467981 -0.5133346 -0.5430882 -1.9208887 -0.1059453 -0.5458090 0.0000556 -2.4209793 9 O -1.7084976 -0.6458029 0.5220036 -0.7489505 -2.4537063 0.7769929 0.5302424 0.7863203 -1.7635325 10 O -1.7084976 0.6458029 0.5220036 0.7489505 -2.4537063 -0.7769929 0.5302424 -0.7863203 -1.7635325 11 O -2.2385152 -0.6522372 -0.3848469 -0.6189609 -1.8875681 0.1506230 -0.4031249 0.2050094 -2.0797998 12 O -2.2385152 0.6522372 -0.3848469 0.6189609 -1.8875681 -0.1506230 -0.4031249 -0.2050094 -2.0797998 13 O -2.2385152 -0.6522372 -0.3848469 -0.6189609 -1.8875681 0.1506230 -0.4031249 0.2050094 -2.0797998 14 O -2.2385152 0.6522372 -0.3848469 0.6189609 -1.8875681 -0.1506230 -0.4031249 -0.2050094 -2.0797998 15 Si 3.5738183 -0.0033742 -0.0203971 0.1216739 3.4021779 0.0290820 0.0162149 -0.0875644 3.3591092 16 Si 3.5738183 0.0033742 -0.0203971 -0.1216739 3.4021779 -0.0290820 0.0162149 0.0875644 3.3591092 17 Si 3.5738183 -0.0033742 -0.0203971 0.1216739 3.4021779 0.0290820 0.0162149 -0.0875644 3.3591092 18 Si 3.5738183 0.0033742 -0.0203971 -0.1216739 3.4021779 -0.0290820 0.0162149 0.0875644 3.3591092 19 Y 3.3260040 -0.0835270 0.0321375 -0.0917063 4.0301645 0.1388406 0.0199362 0.0915209 3.9315988 20 Y 3.3260040 0.0835270 0.0321375 0.0917063 4.0301645 -0.1388406 0.0199362 -0.0915209 3.9315988 21 Y 3.3260040 -0.0835270 0.0321375 -0.0917063 4.0301645 0.1388406 0.0199362 0.0915209 3.9315988 22 Y 3.3260040 0.0835270 0.0321375 0.0917063 4.0301645 -0.1388406 0.0199362 -0.0915209 3.9315988 ---------------------------------------------------------------------------- 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: 396/396 Permutation basis: 13530/13530 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3387 Number of blocks in projector: 3387 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: 727 Use submatrix version of eigh solver. (1) Block: 500 / 727 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 727 / 727 (1) 217 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 10 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 727 Use submatrix version of eigh solver. (1) Block: 500 / 727 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 727 / 727 (1) 217 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 10 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 727 Use submatrix version of eigh solver. (1) Block: 500 / 727 (2) Block: 250 / 500 (2) 239 eigenvectors found. (2) Block: 500 / 500 (2) 241 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 489 eigenvectors found. (1) Block: 727 / 727 (1) 220 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 7 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 402 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 402 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 402 Use standard eigh solver. Tree of FC basis block matrices: - (3387, 3334), data: False |-- (402, 396), data: True |-- (402, 396), data: True |-- (402, 396), data: True |-- (727, 716), data: False |-- (727, 7), data: (727, 18) @ (18, 7) |-- (227, 220), data: True |-- (500, 489), data: False |-- (500, 9), data: (500, 20) @ (20, 9) |-- (250, 241), data: True |-- (250, 239), data: True |-- (727, 715), data: False |-- (727, 10), data: (727, 22) @ (22, 10) |-- (227, 217), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True |-- (727, 715), data: False |-- (727, 10), data: (727, 22) @ (22, 10) |-- (227, 217), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True ----- Solver_atoms: 1 -- 132 / 132 Time (Solver_compr_matrix_reshape): 0.016 Solver_block: 100 / 720 - Time: 2.674 Solver_block: 200 / 720 - Time: 2.447 Solver_block: 300 / 720 - Time: 2.557 Solver_block: 400 / 720 - Time: 2.020 Solver_block: 500 / 720 - Time: 1.688 Solver_block: 600 / 720 - Time: 1.758 Solver_block: 700 / 720 - Time: 1.740 Solver_block: 720 / 720 - Time: 0.567 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 16.034 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 396/396 Permutation basis: 13530/13530 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3387 Number of blocks in projector: 3387 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: 727 Use submatrix version of eigh solver. (1) Block: 500 / 727 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 727 / 727 (1) 217 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 10 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 727 Use submatrix version of eigh solver. (1) Block: 500 / 727 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 727 / 727 (1) 217 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 10 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 727 Use submatrix version of eigh solver. (1) Block: 500 / 727 (2) Block: 250 / 500 (2) 239 eigenvectors found. (2) Block: 500 / 500 (2) 241 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 489 eigenvectors found. (1) Block: 727 / 727 (1) 220 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 7 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 402 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 402 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 402 Use standard eigh solver. Tree of FC basis block matrices: - (3387, 3334), data: False |-- (402, 396), data: True |-- (402, 396), data: True |-- (402, 396), data: True |-- (727, 716), data: False |-- (727, 7), data: (727, 18) @ (18, 7) |-- (227, 220), data: True |-- (500, 489), data: False |-- (500, 9), data: (500, 20) @ (20, 9) |-- (250, 241), data: True |-- (250, 239), data: True |-- (727, 715), data: False |-- (727, 10), data: (727, 22) @ (22, 10) |-- (227, 217), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True |-- (727, 715), data: False |-- (727, 10), data: (727, 22) @ (22, 10) |-- (227, 217), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 22:40:56]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 22:40:57]------------------------- 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): [3 1 2] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.710223510002970 0.000000000000000 0.000000000000000 b 0.000000000000000 10.813810429999998 0.000000000000000 c -0.580180170467019 0.000000000000000 5.537881321597433 Atomic positions (fractional): 1 O 0.79614847511964 0.05123795505048 0.13231014631406 15.999 2 O 0.20385152488035 0.55123795505048 0.36768985368594 15.999 3 O 0.20385152488035 0.94876204494952 0.86768985368594 15.999 4 O 0.79614847511964 0.44876204494952 0.63231014631406 15.999 5 O 0.87670005581066 0.31596955914071 0.04084426355392 15.999 6 O 0.12329994418934 0.81596955914071 0.45915573644608 15.999 7 O 0.12329994418934 0.68403044085929 0.95915573644608 15.999 8 O 0.87670005581066 0.18403044085929 0.54084426355392 15.999 9 O 0.50000000000000 0.00000000000000 0.50000000000000 15.999 10 O 0.50000000000000 0.50000000000000 0.00000000000000 15.999 11 O 0.37943906533187 0.29695277280914 0.74546105713671 15.999 12 O 0.62056093466813 0.79695277280914 0.75453894286329 15.999 13 O 0.62056093466813 0.70304722719086 0.25453894286329 15.999 14 O 0.37943906533187 0.20304722719086 0.24546105713671 15.999 15 Si 0.63975629140086 0.11288240067318 0.35500878785284 28.085 16 Si 0.36024370859914 0.61288240067318 0.14499121214716 28.085 17 Si 0.36024370859914 0.88711759932682 0.64499121214716 28.085 18 Si 0.63975629140086 0.38711759932682 0.85500878785284 28.085 19 Y 0.11086447402643 0.34950950363156 0.40594697486038 88.906 20 Y 0.88913552597357 0.84950950363156 0.09405302513962 88.906 21 Y 0.88913552597357 0.65049049636844 0.59405302513962 88.906 22 Y 0.11086447402643 0.15049049636844 0.90594697486038 88.906 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.130670530008910 0.000000000000000 0.000000000000000 b 0.000000000000000 10.813810429999998 0.000000000000000 c -1.160360340934038 0.000000000000000 11.075762643194865 Atomic positions (fractional): 1 O 0.26538282503988 0.05123795505048 0.06615507315703 15.999 > 1 2 O 0.59871615837322 0.05123795505048 0.06615507315703 15.999 > 1 3 O 0.93204949170655 0.05123795505048 0.06615507315703 15.999 > 1 4 O 0.26538282503988 0.05123795505048 0.56615507315703 15.999 > 1 5 O 0.59871615837322 0.05123795505048 0.56615507315703 15.999 > 1 6 O 0.93204949170655 0.05123795505048 0.56615507315703 15.999 > 1 7 O 0.06795050829345 0.55123795505048 0.18384492684297 15.999 > 7 8 O 0.40128384162678 0.55123795505048 0.18384492684297 15.999 > 7 9 O 0.73461717496012 0.55123795505048 0.18384492684297 15.999 > 7 10 O 0.06795050829345 0.55123795505048 0.68384492684297 15.999 > 7 11 O 0.40128384162678 0.55123795505048 0.68384492684297 15.999 > 7 12 O 0.73461717496012 0.55123795505048 0.68384492684297 15.999 > 7 13 O 0.06795050829345 0.94876204494952 0.43384492684297 15.999 > 13 14 O 0.40128384162678 0.94876204494952 0.43384492684297 15.999 > 13 15 O 0.73461717496012 0.94876204494952 0.43384492684297 15.999 > 13 16 O 0.06795050829345 0.94876204494952 0.93384492684297 15.999 > 13 17 O 0.40128384162678 0.94876204494952 0.93384492684297 15.999 > 13 18 O 0.73461717496012 0.94876204494952 0.93384492684297 15.999 > 13 19 O 0.26538282503988 0.44876204494952 0.31615507315703 15.999 > 19 20 O 0.59871615837322 0.44876204494952 0.31615507315703 15.999 > 19 21 O 0.93204949170655 0.44876204494952 0.31615507315703 15.999 > 19 22 O 0.26538282503988 0.44876204494952 0.81615507315703 15.999 > 19 23 O 0.59871615837322 0.44876204494952 0.81615507315703 15.999 > 19 24 O 0.93204949170655 0.44876204494952 0.81615507315703 15.999 > 19 25 O 0.29223335193689 0.31596955914071 0.02042213177696 15.999 > 25 26 O 0.62556668527022 0.31596955914071 0.02042213177696 15.999 > 25 27 O 0.95890001860355 0.31596955914071 0.02042213177696 15.999 > 25 28 O 0.29223335193689 0.31596955914071 0.52042213177696 15.999 > 25 29 O 0.62556668527022 0.31596955914071 0.52042213177696 15.999 > 25 30 O 0.95890001860355 0.31596955914071 0.52042213177696 15.999 > 25 31 O 0.04109998139645 0.81596955914071 0.22957786822304 15.999 > 31 32 O 0.37443331472978 0.81596955914071 0.22957786822304 15.999 > 31 33 O 0.70776664806311 0.81596955914071 0.22957786822304 15.999 > 31 34 O 0.04109998139645 0.81596955914071 0.72957786822304 15.999 > 31 35 O 0.37443331472978 0.81596955914071 0.72957786822304 15.999 > 31 36 O 0.70776664806311 0.81596955914071 0.72957786822304 15.999 > 31 37 O 0.04109998139645 0.68403044085929 0.47957786822304 15.999 > 37 38 O 0.37443331472978 0.68403044085929 0.47957786822304 15.999 > 37 39 O 0.70776664806311 0.68403044085929 0.47957786822304 15.999 > 37 40 O 0.04109998139645 0.68403044085929 0.97957786822304 15.999 > 37 41 O 0.37443331472978 0.68403044085929 0.97957786822304 15.999 > 37 42 O 0.70776664806311 0.68403044085929 0.97957786822304 15.999 > 37 43 O 0.29223335193689 0.18403044085929 0.27042213177696 15.999 > 43 44 O 0.62556668527022 0.18403044085929 0.27042213177696 15.999 > 43 45 O 0.95890001860355 0.18403044085929 0.27042213177696 15.999 > 43 46 O 0.29223335193689 0.18403044085929 0.77042213177696 15.999 > 43 47 O 0.62556668527022 0.18403044085929 0.77042213177696 15.999 > 43 48 O 0.95890001860355 0.18403044085929 0.77042213177696 15.999 > 43 49 O 0.16666666666667 0.00000000000000 0.25000000000000 15.999 > 49 50 O 0.50000000000000 0.00000000000000 0.25000000000000 15.999 > 49 51 O 0.83333333333333 0.00000000000000 0.25000000000000 15.999 > 49 52 O 0.16666666666667 0.00000000000000 0.75000000000000 15.999 > 49 53 O 0.50000000000000 0.00000000000000 0.75000000000000 15.999 > 49 54 O 0.83333333333333 0.00000000000000 0.75000000000000 15.999 > 49 55 O 0.16666666666667 0.50000000000000 0.00000000000000 15.999 > 55 56 O 0.50000000000000 0.50000000000000 0.00000000000000 15.999 > 55 57 O 0.83333333333333 0.50000000000000 0.00000000000000 15.999 > 55 58 O 0.16666666666667 0.50000000000000 0.50000000000000 15.999 > 55 59 O 0.50000000000000 0.50000000000000 0.50000000000000 15.999 > 55 60 O 0.83333333333333 0.50000000000000 0.50000000000000 15.999 > 55 61 O 0.12647968844396 0.29695277280914 0.37273052856836 15.999 > 61 62 O 0.45981302177729 0.29695277280914 0.37273052856836 15.999 > 61 63 O 0.79314635511062 0.29695277280914 0.37273052856836 15.999 > 61 64 O 0.12647968844396 0.29695277280914 0.87273052856836 15.999 > 61 65 O 0.45981302177729 0.29695277280914 0.87273052856836 15.999 > 61 66 O 0.79314635511062 0.29695277280914 0.87273052856836 15.999 > 61 67 O 0.20685364488938 0.79695277280914 0.37726947143164 15.999 > 67 68 O 0.54018697822271 0.79695277280914 0.37726947143164 15.999 > 67 69 O 0.87352031155604 0.79695277280914 0.37726947143164 15.999 > 67 70 O 0.20685364488938 0.79695277280914 0.87726947143164 15.999 > 67 71 O 0.54018697822271 0.79695277280914 0.87726947143164 15.999 > 67 72 O 0.87352031155604 0.79695277280914 0.87726947143164 15.999 > 67 73 O 0.20685364488938 0.70304722719086 0.12726947143164 15.999 > 73 74 O 0.54018697822271 0.70304722719086 0.12726947143164 15.999 > 73 75 O 0.87352031155604 0.70304722719086 0.12726947143164 15.999 > 73 76 O 0.20685364488938 0.70304722719086 0.62726947143164 15.999 > 73 77 O 0.54018697822271 0.70304722719086 0.62726947143164 15.999 > 73 78 O 0.87352031155604 0.70304722719086 0.62726947143164 15.999 > 73 79 O 0.12647968844396 0.20304722719086 0.12273052856836 15.999 > 79 80 O 0.45981302177729 0.20304722719086 0.12273052856836 15.999 > 79 81 O 0.79314635511062 0.20304722719086 0.12273052856836 15.999 > 79 82 O 0.12647968844396 0.20304722719086 0.62273052856836 15.999 > 79 83 O 0.45981302177729 0.20304722719086 0.62273052856836 15.999 > 79 84 O 0.79314635511062 0.20304722719086 0.62273052856836 15.999 > 79 85 Si 0.21325209713362 0.11288240067318 0.17750439392642 28.085 > 85 86 Si 0.54658543046695 0.11288240067318 0.17750439392642 28.085 > 85 87 Si 0.87991876380029 0.11288240067318 0.17750439392642 28.085 > 85 88 Si 0.21325209713362 0.11288240067318 0.67750439392642 28.085 > 85 89 Si 0.54658543046695 0.11288240067318 0.67750439392642 28.085 > 85 90 Si 0.87991876380029 0.11288240067318 0.67750439392642 28.085 > 85 91 Si 0.12008123619971 0.61288240067318 0.07249560607358 28.085 > 91 92 Si 0.45341456953305 0.61288240067318 0.07249560607358 28.085 > 91 93 Si 0.78674790286638 0.61288240067318 0.07249560607358 28.085 > 91 94 Si 0.12008123619971 0.61288240067318 0.57249560607358 28.085 > 91 95 Si 0.45341456953305 0.61288240067318 0.57249560607358 28.085 > 91 96 Si 0.78674790286638 0.61288240067318 0.57249560607358 28.085 > 91 97 Si 0.12008123619971 0.88711759932682 0.32249560607358 28.085 > 97 98 Si 0.45341456953305 0.88711759932682 0.32249560607358 28.085 > 97 99 Si 0.78674790286638 0.88711759932682 0.32249560607358 28.085 > 97 100 Si 0.12008123619971 0.88711759932682 0.82249560607358 28.085 > 97 101 Si 0.45341456953305 0.88711759932682 0.82249560607358 28.085 > 97 102 Si 0.78674790286638 0.88711759932682 0.82249560607358 28.085 > 97 103 Si 0.21325209713362 0.38711759932682 0.42750439392642 28.085 > 103 104 Si 0.54658543046695 0.38711759932682 0.42750439392642 28.085 > 103 105 Si 0.87991876380029 0.38711759932682 0.42750439392642 28.085 > 103 106 Si 0.21325209713362 0.38711759932682 0.92750439392642 28.085 > 103 107 Si 0.54658543046695 0.38711759932682 0.92750439392642 28.085 > 103 108 Si 0.87991876380029 0.38711759932682 0.92750439392642 28.085 > 103 109 Y 0.03695482467548 0.34950950363156 0.20297348743019 88.906 > 109 110 Y 0.37028815800881 0.34950950363156 0.20297348743019 88.906 > 109 111 Y 0.70362149134214 0.34950950363156 0.20297348743019 88.906 > 109 112 Y 0.03695482467548 0.34950950363156 0.70297348743019 88.906 > 109 113 Y 0.37028815800881 0.34950950363156 0.70297348743019 88.906 > 109 114 Y 0.70362149134214 0.34950950363156 0.70297348743019 88.906 > 109 115 Y 0.29637850865786 0.84950950363156 0.04702651256981 88.906 > 115 116 Y 0.62971184199119 0.84950950363156 0.04702651256981 88.906 > 115 117 Y 0.96304517532452 0.84950950363156 0.04702651256981 88.906 > 115 118 Y 0.29637850865786 0.84950950363156 0.54702651256981 88.906 > 115 119 Y 0.62971184199119 0.84950950363156 0.54702651256981 88.906 > 115 120 Y 0.96304517532452 0.84950950363156 0.54702651256981 88.906 > 115 121 Y 0.29637850865786 0.65049049636844 0.29702651256981 88.906 > 121 122 Y 0.62971184199119 0.65049049636844 0.29702651256981 88.906 > 121 123 Y 0.96304517532452 0.65049049636844 0.29702651256981 88.906 > 121 124 Y 0.29637850865786 0.65049049636844 0.79702651256981 88.906 > 121 125 Y 0.62971184199119 0.65049049636844 0.79702651256981 88.906 > 121 126 Y 0.96304517532452 0.65049049636844 0.79702651256981 88.906 > 121 127 Y 0.03695482467548 0.15049049636844 0.45297348743019 88.906 > 127 128 Y 0.37028815800881 0.15049049636844 0.45297348743019 88.906 > 127 129 Y 0.70362149134214 0.15049049636844 0.45297348743019 88.906 > 127 130 Y 0.03695482467548 0.15049049636844 0.95297348743019 88.906 > 127 131 Y 0.37028815800881 0.15049049636844 0.95297348743019 88.906 > 127 132 Y 0.70362149134214 0.15049049636844 0.95297348743019 88.906 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.1835526 0.0000000 0.0215674 0.0000000 3.3935919 0.0000000 0.0215670 0.0000000 3.3624375 -------------------------- Born effective charges -------------------------- 1 O -1.9089161 0.1739171 0.6254393 0.1187441 -2.3970325 -0.1713965 0.6476615 -0.2297925 -1.9081627 2 O -1.9089161 -0.1739171 0.6254393 -0.1187441 -2.3970325 0.1713965 0.6476615 0.2297925 -1.9081627 3 O -1.9089161 0.1739171 0.6254393 0.1187441 -2.3970325 -0.1713965 0.6476615 -0.2297925 -1.9081627 4 O -1.9089161 -0.1739171 0.6254393 -0.1187441 -2.3970325 0.1713965 0.6476615 0.2297925 -1.9081627 5 O -1.8981422 0.4467981 -0.5133346 0.5430882 -1.9208887 0.1059453 -0.5458090 -0.0000556 -2.4209793 6 O -1.8981422 -0.4467981 -0.5133346 -0.5430882 -1.9208887 -0.1059453 -0.5458090 0.0000556 -2.4209793 7 O -1.8981422 0.4467981 -0.5133346 0.5430882 -1.9208887 0.1059453 -0.5458090 -0.0000556 -2.4209793 8 O -1.8981422 -0.4467981 -0.5133346 -0.5430882 -1.9208887 -0.1059453 -0.5458090 0.0000556 -2.4209793 9 O -1.7084976 -0.6458029 0.5220036 -0.7489505 -2.4537063 0.7769929 0.5302424 0.7863203 -1.7635325 10 O -1.7084976 0.6458029 0.5220036 0.7489505 -2.4537063 -0.7769929 0.5302424 -0.7863203 -1.7635325 11 O -2.2385152 -0.6522372 -0.3848469 -0.6189609 -1.8875681 0.1506230 -0.4031249 0.2050094 -2.0797998 12 O -2.2385152 0.6522372 -0.3848469 0.6189609 -1.8875681 -0.1506230 -0.4031249 -0.2050094 -2.0797998 13 O -2.2385152 -0.6522372 -0.3848469 -0.6189609 -1.8875681 0.1506230 -0.4031249 0.2050094 -2.0797998 14 O -2.2385152 0.6522372 -0.3848469 0.6189609 -1.8875681 -0.1506230 -0.4031249 -0.2050094 -2.0797998 15 Si 3.5738183 -0.0033742 -0.0203971 0.1216739 3.4021779 0.0290820 0.0162149 -0.0875644 3.3591092 16 Si 3.5738183 0.0033742 -0.0203971 -0.1216739 3.4021779 -0.0290820 0.0162149 0.0875644 3.3591092 17 Si 3.5738183 -0.0033742 -0.0203971 0.1216739 3.4021779 0.0290820 0.0162149 -0.0875644 3.3591092 18 Si 3.5738183 0.0033742 -0.0203971 -0.1216739 3.4021779 -0.0290820 0.0162149 0.0875644 3.3591092 19 Y 3.3260040 -0.0835270 0.0321375 -0.0917063 4.0301645 0.1388406 0.0199362 0.0915209 3.9315988 20 Y 3.3260040 0.0835270 0.0321375 0.0917063 4.0301645 -0.1388406 0.0199362 -0.0915209 3.9315988 21 Y 3.3260040 -0.0835270 0.0321375 -0.0917063 4.0301645 0.1388406 0.0199362 0.0915209 3.9315988 22 Y 3.3260040 0.0835270 0.0321375 0.0917063 4.0301645 -0.1388406 0.0199362 -0.0915209 3.9315988 ---------------------------------------------------------------------------- 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] Computing fc3[ 61, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] Computing fc3[ 85, 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] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] Computing fc3[ 109, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0010 0.0000 0.0099] [ 0.0010 0.0000 -0.0099] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (zxz) -0.00000000 (zxz) -0.00000000 (zzx) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (yz) -0.00000000 (yz) 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 22:41:34]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 22:41:35]------------------------- 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): [3 1 2] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.710223510002970 0.000000000000000 0.000000000000000 b 0.000000000000000 10.813810429999998 0.000000000000000 c -0.580180170467019 0.000000000000000 5.537881321597433 Atomic positions (fractional): 1 O 0.79614847511964 0.05123795505048 0.13231014631406 15.999 2 O 0.20385152488035 0.55123795505048 0.36768985368594 15.999 3 O 0.20385152488035 0.94876204494952 0.86768985368594 15.999 4 O 0.79614847511964 0.44876204494952 0.63231014631406 15.999 5 O 0.87670005581066 0.31596955914071 0.04084426355392 15.999 6 O 0.12329994418934 0.81596955914071 0.45915573644608 15.999 7 O 0.12329994418934 0.68403044085929 0.95915573644608 15.999 8 O 0.87670005581066 0.18403044085929 0.54084426355392 15.999 9 O 0.50000000000000 0.00000000000000 0.50000000000000 15.999 10 O 0.50000000000000 0.50000000000000 0.00000000000000 15.999 11 O 0.37943906533187 0.29695277280914 0.74546105713671 15.999 12 O 0.62056093466813 0.79695277280914 0.75453894286329 15.999 13 O 0.62056093466813 0.70304722719086 0.25453894286329 15.999 14 O 0.37943906533187 0.20304722719086 0.24546105713671 15.999 15 Si 0.63975629140086 0.11288240067318 0.35500878785284 28.085 16 Si 0.36024370859914 0.61288240067318 0.14499121214716 28.085 17 Si 0.36024370859914 0.88711759932682 0.64499121214716 28.085 18 Si 0.63975629140086 0.38711759932682 0.85500878785284 28.085 19 Y 0.11086447402643 0.34950950363156 0.40594697486038 88.906 20 Y 0.88913552597357 0.84950950363156 0.09405302513962 88.906 21 Y 0.88913552597357 0.65049049636844 0.59405302513962 88.906 22 Y 0.11086447402643 0.15049049636844 0.90594697486038 88.906 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.130670530008910 0.000000000000000 0.000000000000000 b 0.000000000000000 10.813810429999998 0.000000000000000 c -1.160360340934038 0.000000000000000 11.075762643194865 Atomic positions (fractional): 1 O 0.26538282503988 0.05123795505048 0.06615507315703 15.999 > 1 2 O 0.59871615837322 0.05123795505048 0.06615507315703 15.999 > 1 3 O 0.93204949170655 0.05123795505048 0.06615507315703 15.999 > 1 4 O 0.26538282503988 0.05123795505048 0.56615507315703 15.999 > 1 5 O 0.59871615837322 0.05123795505048 0.56615507315703 15.999 > 1 6 O 0.93204949170655 0.05123795505048 0.56615507315703 15.999 > 1 7 O 0.06795050829345 0.55123795505048 0.18384492684297 15.999 > 7 8 O 0.40128384162678 0.55123795505048 0.18384492684297 15.999 > 7 9 O 0.73461717496012 0.55123795505048 0.18384492684297 15.999 > 7 10 O 0.06795050829345 0.55123795505048 0.68384492684297 15.999 > 7 11 O 0.40128384162678 0.55123795505048 0.68384492684297 15.999 > 7 12 O 0.73461717496012 0.55123795505048 0.68384492684297 15.999 > 7 13 O 0.06795050829345 0.94876204494952 0.43384492684297 15.999 > 13 14 O 0.40128384162678 0.94876204494952 0.43384492684297 15.999 > 13 15 O 0.73461717496012 0.94876204494952 0.43384492684297 15.999 > 13 16 O 0.06795050829345 0.94876204494952 0.93384492684297 15.999 > 13 17 O 0.40128384162678 0.94876204494952 0.93384492684297 15.999 > 13 18 O 0.73461717496012 0.94876204494952 0.93384492684297 15.999 > 13 19 O 0.26538282503988 0.44876204494952 0.31615507315703 15.999 > 19 20 O 0.59871615837322 0.44876204494952 0.31615507315703 15.999 > 19 21 O 0.93204949170655 0.44876204494952 0.31615507315703 15.999 > 19 22 O 0.26538282503988 0.44876204494952 0.81615507315703 15.999 > 19 23 O 0.59871615837322 0.44876204494952 0.81615507315703 15.999 > 19 24 O 0.93204949170655 0.44876204494952 0.81615507315703 15.999 > 19 25 O 0.29223335193689 0.31596955914071 0.02042213177696 15.999 > 25 26 O 0.62556668527022 0.31596955914071 0.02042213177696 15.999 > 25 27 O 0.95890001860355 0.31596955914071 0.02042213177696 15.999 > 25 28 O 0.29223335193689 0.31596955914071 0.52042213177696 15.999 > 25 29 O 0.62556668527022 0.31596955914071 0.52042213177696 15.999 > 25 30 O 0.95890001860355 0.31596955914071 0.52042213177696 15.999 > 25 31 O 0.04109998139645 0.81596955914071 0.22957786822304 15.999 > 31 32 O 0.37443331472978 0.81596955914071 0.22957786822304 15.999 > 31 33 O 0.70776664806311 0.81596955914071 0.22957786822304 15.999 > 31 34 O 0.04109998139645 0.81596955914071 0.72957786822304 15.999 > 31 35 O 0.37443331472978 0.81596955914071 0.72957786822304 15.999 > 31 36 O 0.70776664806311 0.81596955914071 0.72957786822304 15.999 > 31 37 O 0.04109998139645 0.68403044085929 0.47957786822304 15.999 > 37 38 O 0.37443331472978 0.68403044085929 0.47957786822304 15.999 > 37 39 O 0.70776664806311 0.68403044085929 0.47957786822304 15.999 > 37 40 O 0.04109998139645 0.68403044085929 0.97957786822304 15.999 > 37 41 O 0.37443331472978 0.68403044085929 0.97957786822304 15.999 > 37 42 O 0.70776664806311 0.68403044085929 0.97957786822304 15.999 > 37 43 O 0.29223335193689 0.18403044085929 0.27042213177696 15.999 > 43 44 O 0.62556668527022 0.18403044085929 0.27042213177696 15.999 > 43 45 O 0.95890001860355 0.18403044085929 0.27042213177696 15.999 > 43 46 O 0.29223335193689 0.18403044085929 0.77042213177696 15.999 > 43 47 O 0.62556668527022 0.18403044085929 0.77042213177696 15.999 > 43 48 O 0.95890001860355 0.18403044085929 0.77042213177696 15.999 > 43 49 O 0.16666666666667 0.00000000000000 0.25000000000000 15.999 > 49 50 O 0.50000000000000 0.00000000000000 0.25000000000000 15.999 > 49 51 O 0.83333333333333 0.00000000000000 0.25000000000000 15.999 > 49 52 O 0.16666666666667 0.00000000000000 0.75000000000000 15.999 > 49 53 O 0.50000000000000 0.00000000000000 0.75000000000000 15.999 > 49 54 O 0.83333333333333 0.00000000000000 0.75000000000000 15.999 > 49 55 O 0.16666666666667 0.50000000000000 0.00000000000000 15.999 > 55 56 O 0.50000000000000 0.50000000000000 0.00000000000000 15.999 > 55 57 O 0.83333333333333 0.50000000000000 0.00000000000000 15.999 > 55 58 O 0.16666666666667 0.50000000000000 0.50000000000000 15.999 > 55 59 O 0.50000000000000 0.50000000000000 0.50000000000000 15.999 > 55 60 O 0.83333333333333 0.50000000000000 0.50000000000000 15.999 > 55 61 O 0.12647968844396 0.29695277280914 0.37273052856836 15.999 > 61 62 O 0.45981302177729 0.29695277280914 0.37273052856836 15.999 > 61 63 O 0.79314635511062 0.29695277280914 0.37273052856836 15.999 > 61 64 O 0.12647968844396 0.29695277280914 0.87273052856836 15.999 > 61 65 O 0.45981302177729 0.29695277280914 0.87273052856836 15.999 > 61 66 O 0.79314635511062 0.29695277280914 0.87273052856836 15.999 > 61 67 O 0.20685364488938 0.79695277280914 0.37726947143164 15.999 > 67 68 O 0.54018697822271 0.79695277280914 0.37726947143164 15.999 > 67 69 O 0.87352031155604 0.79695277280914 0.37726947143164 15.999 > 67 70 O 0.20685364488938 0.79695277280914 0.87726947143164 15.999 > 67 71 O 0.54018697822271 0.79695277280914 0.87726947143164 15.999 > 67 72 O 0.87352031155604 0.79695277280914 0.87726947143164 15.999 > 67 73 O 0.20685364488938 0.70304722719086 0.12726947143164 15.999 > 73 74 O 0.54018697822271 0.70304722719086 0.12726947143164 15.999 > 73 75 O 0.87352031155604 0.70304722719086 0.12726947143164 15.999 > 73 76 O 0.20685364488938 0.70304722719086 0.62726947143164 15.999 > 73 77 O 0.54018697822271 0.70304722719086 0.62726947143164 15.999 > 73 78 O 0.87352031155604 0.70304722719086 0.62726947143164 15.999 > 73 79 O 0.12647968844396 0.20304722719086 0.12273052856836 15.999 > 79 80 O 0.45981302177729 0.20304722719086 0.12273052856836 15.999 > 79 81 O 0.79314635511062 0.20304722719086 0.12273052856836 15.999 > 79 82 O 0.12647968844396 0.20304722719086 0.62273052856836 15.999 > 79 83 O 0.45981302177729 0.20304722719086 0.62273052856836 15.999 > 79 84 O 0.79314635511062 0.20304722719086 0.62273052856836 15.999 > 79 85 Si 0.21325209713362 0.11288240067318 0.17750439392642 28.085 > 85 86 Si 0.54658543046695 0.11288240067318 0.17750439392642 28.085 > 85 87 Si 0.87991876380029 0.11288240067318 0.17750439392642 28.085 > 85 88 Si 0.21325209713362 0.11288240067318 0.67750439392642 28.085 > 85 89 Si 0.54658543046695 0.11288240067318 0.67750439392642 28.085 > 85 90 Si 0.87991876380029 0.11288240067318 0.67750439392642 28.085 > 85 91 Si 0.12008123619971 0.61288240067318 0.07249560607358 28.085 > 91 92 Si 0.45341456953305 0.61288240067318 0.07249560607358 28.085 > 91 93 Si 0.78674790286638 0.61288240067318 0.07249560607358 28.085 > 91 94 Si 0.12008123619971 0.61288240067318 0.57249560607358 28.085 > 91 95 Si 0.45341456953305 0.61288240067318 0.57249560607358 28.085 > 91 96 Si 0.78674790286638 0.61288240067318 0.57249560607358 28.085 > 91 97 Si 0.12008123619971 0.88711759932682 0.32249560607358 28.085 > 97 98 Si 0.45341456953305 0.88711759932682 0.32249560607358 28.085 > 97 99 Si 0.78674790286638 0.88711759932682 0.32249560607358 28.085 > 97 100 Si 0.12008123619971 0.88711759932682 0.82249560607358 28.085 > 97 101 Si 0.45341456953305 0.88711759932682 0.82249560607358 28.085 > 97 102 Si 0.78674790286638 0.88711759932682 0.82249560607358 28.085 > 97 103 Si 0.21325209713362 0.38711759932682 0.42750439392642 28.085 > 103 104 Si 0.54658543046695 0.38711759932682 0.42750439392642 28.085 > 103 105 Si 0.87991876380029 0.38711759932682 0.42750439392642 28.085 > 103 106 Si 0.21325209713362 0.38711759932682 0.92750439392642 28.085 > 103 107 Si 0.54658543046695 0.38711759932682 0.92750439392642 28.085 > 103 108 Si 0.87991876380029 0.38711759932682 0.92750439392642 28.085 > 103 109 Y 0.03695482467548 0.34950950363156 0.20297348743019 88.906 > 109 110 Y 0.37028815800881 0.34950950363156 0.20297348743019 88.906 > 109 111 Y 0.70362149134214 0.34950950363156 0.20297348743019 88.906 > 109 112 Y 0.03695482467548 0.34950950363156 0.70297348743019 88.906 > 109 113 Y 0.37028815800881 0.34950950363156 0.70297348743019 88.906 > 109 114 Y 0.70362149134214 0.34950950363156 0.70297348743019 88.906 > 109 115 Y 0.29637850865786 0.84950950363156 0.04702651256981 88.906 > 115 116 Y 0.62971184199119 0.84950950363156 0.04702651256981 88.906 > 115 117 Y 0.96304517532452 0.84950950363156 0.04702651256981 88.906 > 115 118 Y 0.29637850865786 0.84950950363156 0.54702651256981 88.906 > 115 119 Y 0.62971184199119 0.84950950363156 0.54702651256981 88.906 > 115 120 Y 0.96304517532452 0.84950950363156 0.54702651256981 88.906 > 115 121 Y 0.29637850865786 0.65049049636844 0.29702651256981 88.906 > 121 122 Y 0.62971184199119 0.65049049636844 0.29702651256981 88.906 > 121 123 Y 0.96304517532452 0.65049049636844 0.29702651256981 88.906 > 121 124 Y 0.29637850865786 0.65049049636844 0.79702651256981 88.906 > 121 125 Y 0.62971184199119 0.65049049636844 0.79702651256981 88.906 > 121 126 Y 0.96304517532452 0.65049049636844 0.79702651256981 88.906 > 121 127 Y 0.03695482467548 0.15049049636844 0.45297348743019 88.906 > 127 128 Y 0.37028815800881 0.15049049636844 0.45297348743019 88.906 > 127 129 Y 0.70362149134214 0.15049049636844 0.45297348743019 88.906 > 127 130 Y 0.03695482467548 0.15049049636844 0.95297348743019 88.906 > 127 131 Y 0.37028815800881 0.15049049636844 0.95297348743019 88.906 > 127 132 Y 0.70362149134214 0.15049049636844 0.95297348743019 88.906 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.1835526 0.0000000 0.0215674 0.0000000 3.3935919 0.0000000 0.0215670 0.0000000 3.3624375 -------------------------- Born effective charges -------------------------- 1 O -1.9089161 0.1739171 0.6254393 0.1187441 -2.3970325 -0.1713965 0.6476615 -0.2297925 -1.9081627 2 O -1.9089161 -0.1739171 0.6254393 -0.1187441 -2.3970325 0.1713965 0.6476615 0.2297925 -1.9081627 3 O -1.9089161 0.1739171 0.6254393 0.1187441 -2.3970325 -0.1713965 0.6476615 -0.2297925 -1.9081627 4 O -1.9089161 -0.1739171 0.6254393 -0.1187441 -2.3970325 0.1713965 0.6476615 0.2297925 -1.9081627 5 O -1.8981422 0.4467981 -0.5133346 0.5430882 -1.9208887 0.1059453 -0.5458090 -0.0000556 -2.4209793 6 O -1.8981422 -0.4467981 -0.5133346 -0.5430882 -1.9208887 -0.1059453 -0.5458090 0.0000556 -2.4209793 7 O -1.8981422 0.4467981 -0.5133346 0.5430882 -1.9208887 0.1059453 -0.5458090 -0.0000556 -2.4209793 8 O -1.8981422 -0.4467981 -0.5133346 -0.5430882 -1.9208887 -0.1059453 -0.5458090 0.0000556 -2.4209793 9 O -1.7084976 -0.6458029 0.5220036 -0.7489505 -2.4537063 0.7769929 0.5302424 0.7863203 -1.7635325 10 O -1.7084976 0.6458029 0.5220036 0.7489505 -2.4537063 -0.7769929 0.5302424 -0.7863203 -1.7635325 11 O -2.2385152 -0.6522372 -0.3848469 -0.6189609 -1.8875681 0.1506230 -0.4031249 0.2050094 -2.0797998 12 O -2.2385152 0.6522372 -0.3848469 0.6189609 -1.8875681 -0.1506230 -0.4031249 -0.2050094 -2.0797998 13 O -2.2385152 -0.6522372 -0.3848469 -0.6189609 -1.8875681 0.1506230 -0.4031249 0.2050094 -2.0797998 14 O -2.2385152 0.6522372 -0.3848469 0.6189609 -1.8875681 -0.1506230 -0.4031249 -0.2050094 -2.0797998 15 Si 3.5738183 -0.0033742 -0.0203971 0.1216739 3.4021779 0.0290820 0.0162149 -0.0875644 3.3591092 16 Si 3.5738183 0.0033742 -0.0203971 -0.1216739 3.4021779 -0.0290820 0.0162149 0.0875644 3.3591092 17 Si 3.5738183 -0.0033742 -0.0203971 0.1216739 3.4021779 0.0290820 0.0162149 -0.0875644 3.3591092 18 Si 3.5738183 0.0033742 -0.0203971 -0.1216739 3.4021779 -0.0290820 0.0162149 0.0875644 3.3591092 19 Y 3.3260040 -0.0835270 0.0321375 -0.0917063 4.0301645 0.1388406 0.0199362 0.0915209 3.9315988 20 Y 3.3260040 0.0835270 0.0321375 0.0917063 4.0301645 -0.1388406 0.0199362 -0.0915209 3.9315988 21 Y 3.3260040 -0.0835270 0.0321375 -0.0917063 4.0301645 0.1388406 0.0199362 0.0915209 3.9315988 22 Y 3.3260040 0.0835270 0.0321375 0.0917063 4.0301645 -0.1388406 0.0199362 -0.0915209 3.9315988 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (zxz) -0.00000000 (zxz) -0.00000000 (zzx) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 11 5 9 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.63, Number of G-points: 299, Lambda: 0.12 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/150) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 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 1.966 ( 0.000 0.000 0.000) 0.000 3.036 ( 0.000 0.000 0.000) 0.000 3.407 ( 0.000 0.000 0.000) 0.000 3.427 ( 0.000 0.000 0.000) 0.000 3.467 ( 0.000 0.000 0.000) 0.000 3.755 ( 0.000 0.000 0.000) 0.000 4.315 ( 0.000 0.000 0.000) 0.000 4.547 ( 0.000 0.000 0.000) 0.000 5.209 ( 0.000 0.000 0.000) 0.000 5.535 ( 0.000 0.000 0.000) 0.000 5.692 ( 0.000 0.000 0.000) 0.000 5.725 ( 0.000 0.000 0.000) 0.000 5.946 ( 0.000 0.000 0.000) 0.000 6.042 ( 0.000 0.000 0.000) 0.000 6.214 ( 0.000 0.000 0.000) 0.000 6.311 ( 0.000 0.000 0.000) 0.000 6.656 ( 0.000 0.000 0.000) 0.000 6.677 ( 0.000 0.000 0.000) 0.000 7.055 ( 0.000 0.000 0.000) 0.000 7.449 ( 0.000 0.000 0.000) 0.000 7.722 ( 0.000 0.000 0.000) 0.000 8.104 ( 0.000 0.000 0.000) 0.000 8.204 ( 0.000 0.000 0.000) 0.000 9.518 ( 0.000 0.000 0.000) 0.000 9.545 ( 0.000 0.000 0.000) 0.000 9.667 ( 0.000 0.000 0.000) 0.000 9.721 ( 0.000 0.000 0.000) 0.000 10.436 ( 0.000 0.000 0.000) 0.000 10.666 ( 0.000 0.000 0.000) 0.000 11.011 ( 0.000 0.000 0.000) 0.000 11.685 ( 0.000 0.000 0.000) 0.000 11.924 ( 0.000 0.000 0.000) 0.000 12.206 ( 0.000 0.000 0.000) 0.000 12.300 ( 0.000 0.000 0.000) 0.000 12.550 ( 0.000 0.000 0.000) 0.000 12.564 ( 0.000 0.000 0.000) 0.000 13.426 ( 0.000 0.000 0.000) 0.000 13.491 ( 0.000 0.000 0.000) 0.000 13.760 ( 0.000 0.000 0.000) 0.000 14.065 ( 0.000 0.000 0.000) 0.000 14.123 ( 0.000 0.000 0.000) 0.000 14.567 ( 0.000 0.000 0.000) 0.000 14.758 ( 0.000 0.000 0.000) 0.000 14.829 ( 0.000 0.000 0.000) 0.000 16.281 ( 0.000 0.000 0.000) 0.000 16.690 ( 0.000 0.000 0.000) 0.000 16.765 ( 0.000 0.000 0.000) 0.000 19.117 ( 0.000 0.000 0.000) 0.000 19.120 ( 0.000 0.000 0.000) 0.000 24.604 ( 0.000 0.000 0.000) 0.000 24.781 ( 0.000 0.000 0.000) 0.000 25.959 ( 0.000 0.000 0.000) 0.000 26.486 ( 0.000 0.000 0.000) 0.000 26.642 ( 0.000 0.000 0.000) 0.000 26.763 ( 0.000 0.000 0.000) 0.000 26.798 ( 0.000 0.000 0.000) 0.000 27.470 ( 0.000 0.000 0.000) 0.000 27.503 ( 0.000 0.000 0.000) 0.000 27.528 ( 0.000 0.000 0.000) 0.000 27.695 ( 0.000 0.000 0.000) 0.000 27.940 ( 0.000 0.000 0.000) 0.000 32.219 ( 0.000 0.000 0.000) 0.000 33.313 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/150) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.863 ( 44.442 0.000 -12.444) 46.151 0.934 ( 46.048 0.000 9.768) 47.073 1.306 ( 64.716 0.000 13.839) 66.179 2.214 ( 20.439 0.000 24.830) 32.161 3.019 ( -24.639 0.000 18.413) 30.759 3.099 ( 1.385 0.000 1.714) 2.204 3.458 ( 3.671 0.000 9.311) 10.009 3.763 ( 12.641 0.000 -4.688) 13.482 3.774 ( 2.521 0.000 -4.818) 5.438 4.304 ( -1.549 0.000 2.205) 2.695 4.488 ( -5.708 0.000 -4.586) 7.323 5.264 ( 4.649 0.000 1.498) 4.884 5.489 ( -7.284 0.000 0.767) 7.324 5.574 ( -5.442 0.000 0.791) 5.499 5.699 ( -4.508 0.000 10.668) 11.581 5.937 ( -1.544 0.000 3.422) 3.754 6.121 ( 13.377 0.000 -5.106) 14.318 6.318 ( -4.569 0.000 8.429) 9.587 6.474 ( 0.031 0.000 6.087) 6.087 6.571 ( 8.035 0.000 -12.618) 14.959 6.833 ( 5.750 0.000 8.446) 10.217 7.419 ( -2.813 0.000 -8.408) 8.866 7.516 ( 6.566 0.000 -1.521) 6.740 8.028 ( -5.421 0.000 -6.624) 8.559 8.213 ( -0.646 0.000 2.426) 2.510 9.241 ( 7.611 0.000 -75.844) 76.225 9.509 ( -4.222 0.000 2.263) 4.790 9.662 ( -1.609 0.000 5.879) 6.095 9.683 ( -3.903 0.000 1.531) 4.192 10.366 ( -15.076 0.000 88.846) 90.116 10.506 ( 6.653 0.000 3.567) 7.549 10.620 ( -3.528 0.000 0.098) 3.529 10.947 ( -6.584 0.000 0.956) 6.653 11.568 ( -10.025 0.000 -3.441) 10.599 11.897 ( -2.601 0.000 -2.006) 3.285 12.269 ( -3.334 0.000 2.974) 4.467 12.322 ( 10.407 0.000 -6.472) 12.255 12.587 ( -0.754 0.000 -11.109) 11.134 12.611 ( 4.811 0.000 -1.094) 4.934 13.451 ( 0.505 0.000 0.366) 0.624 13.651 ( 0.501 0.000 -13.335) 13.344 13.835 ( 6.063 0.000 -4.849) 7.764 14.051 ( 2.751 0.000 -6.690) 7.234 14.201 ( 5.617 0.000 -0.534) 5.642 14.593 ( 0.577 0.000 9.776) 9.793 14.752 ( -0.813 0.000 3.322) 3.420 14.774 ( -4.899 0.000 -6.749) 8.340 16.239 ( -4.181 0.000 -0.372) 4.197 16.665 ( -2.952 0.000 3.095) 4.277 16.795 ( -10.634 0.000 -19.734) 22.417 19.104 ( -1.416 0.000 1.304) 1.925 19.162 ( 4.168 0.000 -3.248) 5.284 24.645 ( 4.578 0.000 -3.248) 5.613 24.968 ( 1.971 0.000 -30.248) 30.312 25.965 ( 0.149 0.000 3.231) 3.234 26.407 ( -9.326 0.000 4.596) 10.397 26.639 ( -0.574 0.000 4.134) 4.174 26.667 ( -6.458 0.000 -11.640) 13.311 27.387 ( -6.464 0.000 -8.607) 10.764 27.479 ( -2.330 0.000 -1.254) 2.646 27.480 ( -3.941 0.000 -4.303) 5.835 27.911 ( 21.336 0.000 32.067) 38.517 27.964 ( 0.678 0.000 6.228) 6.265 30.437 ( -6.454 0.000 69.082) 69.383 32.228 ( 0.877 0.000 -0.445) 0.984 33.625 ( -2.950 0.000 -39.230) 39.340 ======================= Grid point 2 (3/150) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.617 ( 32.993 0.000 -3.411) 33.169 1.785 ( 39.069 0.000 8.528) 39.989 2.513 ( 55.781 0.000 11.582) 56.971 2.647 ( -13.832 0.000 12.148) 18.409 2.671 ( 13.805 0.000 30.426) 33.412 3.210 ( 13.800 0.000 13.254) 19.134 3.554 ( 2.806 0.000 14.207) 14.482 3.841 ( 6.490 0.000 -10.336) 12.204 3.914 ( 3.729 0.000 -0.265) 3.738 4.259 ( -3.888 0.000 4.836) 6.205 4.313 ( -10.859 0.000 -7.211) 13.035 5.294 ( -11.582 0.000 11.788) 16.525 5.336 ( 1.690 0.000 0.060) 1.691 5.548 ( 1.615 0.000 -4.845) 5.107 5.684 ( 1.498 0.000 25.857) 25.900 6.025 ( 7.873 0.000 2.126) 8.155 6.141 ( -10.563 0.000 4.932) 11.657 6.378 ( 13.966 0.000 -6.847) 15.554 6.485 ( -0.178 0.000 6.825) 6.827 6.770 ( 9.075 0.000 -12.030) 15.069 6.933 ( 3.450 0.000 16.865) 17.214 7.332 ( -4.649 0.000 -1.664) 4.938 7.669 ( 8.853 0.000 -2.571) 9.219 7.911 ( -4.800 0.000 -4.322) 6.459 8.174 ( -3.457 0.000 -1.780) 3.888 9.221 ( 0.730 0.000 -31.078) 31.087 9.386 ( -8.721 0.000 1.983) 8.944 9.568 ( -7.309 0.000 7.045) 10.151 9.636 ( -2.947 0.000 2.352) 3.771 10.216 ( -12.173 0.000 28.485) 30.977 10.546 ( -3.335 0.000 1.678) 3.733 10.667 ( 1.759 0.000 3.595) 4.002 10.835 ( 1.736 0.000 3.715) 4.100 11.351 ( -10.776 0.000 -3.900) 11.460 11.821 ( -4.446 0.000 -3.186) 5.470 12.195 ( -4.514 0.000 3.000) 5.420 12.463 ( 1.031 0.000 -9.179) 9.237 12.604 ( 9.398 0.000 -12.639) 15.750 12.717 ( 5.311 0.000 -2.698) 5.957 13.391 ( -5.738 0.000 -3.832) 6.900 13.667 ( 2.775 0.000 -3.168) 4.212 13.939 ( 4.989 0.000 -1.792) 5.302 14.180 ( 10.857 0.000 -7.470) 13.179 14.315 ( 5.812 0.000 2.126) 6.189 14.620 ( 0.121 0.000 3.356) 3.358 14.622 ( -8.319 0.000 -12.326) 14.871 14.755 ( 0.957 0.000 4.013) 4.126 16.133 ( -6.282 0.000 0.111) 6.283 16.478 ( -18.924 0.000 0.925) 18.946 16.587 ( -5.932 0.000 4.370) 7.368 19.072 ( -2.164 0.000 2.244) 3.118 19.242 ( 4.373 0.000 -3.838) 5.818 24.765 ( 8.887 0.000 -6.518) 11.021 24.937 ( -0.396 0.000 -14.806) 14.811 25.970 ( -1.078 0.000 7.428) 7.506 26.189 ( -11.808 0.000 1.057) 11.855 26.573 ( -2.448 0.000 -6.065) 6.541 26.645 ( 0.522 0.000 5.661) 5.686 27.233 ( -6.728 0.000 -9.418) 11.574 27.363 ( -6.827 0.000 -6.501) 9.427 27.411 ( -4.248 0.000 -2.540) 4.950 27.957 ( -3.126 0.000 6.362) 7.089 28.436 ( 25.470 0.000 23.939) 34.955 30.460 ( -1.895 0.000 33.282) 33.336 32.247 ( 1.087 0.000 -0.577) 1.230 33.439 ( -9.785 0.000 -18.116) 20.590 ======================= Grid point 3 (4/150) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.978 ( 3.760 0.000 15.389) 15.842 2.365 ( 11.703 0.000 11.600) 16.478 2.707 ( 19.363 0.000 -10.183) 21.877 2.823 ( 7.869 0.000 21.646) 23.032 3.353 ( 25.407 0.000 15.644) 29.837 3.592 ( -2.329 0.000 13.951) 14.144 3.801 ( 37.167 0.000 1.924) 37.217 3.925 ( -1.909 0.000 -1.556) 2.463 4.015 ( 16.020 0.000 -11.602) 19.780 4.067 ( -11.887 0.000 -6.481) 13.539 4.194 ( -1.263 0.000 5.886) 6.020 5.115 ( -9.924 0.000 16.986) 19.672 5.370 ( 2.709 0.000 4.364) 5.137 5.613 ( 5.847 0.000 -1.847) 6.131 5.803 ( 0.934 0.000 29.394) 29.409 5.954 ( -5.921 0.000 -1.077) 6.019 6.236 ( 11.153 0.000 3.554) 11.705 6.484 ( 0.428 0.000 -0.529) 0.680 6.637 ( 12.624 0.000 -0.924) 12.658 6.823 ( 0.361 0.000 0.457) 0.582 7.053 ( 4.163 0.000 11.148) 11.900 7.247 ( -4.097 0.000 2.294) 4.696 7.816 ( 6.427 0.000 -2.750) 6.990 7.849 ( -0.994 0.000 0.883) 1.329 8.078 ( -5.386 0.000 -7.320) 9.088 9.087 ( -11.898 0.000 -4.556) 12.741 9.203 ( -9.735 0.000 0.209) 9.738 9.487 ( -0.455 0.000 -1.617) 1.680 9.557 ( -5.364 0.000 0.231) 5.369 10.030 ( -10.567 0.000 8.310) 13.444 10.408 ( -10.675 0.000 0.835) 10.707 10.659 ( 2.492 0.000 2.276) 3.375 11.049 ( 12.215 0.000 10.518) 16.119 11.156 ( -8.283 0.000 -4.653) 9.500 11.723 ( -4.828 0.000 -3.324) 5.862 12.117 ( -3.956 0.000 -0.471) 3.984 12.400 ( -3.311 0.000 -9.556) 10.113 12.747 ( -1.755 0.000 -7.620) 7.819 12.819 ( 13.279 0.000 -13.855) 19.191 13.283 ( -3.004 0.000 -5.157) 5.968 13.736 ( 4.345 0.000 0.386) 4.362 14.009 ( 2.286 0.000 -0.417) 2.324 14.343 ( -5.372 0.000 4.945) 7.301 14.377 ( 6.291 0.000 -13.355) 14.763 14.516 ( 5.818 0.000 -5.686) 8.135 14.604 ( -2.191 0.000 4.323) 4.846 14.808 ( 3.495 0.000 1.068) 3.654 16.015 ( -5.523 0.000 0.990) 5.611 16.113 ( -18.748 0.000 7.576) 20.221 16.456 ( -8.219 0.000 3.676) 9.004 19.034 ( -2.123 0.000 2.517) 3.293 19.302 ( 2.354 0.000 -2.762) 3.629 24.897 ( -1.109 0.000 -9.376) 9.441 24.956 ( 12.378 0.000 -9.792) 15.783 25.939 ( -4.440 0.000 12.372) 13.145 25.994 ( -8.299 0.000 0.533) 8.316 26.526 ( -1.750 0.000 -2.041) 2.688 26.694 ( 3.682 0.000 3.993) 5.431 27.106 ( -4.611 0.000 -6.398) 7.886 27.204 ( -7.819 0.000 -7.260) 10.670 27.311 ( -5.266 0.000 -3.424) 6.282 27.868 ( -6.963 0.000 4.517) 8.300 28.949 ( 22.595 0.000 18.324) 29.092 30.495 ( -0.145 0.000 19.882) 19.883 32.264 ( 0.739 0.000 -0.416) 0.848 33.198 ( -11.572 0.000 -10.652) 15.728 ======================= Grid point 4 (5/150) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 ( 4.889 0.000 7.131) 8.646 2.285 ( -13.725 0.000 17.416) 22.174 3.084 ( 16.536 0.000 -5.985) 17.586 3.189 ( 19.761 0.000 8.193) 21.392 3.512 ( -8.539 0.000 11.848) 14.605 3.649 ( 6.295 0.000 6.623) 9.137 3.832 ( -3.418 0.000 -15.041) 15.425 3.914 ( -3.845 0.000 3.830) 5.427 3.985 ( -4.967 0.000 -0.539) 4.996 4.347 ( 17.953 0.000 -11.266) 21.195 4.686 ( 33.939 0.000 0.258) 33.940 4.983 ( -6.337 0.000 18.389) 19.451 5.467 ( 5.277 0.000 8.067) 9.640 5.729 ( -6.646 0.000 2.018) 6.946 5.748 ( 7.045 0.000 2.932) 7.630 5.959 ( -0.175 0.000 15.269) 15.270 6.438 ( 7.899 0.000 2.802) 8.381 6.508 ( 2.801 0.000 -1.100) 3.009 6.842 ( 7.400 0.000 -0.475) 7.415 6.858 ( 3.087 0.000 5.542) 6.344 7.122 ( 1.566 0.000 10.525) 10.641 7.185 ( -2.857 0.000 4.384) 5.233 7.841 ( -2.463 0.000 1.975) 3.157 7.915 ( 5.622 0.000 -2.744) 6.255 7.961 ( -2.971 0.000 -10.509) 10.921 8.775 ( -19.064 0.000 3.563) 19.395 9.036 ( -6.986 0.000 -0.280) 6.992 9.440 ( -5.947 0.000 -0.768) 5.996 9.530 ( 4.238 0.000 -3.313) 5.380 9.857 ( -8.161 0.000 1.660) 8.328 10.215 ( -8.427 0.000 0.692) 8.456 10.752 ( 5.541 0.000 2.728) 6.176 11.019 ( -4.884 0.000 -4.194) 6.438 11.272 ( 8.513 0.000 12.334) 14.987 11.630 ( -3.910 0.000 -2.753) 4.782 12.004 ( -8.443 0.000 -6.242) 10.500 12.325 ( -2.454 0.000 -7.179) 7.587 12.688 ( 0.177 0.000 -8.466) 8.468 13.030 ( 10.746 0.000 -11.449) 15.702 13.244 ( -1.233 0.000 -4.536) 4.701 13.821 ( 3.881 0.000 1.623) 4.207 14.023 ( -0.683 0.000 0.178) 0.706 14.153 ( -9.183 0.000 -2.651) 9.558 14.487 ( 4.896 0.000 -5.581) 7.424 14.568 ( -2.052 0.000 3.742) 4.268 14.675 ( 8.169 0.000 0.839) 8.212 14.876 ( 3.081 0.000 -0.241) 3.090 15.817 ( -12.970 0.000 7.780) 15.125 15.939 ( -2.413 0.000 1.501) 2.842 16.296 ( -8.570 0.000 1.870) 8.772 19.003 ( -1.516 0.000 1.976) 2.491 19.325 ( 0.621 0.000 -1.446) 1.574 24.860 ( -1.035 0.000 -5.706) 5.799 25.194 ( 14.339 0.000 -12.926) 19.305 25.842 ( -8.610 0.000 15.931) 18.108 25.870 ( -4.786 0.000 0.756) 4.845 26.498 ( -0.937 0.000 -0.005) 0.938 26.796 ( 5.757 0.000 1.319) 5.906 27.033 ( -2.002 0.000 -2.367) 3.100 27.049 ( -6.338 0.000 -5.996) 8.725 27.205 ( -4.607 0.000 -3.327) 5.683 27.722 ( -8.252 0.000 2.462) 8.612 29.358 ( 15.999 0.000 11.869) 19.921 30.528 ( 0.139 0.000 11.221) 11.222 32.273 ( 0.319 0.000 -0.189) 0.371 32.974 ( -9.244 0.000 -6.214) 11.139 ======================= Grid point 5 (6/150) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.088 ( -7.023 0.000 7.441) 10.232 2.175 ( 4.623 0.000 0.155) 4.626 3.262 ( 4.002 0.000 -0.405) 4.022 3.360 ( -7.030 0.000 6.202) 9.375 3.508 ( 10.812 0.000 2.823) 11.174 3.709 ( 0.129 0.000 2.940) 2.943 3.819 ( 3.336 0.000 -13.498) 13.904 3.869 ( -2.275 0.000 6.398) 6.790 3.871 ( -5.048 0.000 -2.095) 5.466 4.627 ( 12.793 0.000 -13.243) 18.412 4.818 ( -8.235 0.000 14.853) 16.983 5.242 ( 14.765 0.000 0.063) 14.766 5.528 ( -1.238 0.000 5.970) 6.097 5.698 ( 3.852 0.000 -4.643) 6.033 5.852 ( 2.420 0.000 2.144) 3.233 5.938 ( -3.504 0.000 8.052) 8.781 6.533 ( 1.907 0.000 1.427) 2.382 6.599 ( 6.035 0.000 -2.410) 6.498 6.871 ( -3.819 0.000 3.313) 5.055 6.937 ( 2.855 0.000 2.284) 3.656 7.165 ( -0.005 0.000 1.184) 1.184 7.174 ( 1.426 0.000 6.781) 6.929 7.751 ( -3.804 0.000 -2.525) 4.566 7.940 ( 0.358 0.000 -3.327) 3.346 8.080 ( 12.731 0.000 -2.977) 13.074 8.405 ( -18.800 0.000 3.475) 19.119 8.945 ( -2.395 0.000 0.126) 2.398 9.347 ( -2.784 0.000 -0.778) 2.890 9.618 ( 4.907 0.000 -0.458) 4.929 9.726 ( -5.633 0.000 -0.197) 5.637 10.105 ( -2.939 0.000 0.305) 2.955 10.845 ( 2.717 0.000 1.519) 3.113 10.951 ( -1.582 0.000 -1.737) 2.349 11.452 ( 7.937 0.000 9.629) 12.478 11.570 ( -1.588 0.000 -1.165) 1.970 11.777 ( -10.975 0.000 -8.515) 13.891 12.282 ( -0.830 0.000 -2.629) 2.757 12.734 ( 3.551 0.000 -2.914) 4.593 13.166 ( 4.392 0.000 -4.655) 6.400 13.200 ( -1.957 0.000 -2.433) 3.122 13.880 ( 1.702 0.000 0.974) 1.961 13.999 ( -1.233 0.000 0.183) 1.246 14.022 ( -3.561 0.000 -0.506) 3.597 14.542 ( 1.596 0.000 -1.929) 2.504 14.545 ( -0.764 0.000 1.408) 1.602 14.794 ( 3.358 0.000 0.677) 3.426 14.918 ( 1.178 0.000 -0.208) 1.196 15.658 ( -4.503 0.000 3.248) 5.552 15.927 ( 0.368 0.000 0.913) 0.985 16.160 ( -4.649 0.000 0.280) 4.657 18.985 ( -0.551 0.000 0.749) 0.930 19.327 ( 0.022 0.000 -0.425) 0.425 24.838 ( -0.420 0.000 -1.971) 2.015 25.444 ( 14.055 0.000 -15.262) 20.748 25.674 ( -11.954 0.000 16.580) 20.440 25.810 ( -1.583 0.000 0.373) 1.627 26.488 ( -0.196 0.000 0.334) 0.387 26.890 ( 3.001 0.000 -0.141) 3.004 26.952 ( -2.498 0.000 -2.426) 3.483 27.011 ( -0.448 0.000 -0.228) 0.503 27.140 ( -1.321 0.000 -1.237) 1.809 27.592 ( -4.474 0.000 0.720) 4.532 29.592 ( 5.995 0.000 4.167) 7.301 30.544 ( -0.067 0.000 3.687) 3.687 32.277 ( 0.074 0.000 -0.045) 0.086 32.837 ( -3.560 0.000 -2.138) 4.153 ======================= Grid point 11 (7/150) ======================= q-point: ( 0.00 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.565 ( 0.000 29.897 0.000) 29.897 0.922 ( 0.000 48.872 0.000) 48.872 1.431 ( 0.000 74.359 0.000) 74.359 1.854 ( 0.000 -11.334 0.000) 11.334 3.090 ( 0.000 5.460 0.000) 5.460 3.185 ( 0.000 -26.983 0.000) 26.983 3.408 ( 0.000 -2.309 0.000) 2.309 3.440 ( 0.000 1.087 0.000) 1.087 3.858 ( 0.000 3.808 0.000) 3.808 4.298 ( 0.000 -2.875 0.000) 2.875 4.564 ( 0.000 -0.589 0.000) 0.589 5.096 ( 0.000 -14.462 0.000) 14.462 5.545 ( 0.000 1.876 0.000) 1.876 5.556 ( 0.000 -9.350 0.000) 9.350 5.653 ( 0.000 -6.482 0.000) 6.482 6.025 ( 0.000 6.181 0.000) 6.181 6.050 ( 0.000 -3.291 0.000) 3.291 6.345 ( 0.000 -18.501 0.000) 18.501 6.392 ( 0.000 4.548 0.000) 4.548 6.440 ( 0.000 4.380 0.000) 4.380 6.698 ( 0.000 2.242 0.000) 2.242 7.031 ( 0.000 -4.249 0.000) 4.249 7.557 ( 0.000 10.789 0.000) 10.789 7.956 ( 0.000 17.507 0.000) 17.507 8.108 ( 0.000 1.338 0.000) 1.338 9.041 ( 0.000 -16.315 0.000) 16.315 9.395 ( 0.000 -4.304 0.000) 4.304 9.643 ( 0.000 -5.288 0.000) 5.288 9.738 ( 0.000 12.196 0.000) 12.196 9.857 ( 0.000 12.791 0.000) 12.791 10.633 ( 0.000 -3.639 0.000) 3.639 10.646 ( 0.000 -8.669 0.000) 8.669 11.038 ( 0.000 2.802 0.000) 2.802 11.548 ( 0.000 -12.882 0.000) 12.882 11.971 ( 0.000 4.566 0.000) 4.566 12.216 ( 0.000 1.027 0.000) 1.027 12.278 ( 0.000 -3.618 0.000) 3.618 12.320 ( 0.000 -6.389 0.000) 6.389 12.943 ( 0.000 21.449 0.000) 21.449 13.419 ( 0.000 -0.921 0.000) 0.921 13.510 ( 0.000 2.289 0.000) 2.289 13.747 ( 0.000 -1.527 0.000) 1.527 14.096 ( 0.000 3.550 0.000) 3.550 14.597 ( 0.000 3.098 0.000) 3.098 14.669 ( 0.000 -9.074 0.000) 9.074 14.806 ( 0.000 -1.948 0.000) 1.948 16.168 ( 0.000 3.479 0.000) 3.479 16.562 ( 0.000 -8.664 0.000) 8.664 16.880 ( 0.000 7.319 0.000) 7.319 17.204 ( 0.000 -3.280 0.000) 3.280 19.121 ( 0.000 0.361 0.000) 0.361 19.124 ( 0.000 0.332 0.000) 0.332 24.628 ( 0.000 1.652 0.000) 1.652 24.765 ( 0.000 -1.705 0.000) 1.705 26.505 ( 0.000 1.986 0.000) 1.986 26.631 ( 0.000 -1.133 0.000) 1.133 26.766 ( 0.000 0.361 0.000) 0.361 26.794 ( 0.000 -0.349 0.000) 0.349 27.466 ( 0.000 -0.267 0.000) 0.267 27.495 ( 0.000 -0.861 0.000) 0.861 27.543 ( 0.000 1.518 0.000) 1.518 27.675 ( 0.000 -2.000 0.000) 2.000 27.949 ( 0.000 0.791 0.000) 0.791 27.974 ( 0.000 0.031 0.000) 0.031 33.327 ( 0.000 1.480 0.000) 1.480 33.445 ( 0.000 -1.426 0.000) 1.426 ======================= Grid point 12 (8/150) ======================= q-point: ( 0.09 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.948 ( 17.812 32.114 -0.628) 36.728 1.185 ( 40.121 15.033 38.105) 57.338 1.983 ( 41.619 49.963 -8.968) 65.642 2.118 ( 22.153 -7.900 24.845) 34.212 2.912 ( -15.491 -9.823 20.102) 27.213 3.163 ( -8.018 2.118 5.824) 10.134 3.393 ( 9.540 -15.137 -6.574) 19.062 3.566 ( 1.947 1.550 8.650) 9.001 3.903 ( 6.241 1.858 -3.037) 7.185 4.270 ( -3.050 -4.009 0.666) 5.081 4.532 ( -2.133 3.894 -5.677) 7.207 5.110 ( -0.283 -14.071 2.880) 14.365 5.492 ( -2.539 -2.429 -1.736) 3.919 5.553 ( 1.413 0.741 7.088) 7.266 5.678 ( -0.006 -2.824 5.023) 5.763 5.968 ( -3.276 -1.138 -4.253) 5.488 6.026 ( 0.241 -5.608 -2.518) 6.152 6.385 ( 3.282 -1.032 7.733) 8.464 6.496 ( 11.110 -1.594 -7.440) 13.466 6.529 ( 1.916 5.129 6.454) 8.463 6.746 ( 4.144 -0.952 8.786) 9.761 7.353 ( 10.122 -13.893 -11.302) 20.572 7.640 ( 7.104 10.292 -4.316) 13.229 8.016 ( 1.432 5.415 3.570) 6.642 8.093 ( 2.729 -2.678 -0.670) 3.881 8.996 ( 1.151 -22.228 -30.393) 37.671 9.376 ( -2.251 -4.841 0.788) 5.397 9.624 ( -2.606 -5.768 1.573) 6.521 9.700 ( -2.666 6.329 3.318) 7.627 10.000 ( 2.624 0.881 39.824) 39.920 10.581 ( 0.404 -2.998 -2.567) 3.967 10.652 ( -2.309 -1.867 11.050) 11.442 10.973 ( -6.624 2.805 0.591) 7.218 11.461 ( -7.912 -10.381 -1.270) 13.114 11.938 ( -3.169 4.146 -2.246) 5.681 12.233 ( 0.315 -7.182 -1.857) 7.425 12.315 ( 5.054 0.667 -4.301) 6.670 12.383 ( 5.385 -4.762 -7.186) 10.165 12.962 ( 2.548 19.801 -3.084) 20.201 13.396 ( -2.353 -3.259 -0.483) 4.049 13.534 ( 2.603 2.827 -0.413) 3.865 13.834 ( 7.859 -0.342 -1.846) 8.080 14.129 ( 3.775 2.444 -5.072) 6.779 14.603 ( -1.007 -0.628 3.776) 3.958 14.650 ( 0.028 -5.654 -10.242) 11.699 14.772 ( -2.992 -1.265 -3.552) 4.813 15.615 ( -54.277 58.440 12.951) 80.802 16.353 ( -14.120 14.157 0.016) 19.995 16.522 ( -5.103 -10.106 0.911) 11.358 16.890 ( -12.426 4.336 -10.723) 16.976 19.118 ( -0.420 1.322 -4.411) 4.624 19.165 ( 4.168 0.157 -5.001) 6.512 24.661 ( 4.356 1.754 -3.565) 5.896 24.868 ( 6.234 -6.448 -15.583) 17.980 26.183 ( -17.245 14.565 -3.445) 22.834 26.417 ( -10.705 0.843 4.659) 11.705 26.637 ( -0.875 -0.159 1.790) 1.999 26.664 ( -5.569 -0.412 -11.042) 12.374 27.380 ( -6.856 -0.594 -7.510) 10.186 27.424 ( -5.535 -2.446 -4.524) 7.555 27.551 ( 0.047 4.257 -1.052) 4.385 27.837 ( 8.287 -4.925 11.830) 15.260 28.075 ( 15.701 8.707 20.534) 27.276 29.316 ( 53.775 -58.884 35.857) 87.434 32.845 ( -24.633 28.061 10.468) 38.779 33.525 ( -1.495 -8.141 -23.574) 24.985 ======================= Grid point 13 (9/150) ======================= q-point: ( 0.18 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.523 ( 36.344 3.475 -8.117) 37.401 1.964 ( 30.249 11.297 23.835) 40.134 2.545 ( -0.927 1.542 19.945) 20.026 2.611 ( 12.318 -4.336 29.975) 32.696 2.832 ( 19.239 2.173 12.387) 22.985 3.181 ( 17.815 8.336 5.629) 20.458 3.506 ( 2.321 -19.422 -1.595) 19.625 3.678 ( 10.517 7.649 4.454) 13.746 4.021 ( 5.377 2.030 -1.069) 5.846 4.188 ( -5.184 -3.507 1.680) 6.480 4.472 ( -2.766 12.046 -5.565) 13.555 5.062 ( -5.435 -9.256 8.206) 13.511 5.472 ( 1.702 -3.218 -4.298) 5.633 5.651 ( 0.654 9.551 -2.274) 9.840 5.689 ( 5.713 1.932 23.265) 24.034 5.970 ( 3.227 -4.827 -2.041) 6.155 6.008 ( -1.836 -9.836 -3.213) 10.510 6.483 ( 5.142 4.916 7.705) 10.486 6.561 ( 0.449 7.615 4.937) 9.086 6.670 ( 7.184 -5.864 -3.420) 9.884 6.885 ( 7.268 -2.549 11.702) 14.009 7.330 ( -6.437 -3.685 -2.285) 7.762 7.767 ( 7.526 9.997 -4.109) 13.170 7.961 ( -3.233 5.031 -3.278) 6.820 8.153 ( -0.414 -1.869 -0.163) 1.921 8.988 ( 1.836 -25.721 -20.239) 32.781 9.306 ( -4.839 -3.626 -1.233) 6.172 9.527 ( -7.292 -5.385 2.044) 9.292 9.657 ( -3.352 2.958 5.201) 6.859 9.990 ( -8.479 -10.031 23.814) 27.196 10.606 ( -1.642 3.408 3.627) 5.241 10.715 ( 5.565 3.438 4.389) 7.877 10.832 ( -2.790 0.203 1.992) 3.434 11.282 ( -9.372 -7.074 -2.095) 11.927 11.849 ( -5.078 3.112 -3.919) 7.129 12.204 ( -2.215 -6.327 -1.671) 6.909 12.405 ( 1.267 -1.750 -7.694) 7.991 12.471 ( 7.704 -1.368 -9.080) 11.986 13.031 ( 4.929 17.775 -4.564) 19.002 13.346 ( -3.329 -3.580 -2.029) 5.293 13.564 ( 1.044 -1.362 0.237) 1.732 13.992 ( 7.632 4.160 -4.126) 9.621 14.218 ( 6.328 -2.042 -4.318) 7.929 14.517 ( -6.448 -6.562 -5.684) 10.814 14.659 ( -1.409 1.577 -0.224) 2.127 14.706 ( 1.449 3.287 -16.121) 16.517 14.962 ( -18.009 43.758 16.916) 50.252 16.178 ( -7.844 4.095 -1.606) 8.993 16.352 ( -13.937 -9.053 7.181) 18.104 16.630 ( -12.013 0.517 2.031) 12.194 19.093 ( -1.461 2.265 -1.426) 3.049 19.237 ( 3.886 -0.768 -5.114) 6.469 24.778 ( 8.591 1.290 -6.827) 11.049 24.911 ( 2.029 -2.447 -12.983) 13.366 26.007 ( -5.343 3.568 6.713) 9.292 26.178 ( -12.497 -1.179 2.102) 12.728 26.581 ( -2.047 0.811 -4.685) 5.176 26.640 ( 0.286 -0.605 4.124) 4.178 27.221 ( -7.077 -1.070 -8.552) 11.151 27.289 ( -6.902 -3.906 -6.791) 10.441 27.515 ( -3.320 7.060 -2.618) 8.229 27.897 ( -1.714 -5.495 5.078) 7.676 28.560 ( 25.366 12.351 22.581) 36.137 29.998 ( 17.705 -37.849 26.570) 49.518 32.542 ( -9.842 22.769 2.109) 24.894 33.365 ( -9.740 -7.466 -14.026) 18.637 ======================= Grid point 14 (10/150) ======================= q-point: ( 0.27 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.059 ( 8.130 8.779 11.306) 16.462 2.312 ( 10.563 -4.240 8.430) 14.164 2.609 ( 7.813 -8.554 5.283) 12.733 2.809 ( 14.661 0.900 16.917) 22.404 3.211 ( 12.454 -19.637 9.597) 25.156 3.453 ( 1.750 -12.270 9.259) 15.471 3.807 ( 16.791 4.216 4.455) 17.876 3.904 ( 9.483 7.179 -1.111) 11.945 4.111 ( 8.594 2.960 -2.325) 9.382 4.188 ( 9.670 3.810 7.506) 12.821 4.424 ( 1.523 23.857 -8.711) 25.443 4.966 ( -6.060 -5.097 13.794) 15.905 5.542 ( 5.652 1.224 -2.378) 6.253 5.662 ( 2.078 7.208 3.993) 8.498 5.839 ( -2.318 4.742 16.980) 17.781 5.928 ( 1.103 -1.611 2.041) 2.824 6.094 ( 7.358 -10.099 0.695) 12.515 6.572 ( 0.325 5.840 4.658) 7.477 6.600 ( 4.904 -4.698 4.572) 8.187 6.789 ( 6.122 -1.162 4.231) 7.532 7.027 ( 4.615 -2.654 8.869) 10.344 7.200 ( -5.832 -4.550 1.975) 7.656 7.878 ( 2.843 7.333 -2.030) 8.122 7.930 ( 1.364 6.388 -0.638) 6.563 8.102 ( -2.946 2.491 -6.039) 7.166 8.921 ( -7.021 -17.288 -4.688) 19.239 9.186 ( -7.791 -1.730 -1.306) 8.087 9.401 ( -4.149 -9.137 -0.690) 10.059 9.577 ( -5.610 2.381 2.682) 6.659 9.847 ( -8.641 -11.123 7.368) 15.895 10.523 ( -7.338 8.498 -0.514) 11.240 10.709 ( 2.168 4.939 2.019) 5.759 11.025 ( 11.398 -2.917 9.544) 15.150 11.113 ( -7.023 -4.112 -2.701) 8.575 11.741 ( -4.747 2.522 -4.242) 6.848 12.169 ( -0.498 -3.232 -2.986) 4.428 12.340 ( -5.047 1.016 -8.205) 9.686 12.598 ( 5.678 -4.847 -9.482) 12.068 13.086 ( 0.887 14.899 -9.811) 17.862 13.260 ( -3.019 -1.913 -2.469) 4.344 13.619 ( 4.450 -6.299 1.761) 7.911 14.088 ( 3.532 7.567 -4.637) 9.552 14.243 ( -6.587 -10.429 -6.118) 13.769 14.466 ( 6.137 -1.069 -4.072) 7.442 14.610 ( -1.485 4.915 -1.609) 5.381 14.753 ( 3.688 11.628 -13.893) 18.489 14.812 ( -3.877 12.969 18.931) 23.273 15.988 ( -13.575 -7.019 4.305) 15.877 16.097 ( -10.026 2.537 5.887) 11.900 16.437 ( -9.298 -2.608 2.831) 10.063 19.061 ( -1.627 2.899 0.326) 3.341 19.284 ( 1.871 -1.993 -3.534) 4.468 24.911 ( 0.679 1.411 -9.547) 9.675 24.958 ( 11.578 0.179 -9.830) 15.189 25.929 ( -5.478 -0.908 11.131) 12.439 25.975 ( -9.054 -1.891 2.885) 9.689 26.543 ( -1.347 1.774 -1.274) 2.567 26.678 ( 3.063 -1.646 3.392) 4.857 27.089 ( -4.967 -1.541 -6.061) 7.987 27.144 ( -6.156 -3.298 -6.997) 9.886 27.419 ( -5.767 8.207 -3.519) 10.631 27.824 ( -6.307 -4.477 3.154) 8.353 29.069 ( 22.280 12.379 17.879) 31.134 30.270 ( 7.722 -21.423 18.309) 29.220 32.416 ( -4.348 13.981 -0.101) 14.642 33.130 ( -11.501 -7.070 -8.889) 16.164 ======================= Grid point 15 (11/150) ======================= q-point: ( 0.36 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.086 ( -0.586 3.480 11.335) 11.871 2.314 ( -7.550 3.049 11.781) 14.321 2.989 ( 21.803 -13.339 -3.884) 25.853 3.129 ( 11.501 -1.688 8.063) 14.147 3.311 ( 2.262 -13.465 0.976) 13.689 3.519 ( 2.477 -13.727 -3.193) 14.309 3.888 ( -1.640 10.727 5.044) 11.967 3.929 ( -0.352 4.569 5.279) 6.991 4.267 ( -2.455 13.453 -4.673) 14.451 4.438 ( 17.523 4.799 -5.310) 18.929 4.680 ( 13.916 3.108 1.916) 14.387 4.926 ( 1.403 -2.176 15.328) 15.545 5.643 ( 2.109 10.636 5.355) 12.093 5.718 ( 0.044 -0.702 -1.984) 2.105 5.764 ( 2.919 4.208 3.269) 6.076 6.011 ( 1.374 6.062 16.525) 17.656 6.251 ( 9.203 -13.235 -2.236) 16.275 6.593 ( 0.729 3.160 2.964) 4.393 6.684 ( 2.456 -9.894 6.027) 11.843 6.925 ( 5.533 -0.334 5.280) 7.656 7.098 ( 1.264 -2.917 3.989) 5.101 7.139 ( -0.284 -2.868 7.588) 8.117 7.891 ( -0.216 4.100 0.195) 4.110 7.933 ( -2.654 5.375 -2.953) 6.683 8.078 ( 3.139 8.633 -7.225) 11.687 8.703 ( -14.631 -7.555 2.471) 16.651 9.023 ( -7.311 -1.138 -0.394) 7.409 9.370 ( -0.498 -14.367 -0.935) 14.406 9.474 ( -4.346 1.580 -0.521) 4.654 9.705 ( -6.398 -8.550 0.463) 10.689 10.400 ( -4.377 13.507 -1.059) 14.238 10.793 ( 4.841 3.850 2.268) 6.588 10.986 ( -4.554 -3.287 -3.310) 6.519 11.219 ( 4.926 -5.757 9.494) 12.147 11.673 ( -0.677 5.349 -2.325) 5.871 12.128 ( -6.962 10.730 -4.283) 13.489 12.245 ( 0.215 -7.577 -6.390) 9.914 12.629 ( 0.763 -4.710 -8.776) 9.989 13.077 ( 2.214 3.134 -11.118) 11.761 13.215 ( -3.094 -2.862 -1.134) 4.365 13.720 ( 5.071 -6.123 0.998) 8.012 14.070 ( -7.117 -8.226 -5.296) 12.099 14.125 ( 0.659 9.774 -2.087) 10.016 14.583 ( -0.228 1.830 1.796) 2.574 14.609 ( 5.577 0.383 -3.192) 6.438 14.771 ( 1.022 17.958 3.357) 18.298 14.841 ( 2.513 -3.602 0.232) 4.398 15.739 ( -11.467 -7.973 7.363) 15.788 15.983 ( -3.633 4.202 2.220) 5.981 16.270 ( -8.341 -2.852 1.643) 8.967 19.034 ( -1.226 3.309 0.804) 3.619 19.299 ( 0.358 -2.810 -1.820) 3.367 24.902 ( 0.103 4.320 -6.118) 7.490 25.177 ( 13.052 -1.975 -12.405) 18.115 25.814 ( -9.042 -2.411 13.692) 16.585 25.849 ( -4.805 -2.247 3.038) 6.113 26.524 ( -0.538 2.755 0.163) 2.812 26.762 ( 4.489 -3.417 1.089) 5.746 27.005 ( -2.649 -1.365 -3.709) 4.757 27.044 ( -2.659 -0.810 -3.407) 4.397 27.292 ( -6.164 7.595 -3.547) 10.405 27.685 ( -7.902 -3.900 1.449) 8.930 29.468 ( 15.519 11.443 11.681) 22.544 30.406 ( 3.688 -12.527 11.015) 17.084 32.355 ( -2.137 8.154 -0.442) 8.441 32.910 ( -9.114 -6.548 -5.396) 12.452 ======================= Grid point 16 (12/150) ======================= q-point: ( 0.45 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.122 ( 2.142 1.185 5.411) 5.939 2.204 ( -4.682 4.222 1.907) 6.587 3.185 ( 0.404 -11.499 5.555) 12.777 3.253 ( 3.099 -0.451 -0.263) 3.142 3.452 ( 7.372 -6.295 -2.089) 9.916 3.528 ( 0.311 -13.099 -4.309) 13.794 3.880 ( -0.206 11.158 2.664) 11.474 3.969 ( 3.073 9.829 6.318) 12.082 4.184 ( -3.487 18.137 -8.692) 20.413 4.675 ( 7.555 3.037 -11.740) 14.287 4.753 ( -1.538 -7.705 12.993) 15.184 5.032 ( 2.292 -16.116 5.377) 17.144 5.626 ( -0.585 10.551 4.241) 11.387 5.789 ( 1.733 -1.256 -3.996) 4.533 5.842 ( 4.172 7.906 1.835) 9.126 6.044 ( -0.088 8.041 6.939) 10.621 6.449 ( 11.101 -7.935 -2.004) 13.792 6.595 ( -1.769 -0.497 0.675) 1.958 6.688 ( -3.257 -11.472 4.648) 12.799 6.983 ( 0.675 -12.127 1.635) 12.255 7.119 ( 1.026 7.040 -0.393) 7.125 7.196 ( 1.851 1.787 7.857) 8.267 7.867 ( -0.526 3.468 -5.052) 6.150 7.888 ( -1.408 3.219 1.330) 3.757 8.180 ( 8.818 7.292 -4.533) 12.308 8.410 ( -14.950 1.034 3.690) 15.434 8.931 ( -2.252 -1.310 -0.080) 2.606 9.336 ( -1.886 -6.901 -0.380) 7.165 9.435 ( -0.388 -10.479 0.100) 10.486 9.621 ( -2.040 -5.058 -0.713) 5.501 10.350 ( -0.981 17.441 -0.492) 17.475 10.872 ( 2.279 2.259 1.054) 3.378 10.923 ( -1.402 -2.692 -1.429) 3.354 11.263 ( -0.380 -12.086 3.021) 12.464 11.735 ( 6.834 11.631 3.326) 13.894 11.923 ( -10.828 13.076 -6.004) 18.008 12.263 ( 0.802 -2.216 -2.009) 3.097 12.656 ( 2.785 -8.116 -3.572) 9.295 13.102 ( 0.491 -6.082 -6.615) 8.999 13.139 ( -2.558 -5.563 1.441) 6.290 13.796 ( 2.235 -5.447 0.128) 5.889 13.969 ( -2.380 -5.263 -1.405) 5.944 14.125 ( -0.224 11.829 -0.490) 11.841 14.569 ( -0.614 3.116 0.763) 3.267 14.677 ( 1.553 3.421 -1.089) 3.912 14.814 ( 1.768 9.120 2.474) 9.614 14.876 ( 1.034 -4.299 -1.087) 4.553 15.600 ( -3.938 -6.329 3.101) 8.074 15.953 ( -0.260 2.694 0.962) 2.873 16.142 ( -4.267 -1.972 0.316) 4.712 19.019 ( -0.457 3.501 0.379) 3.551 19.298 ( -0.051 -3.147 -0.531) 3.192 24.894 ( -0.021 5.905 -2.155) 6.286 25.395 ( 11.068 -5.742 -12.157) 17.415 25.655 ( -9.511 -0.900 12.899) 16.052 25.789 ( -1.716 -2.390 1.064) 3.129 26.520 ( -0.058 3.326 0.243) 3.335 26.820 ( 1.113 -5.304 -0.644) 5.458 26.987 ( 1.261 1.607 -0.811) 2.198 27.019 ( -0.605 0.514 -0.237) 0.828 27.191 ( -2.899 5.593 -1.721) 6.530 27.557 ( -4.360 -3.649 0.293) 5.693 29.695 ( 5.760 10.574 4.114) 12.725 30.464 ( 1.021 -8.416 3.714) 9.255 32.328 ( -0.671 5.305 -0.191) 5.350 32.777 ( -3.509 -6.177 -1.899) 7.354 ======================= Grid point 22 (13/150) ======================= q-point: ( 0.00 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.093 ( 0.000 26.770 0.000) 26.770 1.539 ( 0.000 -20.957 0.000) 20.957 1.790 ( 0.000 44.416 0.000) 44.416 2.502 ( 0.000 -16.168 0.000) 16.168 2.790 ( 0.000 37.393 0.000) 37.393 3.207 ( 0.000 5.597 0.000) 5.597 3.347 ( 0.000 -4.206 0.000) 4.206 3.416 ( 0.000 -7.707 0.000) 7.707 3.876 ( 0.000 1.245 0.000) 1.245 4.104 ( 0.000 -20.418 0.000) 20.418 4.582 ( 0.000 3.038 0.000) 3.038 4.731 ( 0.000 -16.349 0.000) 16.349 5.472 ( 0.000 0.130 0.000) 0.130 5.530 ( 0.000 -5.313 0.000) 5.313 5.635 ( 0.000 7.429 0.000) 7.429 5.835 ( 0.000 -14.160 0.000) 14.160 6.121 ( 0.000 3.750 0.000) 3.750 6.171 ( 0.000 -2.577 0.000) 2.577 6.498 ( 0.000 3.683 0.000) 3.683 6.510 ( 0.000 2.198 0.000) 2.198 6.776 ( 0.000 6.218 0.000) 6.218 6.912 ( 0.000 -7.764 0.000) 7.764 7.797 ( 0.000 13.557 0.000) 13.557 8.002 ( 0.000 -7.358 0.000) 7.358 8.358 ( 0.000 19.111 0.000) 19.111 8.710 ( 0.000 -18.785 0.000) 18.785 9.391 ( 0.000 3.925 0.000) 3.925 9.512 ( 0.000 -7.921 0.000) 7.921 9.963 ( 0.000 11.109 0.000) 11.109 10.051 ( 0.000 4.654 0.000) 4.654 10.491 ( 0.000 -4.690 0.000) 4.690 10.534 ( 0.000 -6.323 0.000) 6.323 11.123 ( 0.000 6.748 0.000) 6.748 11.299 ( 0.000 -12.269 0.000) 12.269 12.070 ( 0.000 5.683 0.000) 5.683 12.175 ( 0.000 -5.656 0.000) 5.656 12.241 ( 0.000 1.565 0.000) 1.565 12.272 ( 0.000 -1.696 0.000) 1.696 13.265 ( 0.000 11.573 0.000) 11.573 13.385 ( 0.000 -3.097 0.000) 3.097 13.586 ( 0.000 6.011 0.000) 6.011 13.694 ( 0.000 -4.498 0.000) 4.498 14.216 ( 0.000 9.899 0.000) 9.899 14.447 ( 0.000 -13.763 0.000) 13.763 14.671 ( 0.000 4.470 0.000) 4.470 14.750 ( 0.000 -3.871 0.000) 3.871 16.262 ( 0.000 6.543 0.000) 6.543 16.402 ( 0.000 -8.372 0.000) 8.372 17.009 ( 0.000 6.590 0.000) 6.590 17.121 ( 0.000 -5.432 0.000) 5.432 19.127 ( 0.000 0.280 0.000) 0.280 19.129 ( 0.000 0.142 0.000) 0.142 24.670 ( 0.000 2.707 0.000) 2.707 24.722 ( 0.000 -2.740 0.000) 2.740 26.552 ( 0.000 2.780 0.000) 2.780 26.600 ( 0.000 -2.243 0.000) 2.243 26.775 ( 0.000 0.559 0.000) 0.559 26.786 ( 0.000 -0.556 0.000) 0.556 27.465 ( 0.000 0.268 0.000) 0.268 27.477 ( 0.000 -0.907 0.000) 0.907 27.580 ( 0.000 2.412 0.000) 2.412 27.629 ( 0.000 -2.725 0.000) 2.725 27.964 ( 0.000 0.691 0.000) 0.691 27.972 ( 0.000 -0.232 0.000) 0.232 33.364 ( 0.000 2.366 0.000) 2.366 33.409 ( 0.000 -2.333 0.000) 2.333 ======================= Grid point 23 (14/150) ======================= q-point: ( 0.09 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( 30.587 19.556 29.272) 46.635 1.728 ( -1.728 44.036 10.969) 45.415 1.847 ( 25.063 -17.324 25.924) 40.004 2.480 ( -5.302 -33.553 13.470) 36.543 2.887 ( 3.369 31.388 6.336) 32.198 3.128 ( -6.726 -5.029 5.118) 9.835 3.306 ( 6.047 12.545 2.212) 14.101 3.618 ( 11.894 -5.048 4.455) 13.667 3.890 ( 3.104 2.720 -3.320) 5.297 4.109 ( 0.643 -14.477 -5.356) 15.449 4.622 ( 4.633 6.186 -6.034) 9.805 4.807 ( 7.039 -15.262 -3.705) 17.211 5.468 ( -2.038 1.868 4.107) 4.951 5.556 ( 2.407 -4.883 4.910) 7.332 5.635 ( 2.498 2.659 -2.319) 4.323 5.760 ( -4.147 -10.680 -6.140) 12.999 6.109 ( -1.416 6.853 3.631) 7.883 6.240 ( 5.313 -7.676 5.060) 10.619 6.621 ( 7.306 4.895 3.467) 9.453 6.627 ( 9.625 4.784 4.217) 11.546 6.801 ( 1.891 7.678 2.224) 8.214 7.043 ( 11.169 -16.460 -5.185) 20.556 7.842 ( 4.760 11.371 -0.304) 12.331 8.020 ( 2.120 -6.778 0.175) 7.104 8.273 ( -7.251 17.670 -1.301) 19.144 8.616 ( -7.210 -19.270 -7.211) 21.801 9.371 ( -2.160 3.813 -1.081) 4.513 9.490 ( -2.570 -7.887 -0.073) 8.295 9.873 ( -6.861 10.426 3.475) 12.955 10.018 ( -7.104 -3.350 15.337) 17.231 10.542 ( 6.623 0.675 2.791) 7.219 10.596 ( 3.515 -3.660 7.462) 9.024 11.059 ( -6.375 6.940 -0.118) 9.425 11.238 ( -5.826 -12.008 -0.562) 13.359 12.027 ( -3.905 5.006 -1.498) 6.524 12.118 ( -3.458 -5.112 -1.329) 6.313 12.321 ( 6.229 0.296 -5.906) 8.589 12.336 ( 6.507 -1.400 -6.565) 9.349 13.240 ( -1.117 9.127 -1.474) 9.313 13.341 ( -3.339 -3.321 -0.377) 4.724 13.655 ( 4.888 9.178 -0.796) 10.429 13.795 ( 8.810 -4.674 -1.654) 10.110 14.220 ( 1.034 8.117 -4.431) 9.305 14.424 ( -1.998 -12.695 -3.833) 13.411 14.672 ( 0.515 3.202 -2.407) 4.039 14.731 ( -1.554 -2.913 -2.417) 4.091 16.131 ( -16.283 12.864 6.961) 21.888 16.332 ( -8.242 -10.224 2.381) 13.346 16.688 ( -25.531 15.891 7.238) 30.931 16.884 ( -17.917 -5.433 0.531) 18.730 19.144 ( 1.739 1.296 -8.107) 8.392 19.162 ( 3.517 -0.552 -7.546) 8.344 24.707 ( 4.318 3.051 -4.620) 7.021 24.773 ( 5.045 -4.151 -7.320) 9.812 26.370 ( -19.838 5.860 0.732) 20.698 26.424 ( -14.937 -0.649 4.294) 15.556 26.638 ( -1.649 0.412 -4.090) 4.429 26.651 ( -3.661 -0.866 -9.155) 9.898 27.374 ( -7.409 0.222 -6.336) 9.751 27.389 ( -6.937 -1.350 -5.846) 9.171 27.639 ( 2.793 5.189 0.490) 5.913 27.739 ( 4.787 -5.555 3.698) 8.213 28.273 ( 26.703 13.126 20.455) 36.108 28.600 ( 42.053 -24.287 21.925) 53.282 33.183 ( -13.942 12.243 2.727) 18.754 33.369 ( -5.782 -8.759 -7.813) 13.085 ======================= Grid point 24 (15/150) ======================= q-point: ( 0.18 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.846 ( 15.930 28.465 0.773) 32.628 2.181 ( 25.377 12.132 28.675) 40.168 2.405 ( 2.841 -16.317 25.558) 30.455 2.422 ( 17.155 -22.161 14.718) 31.655 2.798 ( -8.193 8.857 20.788) 24.036 3.056 ( -1.290 -18.044 9.170) 20.281 3.627 ( 21.044 20.872 5.035) 30.064 3.844 ( 10.626 3.346 4.474) 12.006 3.988 ( 6.690 -0.784 -0.602) 6.763 4.105 ( 0.243 -6.534 -1.303) 6.667 4.727 ( 7.824 14.479 -10.611) 19.582 4.936 ( 6.051 -7.056 -4.330) 10.254 5.431 ( -0.459 2.380 0.091) 2.425 5.622 ( -0.042 -12.879 5.768) 14.111 5.708 ( 5.837 -1.046 0.754) 5.978 5.746 ( 5.146 -5.512 -7.654) 10.745 6.119 ( 1.368 12.542 8.691) 15.321 6.350 ( 4.421 -12.050 7.118) 14.677 6.700 ( 1.640 7.304 9.632) 12.198 6.811 ( -0.063 -0.775 8.188) 8.225 6.856 ( 7.788 12.687 2.060) 15.028 7.154 ( -0.373 -14.489 -1.803) 14.606 7.957 ( 6.359 8.370 -3.055) 10.946 8.063 ( 0.615 -0.993 -4.363) 4.517 8.162 ( -1.976 10.675 2.095) 11.057 8.499 ( -1.391 -23.284 -6.231) 24.143 9.298 ( -5.166 2.985 -1.138) 6.074 9.402 ( -6.650 -7.226 0.141) 9.822 9.748 ( -6.918 6.386 5.486) 10.897 9.867 ( -10.080 -5.982 11.306) 16.285 10.672 ( 3.244 3.786 4.941) 7.019 10.733 ( 10.171 -2.123 6.676) 12.350 10.908 ( -7.659 8.775 -0.500) 11.658 11.105 ( -6.637 -11.234 -0.422) 13.055 11.928 ( -5.439 5.220 -3.982) 8.526 12.045 ( -3.480 -7.806 -4.145) 9.498 12.428 ( 5.133 1.596 -7.859) 9.522 12.451 ( 6.537 -1.041 -9.037) 11.202 13.236 ( 0.496 4.561 0.261) 4.595 13.288 ( -2.124 -2.542 0.572) 3.362 13.702 ( 0.082 14.490 -3.940) 15.016 13.958 ( 6.657 -9.942 -3.783) 12.549 14.238 ( 1.605 5.525 -5.319) 7.836 14.370 ( -1.062 -8.093 -7.393) 11.013 14.681 ( 0.084 0.954 -1.548) 1.820 14.700 ( 0.186 -1.121 -4.606) 4.744 15.691 ( -25.165 29.438 11.642) 40.440 16.080 ( -17.578 -14.707 6.922) 23.941 16.372 ( -10.643 10.154 3.281) 15.071 16.560 ( -14.006 -8.043 2.416) 16.331 19.149 ( 0.356 3.491 -6.513) 7.398 19.207 ( 2.463 -2.497 -7.235) 8.040 24.811 ( 7.583 2.297 -7.893) 11.184 24.860 ( 5.503 -2.852 -9.979) 11.747 26.081 ( -11.195 3.949 5.472) 13.072 26.143 ( -13.190 -2.659 3.990) 14.034 26.601 ( -1.185 1.216 -1.799) 2.473 26.623 ( -0.334 -1.120 1.174) 1.656 27.210 ( -7.419 0.243 -7.795) 10.764 27.233 ( -7.188 -2.168 -7.793) 10.821 27.649 ( -1.707 7.239 -0.930) 7.495 27.780 ( -1.039 -6.848 1.873) 7.175 28.867 ( 27.706 20.837 20.961) 40.511 29.341 ( 28.807 -30.830 21.534) 47.372 32.917 ( -12.949 17.063 -0.363) 21.423 33.182 ( -11.012 -12.018 -6.547) 17.566 ======================= Grid point 25 (16/150) ======================= q-point: ( 0.27 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.262 ( 22.337 7.727 -3.111) 23.839 2.341 ( -7.529 13.799 19.534) 25.073 2.423 ( 1.378 -9.908 13.965) 17.178 2.733 ( 9.196 -22.614 7.669) 25.589 2.948 ( 15.441 7.590 9.801) 19.801 3.179 ( 9.987 -15.170 8.566) 20.081 3.938 ( 6.899 7.995 7.737) 13.091 4.029 ( 3.852 0.986 1.304) 4.184 4.140 ( 11.928 2.636 7.118) 14.138 4.201 ( 10.064 -2.282 13.604) 17.075 4.864 ( 7.264 19.410 -12.500) 24.202 4.986 ( -0.909 3.731 0.369) 3.858 5.502 ( 8.579 -1.788 -2.779) 9.193 5.613 ( 0.808 -10.647 -2.078) 10.878 5.825 ( 5.016 -0.826 1.043) 5.190 5.874 ( 7.758 -5.856 -0.062) 9.721 6.181 ( 1.944 14.775 13.080) 19.828 6.429 ( 1.797 -11.767 10.344) 15.770 6.706 ( -3.510 8.132 8.489) 12.269 6.812 ( 0.659 -0.251 10.567) 10.590 6.982 ( 4.024 0.541 5.653) 6.960 7.085 ( -3.978 -7.556 2.182) 8.814 8.032 ( 1.542 4.272 -2.722) 5.295 8.040 ( -0.877 5.487 -3.561) 6.600 8.189 ( 3.499 10.230 -1.473) 10.911 8.519 ( 1.969 -22.696 -2.993) 22.977 9.170 ( -7.767 1.233 -0.154) 7.865 9.245 ( -8.834 -6.574 0.957) 11.053 9.629 ( -6.180 3.343 1.784) 7.249 9.706 ( -7.665 -5.236 3.186) 9.814 10.688 ( -2.915 9.007 -0.626) 9.488 10.794 ( 0.066 0.978 -0.224) 1.005 10.956 ( 5.940 -1.679 7.210) 9.491 11.021 ( -0.590 -5.527 2.421) 6.063 11.825 ( -3.301 6.593 -5.256) 9.054 11.987 ( -0.483 -10.826 -6.160) 12.465 12.454 ( -0.894 6.257 -7.258) 9.624 12.536 ( 3.508 -3.104 -9.115) 10.248 13.231 ( -4.614 0.345 -1.834) 4.977 13.234 ( -1.846 -0.098 1.953) 2.689 13.680 ( 0.335 13.024 -6.102) 14.387 13.970 ( -3.569 -15.892 -7.911) 18.107 14.272 ( 3.404 8.704 -3.909) 10.131 14.405 ( 5.240 -5.286 -3.861) 8.385 14.668 ( -0.413 2.737 -0.984) 2.937 14.724 ( 2.020 -3.241 -2.596) 4.618 15.334 ( -13.838 27.691 9.751) 32.456 15.754 ( -16.245 -17.586 9.404) 25.721 16.204 ( -7.845 7.636 2.571) 11.246 16.347 ( -9.379 -6.988 2.023) 11.869 19.136 ( -0.532 4.917 -3.352) 5.975 19.226 ( 0.743 -4.277 -4.569) 6.302 24.940 ( 4.944 1.429 -9.845) 11.109 24.958 ( 9.083 -0.417 -9.916) 13.454 25.918 ( -8.005 0.076 9.059) 12.090 25.937 ( -9.630 -1.819 6.673) 11.856 26.586 ( -0.166 2.704 0.380) 2.736 26.637 ( 1.520 -2.656 2.035) 3.675 27.073 ( -5.014 0.277 -6.236) 8.007 27.097 ( -5.081 -2.038 -6.709) 8.659 27.574 ( -5.464 8.223 -2.121) 10.098 27.715 ( -5.528 -6.931 0.336) 8.872 29.383 ( 21.336 20.904 17.029) 34.383 29.817 ( 17.408 -25.306 16.879) 35.047 32.697 ( -9.569 15.080 -1.585) 17.930 32.950 ( -11.222 -11.990 -5.070) 17.187 ======================= Grid point 26 (17/150) ======================= q-point: ( 0.36 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.197 ( -6.834 8.461 15.075) 18.589 2.342 ( -6.089 -3.512 9.843) 12.095 2.788 ( 22.334 -1.065 -1.839) 22.435 2.974 ( 16.837 -16.579 -6.131) 24.412 3.199 ( 8.132 5.125 2.019) 9.822 3.333 ( 4.366 -8.516 -0.421) 9.579 4.027 ( 3.657 5.909 4.098) 8.067 4.055 ( 0.674 4.105 2.980) 5.117 4.393 ( 8.380 1.789 9.376) 12.702 4.433 ( 10.834 -2.095 7.969) 13.611 4.843 ( -7.615 9.113 -2.246) 12.086 4.921 ( -7.256 -0.024 3.363) 7.998 5.694 ( 9.491 -0.331 -5.523) 10.986 5.710 ( 9.135 -0.250 0.378) 9.146 5.915 ( 3.672 6.414 4.353) 8.578 6.027 ( 9.454 -8.403 -1.468) 12.734 6.216 ( -1.121 14.352 13.196) 19.529 6.468 ( 0.248 -12.148 10.012) 15.744 6.659 ( -2.142 4.327 4.534) 6.624 6.805 ( -4.075 -10.264 6.279) 12.703 7.076 ( 6.589 1.056 4.672) 8.146 7.105 ( 4.467 -1.583 7.059) 8.503 7.990 ( -4.176 5.422 -3.047) 7.491 8.030 ( -1.511 2.288 -1.194) 2.990 8.261 ( 4.175 11.855 -3.384) 13.016 8.506 ( -3.122 -13.200 0.234) 13.567 9.014 ( -7.397 1.072 0.114) 7.475 9.109 ( -4.928 -10.278 0.979) 11.441 9.520 ( -4.987 2.996 -1.108) 5.923 9.589 ( -4.703 -4.705 -1.151) 6.751 10.639 ( -0.934 11.880 -1.773) 12.048 10.814 ( 1.172 -5.397 -1.538) 5.733 10.962 ( -1.500 4.086 2.109) 4.836 11.086 ( 0.767 -7.767 5.209) 9.384 11.821 ( 4.436 10.187 -2.367) 11.360 12.033 ( 6.344 -12.045 -3.885) 14.157 12.369 ( -6.428 11.613 -5.070) 14.209 12.534 ( -1.815 -6.237 -8.006) 10.309 13.108 ( -6.028 0.910 -5.682) 8.334 13.149 ( -7.063 -3.669 0.468) 7.973 13.713 ( 3.427 5.661 -3.714) 7.588 13.881 ( -2.568 -10.957 -5.905) 12.709 14.332 ( 2.960 11.238 -2.225) 11.832 14.510 ( 5.327 -7.570 -1.363) 9.356 14.660 ( -0.445 4.486 0.290) 4.517 14.754 ( 1.265 -5.326 -0.107) 5.475 15.172 ( -5.384 21.827 5.525) 23.150 15.523 ( -9.281 -15.526 7.108) 19.436 16.081 ( -5.210 5.991 2.012) 8.190 16.191 ( -7.137 -5.502 1.555) 9.145 19.119 ( -0.690 5.555 -1.291) 5.744 19.223 ( -0.168 -5.201 -2.202) 5.651 25.005 ( 3.604 6.334 -7.659) 10.572 25.114 ( 8.879 -4.885 -10.350) 14.485 25.781 ( -8.151 -0.504 10.324) 13.163 25.801 ( -5.923 -2.343 6.195) 8.885 26.593 ( 0.627 4.514 0.459) 4.581 26.682 ( 2.372 -4.866 0.734) 5.463 27.001 ( -1.270 0.723 -3.099) 3.426 27.022 ( -1.438 -1.354 -2.895) 3.505 27.444 ( -6.968 8.279 -2.591) 11.127 27.585 ( -7.355 -6.719 -0.685) 9.985 29.752 ( 13.797 18.258 11.232) 25.493 30.105 ( 9.799 -18.812 10.908) 23.851 32.542 ( -6.060 11.280 -1.553) 12.899 32.748 ( -8.348 -10.465 -3.480) 13.831 ======================= Grid point 27 (18/150) ======================= q-point: ( 0.45 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.155 ( 0.081 3.544 5.154) 6.256 2.234 ( -5.372 -2.883 4.253) 7.434 3.105 ( 10.505 4.059 -0.642) 11.280 3.255 ( 3.938 -6.579 -1.751) 7.865 3.284 ( 6.938 -1.224 -3.835) 8.021 3.370 ( -0.206 -6.453 -0.951) 6.526 4.078 ( 1.166 9.724 2.354) 10.072 4.151 ( 7.272 5.630 3.802) 9.951 4.481 ( 1.712 11.388 -12.003) 16.634 4.590 ( -0.250 -4.447 11.720) 12.538 4.653 ( -6.752 -5.007 -0.146) 8.407 4.770 ( -5.815 -11.510 6.088) 14.260 5.808 ( 2.446 3.504 -1.985) 4.712 5.846 ( 4.148 4.930 0.417) 6.456 5.965 ( 0.802 11.305 1.644) 11.452 6.206 ( 1.227 4.359 3.035) 5.452 6.262 ( 9.987 -7.277 1.347) 12.431 6.457 ( -3.952 -13.530 4.996) 14.955 6.620 ( -2.197 4.181 1.129) 4.856 6.753 ( -1.130 -10.163 1.536) 10.341 7.215 ( 5.594 2.568 0.172) 6.157 7.229 ( 4.379 1.058 6.786) 8.146 7.891 ( -3.704 3.874 -1.916) 5.692 7.961 ( -4.189 -1.431 -0.762) 4.492 8.334 ( 3.614 9.042 -2.621) 10.084 8.433 ( -3.553 -0.536 1.690) 3.970 8.919 ( -2.289 1.446 -0.043) 2.708 9.053 ( -1.334 -13.757 0.512) 13.831 9.443 ( -2.279 3.673 -0.855) 4.406 9.525 ( -1.549 -5.052 -0.904) 5.360 10.635 ( 0.304 12.709 -0.837) 12.740 10.817 ( -0.337 -7.151 -1.034) 7.233 10.952 ( 0.120 4.743 0.823) 4.816 11.070 ( -1.482 -8.354 1.266) 8.578 11.971 ( 10.033 13.068 2.107) 16.610 12.175 ( 4.857 -5.770 -0.701) 7.575 12.195 ( -8.426 12.945 -3.029) 15.739 12.457 ( -3.732 -12.805 -4.631) 14.119 13.002 ( -4.225 -2.915 -2.524) 5.720 13.028 ( -2.898 -5.109 -0.674) 5.912 13.764 ( 1.735 2.220 -1.191) 3.059 13.853 ( -0.113 -6.482 -1.765) 6.719 14.368 ( 1.016 13.204 -0.801) 13.267 14.582 ( 2.015 -9.392 -0.692) 9.630 14.652 ( -0.302 5.726 0.660) 5.772 14.770 ( 0.347 -6.539 0.543) 6.571 15.122 ( -1.088 18.247 1.601) 18.350 15.420 ( -2.733 -13.212 2.590) 13.738 16.017 ( -1.622 3.940 0.830) 4.341 16.089 ( -3.141 -3.596 0.518) 4.803 19.107 ( -0.302 5.753 -0.295) 5.769 19.215 ( -0.182 -5.504 -0.619) 5.542 25.044 ( 1.387 9.881 -3.035) 10.430 25.238 ( 4.743 -10.351 -5.854) 12.803 25.669 ( -4.431 2.339 5.957) 7.784 25.728 ( -2.275 -3.701 2.545) 5.035 26.604 ( 0.297 5.506 0.009) 5.514 26.714 ( 0.706 -6.080 -0.322) 6.130 27.008 ( 1.600 0.861 -0.189) 1.827 27.020 ( 0.601 -0.360 -0.117) 0.710 27.324 ( -4.000 7.886 -1.516) 8.971 27.461 ( -4.196 -6.580 -0.640) 7.830 29.951 ( 4.922 16.020 3.971) 17.223 30.245 ( 3.210 -14.732 3.812) 15.552 32.460 ( -2.116 8.614 -0.640) 8.893 32.629 ( -3.144 -9.152 -1.302) 9.764 ======================= Grid point 55 (19/150) ======================= q-point: ( 0.00 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.783 ( -18.726 0.000 38.122) 42.473 0.821 ( -34.511 0.000 41.043) 53.624 1.450 ( 28.698 0.000 68.485) 74.255 2.261 ( 21.465 0.000 24.791) 32.792 2.979 ( 3.025 0.000 -10.939) 11.350 3.179 ( 25.381 0.000 -12.671) 28.368 3.523 ( 8.201 0.000 9.257) 12.368 3.747 ( -12.051 0.000 17.216) 21.014 3.808 ( -3.224 0.000 4.556) 5.581 4.477 ( -2.674 0.000 -5.766) 6.356 4.630 ( 3.259 0.000 10.043) 10.559 5.166 ( 3.124 0.000 -4.299) 5.314 5.561 ( -4.957 0.000 2.744) 5.666 5.727 ( 2.641 0.000 -3.706) 4.551 5.775 ( 4.008 0.000 -10.548) 11.284 5.967 ( 18.257 0.000 -9.371) 20.522 6.065 ( -13.774 0.000 5.843) 14.962 6.095 ( -6.164 0.000 2.568) 6.677 6.513 ( 19.783 0.000 12.727) 23.523 6.631 ( 0.042 0.000 -2.117) 2.117 7.016 ( 0.419 0.000 22.978) 22.982 7.088 ( -23.147 0.000 -2.488) 23.281 7.467 ( -1.362 0.000 0.886) 1.625 7.742 ( 9.046 0.000 -0.725) 9.075 8.011 ( -4.120 0.000 -5.767) 7.088 8.262 ( 0.211 0.000 3.044) 3.051 9.549 ( 2.802 0.000 0.070) 2.803 9.653 ( 1.104 0.000 -5.816) 5.920 9.754 ( -0.123 0.000 7.474) 7.475 10.404 ( 3.762 0.000 -1.987) 4.255 10.700 ( -0.096 0.000 2.173) 2.175 10.951 ( 16.803 0.000 -2.331) 16.964 11.020 ( 0.938 0.000 0.954) 1.338 11.758 ( 2.709 0.000 -2.830) 3.918 11.956 ( 2.623 0.000 2.571) 3.672 12.253 ( 3.825 0.000 -4.348) 5.791 12.265 ( -8.569 0.000 6.096) 10.516 12.586 ( -1.925 0.000 1.978) 2.760 12.602 ( -8.609 0.000 -2.146) 8.873 13.411 ( 2.071 0.000 -1.412) 2.507 13.547 ( -7.404 0.000 -1.420) 7.539 13.729 ( -3.989 0.000 -3.001) 4.992 14.010 ( -8.379 0.000 -5.368) 9.951 14.163 ( -0.361 0.000 3.433) 3.451 14.670 ( 6.596 0.000 -7.896) 10.289 14.730 ( -5.630 0.000 -9.691) 11.207 15.701 ( 1.860 0.000 2.287) 2.948 16.196 ( 0.108 0.000 -7.955) 7.956 16.656 ( 3.773 0.000 -3.027) 4.837 17.460 ( -32.382 0.000 -11.376) 34.322 19.108 ( 1.456 0.000 -0.538) 1.553 19.219 ( -11.035 0.000 8.411) 13.875 24.646 ( -3.520 0.000 4.041) 5.359 25.191 ( -51.757 0.000 1.192) 51.771 25.929 ( 3.561 0.000 -2.724) 4.484 26.394 ( 7.115 0.000 -9.554) 11.913 26.627 ( 4.201 0.000 -1.033) 4.326 26.712 ( -11.854 0.000 -4.299) 12.610 27.397 ( 34.436 0.000 5.357) 34.851 27.458 ( -7.659 0.000 -0.762) 7.697 27.549 ( 22.741 0.000 4.984) 23.280 27.581 ( -4.530 0.000 5.664) 7.253 28.018 ( 6.820 0.000 8.410) 10.828 29.813 ( 62.940 0.000 -3.733) 63.051 32.257 ( -0.781 0.000 3.605) 3.688 33.624 ( -30.448 0.000 -7.872) 31.449 ======================= Grid point 56 (20/150) ======================= q-point: ( 0.09 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.784 ( 32.638 0.000 6.915) 33.362 0.941 ( 25.431 0.000 19.495) 32.044 2.293 ( 38.741 0.000 51.821) 64.701 2.806 ( 26.914 0.000 27.477) 38.462 3.082 ( 9.320 0.000 0.156) 9.321 3.401 ( -20.832 0.000 17.731) 27.356 3.585 ( 17.422 0.000 -5.210) 18.184 3.773 ( 8.300 0.000 12.725) 15.193 3.784 ( -0.607 0.000 5.569) 5.602 4.376 ( -6.696 0.000 -5.046) 8.385 4.570 ( -6.947 0.000 19.559) 20.756 5.197 ( 1.118 0.000 -5.562) 5.673 5.457 ( -5.161 0.000 -2.377) 5.682 5.796 ( 5.290 0.000 -10.584) 11.832 5.804 ( -9.701 0.000 16.963) 19.541 5.934 ( 13.090 0.000 -9.643) 16.259 6.055 ( 2.145 0.000 16.204) 16.345 6.295 ( 15.830 0.000 -8.543) 17.988 6.530 ( -8.674 0.000 6.791) 11.016 6.696 ( -1.155 0.000 12.174) 12.228 7.147 ( 6.582 0.000 19.712) 20.782 7.233 ( 11.675 0.000 -5.837) 13.053 7.491 ( 3.815 0.000 -0.637) 3.868 7.918 ( -4.091 0.000 -4.295) 5.932 8.190 ( 33.313 0.000 -24.825) 41.546 8.228 ( -3.813 0.000 -0.109) 3.815 9.547 ( -3.723 0.000 1.263) 3.932 9.638 ( -1.852 0.000 -5.301) 5.616 9.769 ( -0.125 0.000 7.293) 7.294 10.544 ( 9.442 0.000 0.723) 9.469 10.648 ( -3.190 0.000 2.013) 3.772 10.859 ( -20.138 0.000 -11.891) 23.387 10.969 ( -6.400 0.000 1.120) 6.498 11.614 ( -15.527 0.000 3.451) 15.906 11.958 ( -4.551 0.000 6.493) 7.929 12.224 ( 3.789 0.000 -1.931) 4.253 12.289 ( 0.054 0.000 -0.967) 0.969 12.415 ( -6.617 0.000 -5.760) 8.773 12.594 ( 2.317 0.000 -1.154) 2.589 13.412 ( -0.174 0.000 -4.246) 4.249 13.445 ( -2.256 0.000 -0.812) 2.397 13.808 ( 7.469 0.000 -2.867) 8.001 13.889 ( 1.236 0.000 -9.398) 9.479 14.207 ( 4.082 0.000 1.014) 4.206 14.580 ( -7.247 0.000 -11.636) 13.708 14.731 ( 0.405 0.000 -2.932) 2.960 15.397 ( -22.897 0.000 23.373) 32.719 16.149 ( -3.025 0.000 -8.198) 8.739 16.685 ( -0.615 0.000 -0.843) 1.043 16.792 ( -19.178 0.000 13.662) 23.547 19.124 ( 0.188 0.000 1.036) 1.053 19.177 ( 1.641 0.000 2.957) 3.382 24.624 ( 0.662 0.000 1.242) 1.407 24.773 ( -4.454 0.000 2.470) 5.094 25.998 ( 3.906 0.000 0.493) 3.937 26.389 ( -10.669 0.000 -12.004) 16.060 26.521 ( -0.504 0.000 3.119) 3.160 26.704 ( 3.443 0.000 2.131) 4.049 27.270 ( -9.863 0.000 -3.414) 10.438 27.379 ( -5.975 0.000 -5.355) 8.023 27.503 ( -5.017 0.000 2.862) 5.776 28.120 ( 1.344 0.000 9.686) 9.779 28.266 ( 28.213 0.000 10.713) 30.179 30.725 ( 18.986 0.000 -22.569) 29.493 32.256 ( -0.031 0.000 3.210) 3.211 33.191 ( -8.675 0.000 -3.184) 9.241 ======================= Grid point 57 (21/150) ======================= q-point: ( 0.18 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.591 ( 35.708 0.000 3.520) 35.881 1.612 ( 46.588 0.000 -12.984) 48.363 2.990 ( -24.081 0.000 19.274) 30.845 3.035 ( 25.823 0.000 21.957) 33.896 3.273 ( 13.218 0.000 27.350) 30.377 3.374 ( 23.273 0.000 3.483) 23.532 3.802 ( 4.366 0.000 4.376) 6.181 3.804 ( 1.637 0.000 11.166) 11.285 3.910 ( 3.127 0.000 3.818) 4.935 4.214 ( -8.373 0.000 -1.162) 8.454 4.482 ( -6.334 0.000 17.767) 18.862 5.214 ( 3.213 0.000 -8.905) 9.467 5.373 ( -2.677 0.000 -4.210) 4.989 5.718 ( -3.461 0.000 20.505) 20.795 5.864 ( 3.094 0.000 -13.558) 13.906 6.155 ( 10.954 0.000 -10.798) 15.381 6.199 ( 6.184 0.000 19.542) 20.497 6.375 ( -4.619 0.000 14.392) 15.115 6.558 ( 10.361 0.000 -7.717) 12.919 6.708 ( 0.464 0.000 9.820) 9.831 7.297 ( 4.445 0.000 18.187) 18.722 7.317 ( 0.395 0.000 1.068) 1.138 7.607 ( 7.726 0.000 -2.834) 8.230 7.848 ( -2.154 0.000 -3.618) 4.210 8.123 ( -6.745 0.000 -1.270) 6.864 8.687 ( 21.836 0.000 -20.806) 30.161 9.405 ( -10.524 0.000 0.018) 10.524 9.557 ( -5.499 0.000 -3.449) 6.491 9.752 ( -3.949 0.000 6.111) 7.276 10.366 ( -23.895 0.000 -11.523) 26.529 10.548 ( -2.578 0.000 -1.070) 2.791 10.748 ( -4.745 0.000 4.119) 6.284 10.900 ( 11.373 0.000 2.551) 11.655 11.313 ( -14.878 0.000 2.047) 15.018 11.855 ( -6.627 0.000 6.736) 9.449 12.245 ( -4.737 0.000 1.753) 5.051 12.284 ( -1.839 0.000 -7.828) 8.041 12.381 ( 8.218 0.000 -8.652) 11.932 12.625 ( 0.039 0.000 -7.090) 7.090 13.299 ( -8.608 0.000 -5.236) 10.075 13.475 ( 6.344 0.000 -8.284) 10.435 13.949 ( 6.970 0.000 -0.785) 7.014 14.018 ( 9.104 0.000 -8.932) 12.754 14.299 ( 4.775 0.000 -5.987) 7.658 14.451 ( -1.827 0.000 -0.735) 1.970 14.693 ( -3.116 0.000 0.667) 3.187 15.167 ( -7.914 0.000 24.336) 25.590 16.059 ( -4.310 0.000 -7.275) 8.455 16.525 ( -14.303 0.000 5.604) 15.361 16.626 ( -5.291 0.000 -0.058) 5.291 19.120 ( -1.024 0.000 2.715) 2.901 19.231 ( 2.962 0.000 1.352) 3.256 24.675 ( 4.708 0.000 -2.181) 5.188 24.746 ( -0.013 0.000 -4.534) 4.534 26.080 ( 3.862 0.000 4.030) 5.582 26.154 ( -10.003 0.000 -3.979) 10.765 26.538 ( 0.371 0.000 1.610) 1.652 26.762 ( 1.764 0.000 5.220) 5.510 27.099 ( -6.500 0.000 -4.005) 7.634 27.230 ( -7.764 0.000 -6.274) 9.982 27.394 ( -6.437 0.000 0.202) 6.440 28.102 ( -4.958 0.000 8.343) 9.705 28.779 ( 23.224 0.000 11.009) 25.701 30.780 ( -3.229 0.000 -2.765) 4.251 32.266 ( 0.408 0.000 2.555) 2.587 33.083 ( -4.224 0.000 -13.468) 14.114 ======================= Grid point 58 (22/150) ======================= q-point: ( 0.27 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.223 ( 22.674 0.000 5.981) 23.450 2.398 ( 34.377 0.000 -8.773) 35.479 2.637 ( -8.969 0.000 6.866) 11.295 3.225 ( -3.480 0.000 19.730) 20.035 3.620 ( 12.365 0.000 2.339) 12.584 3.764 ( -7.356 0.000 -2.483) 7.764 3.799 ( 19.603 0.000 0.997) 19.629 3.885 ( -6.399 0.000 4.449) 7.794 3.946 ( 9.514 0.000 9.917) 13.743 4.104 ( -3.466 0.000 8.222) 8.923 4.439 ( 1.499 0.000 17.466) 17.530 5.298 ( 6.922 0.000 -9.422) 11.691 5.320 ( -3.026 0.000 0.488) 3.065 5.746 ( 1.904 0.000 15.843) 15.957 5.818 ( -5.116 0.000 -10.881) 12.024 6.243 ( -1.538 0.000 10.571) 10.683 6.304 ( 6.996 0.000 -11.365) 13.346 6.496 ( 9.037 0.000 21.103) 22.957 6.687 ( 4.744 0.000 -9.040) 10.209 6.762 ( 3.424 0.000 6.396) 7.255 7.312 ( -0.902 0.000 3.790) 3.896 7.383 ( 0.540 0.000 15.935) 15.944 7.742 ( 6.314 0.000 -3.834) 7.387 7.814 ( -0.717 0.000 -7.174) 7.210 7.971 ( -8.146 0.000 -0.282) 8.151 8.929 ( 4.329 0.000 -10.125) 11.012 9.183 ( -11.071 0.000 -2.140) 11.275 9.437 ( -4.071 0.000 -2.940) 5.022 9.622 ( -9.594 0.000 4.180) 10.465 9.990 ( -12.181 0.000 -11.242) 16.576 10.447 ( -9.443 0.000 3.242) 9.984 10.677 ( 2.245 0.000 -0.562) 2.314 11.069 ( -10.074 0.000 -1.167) 10.142 11.218 ( 15.645 0.000 5.624) 16.625 11.742 ( -6.114 0.000 5.214) 8.035 12.115 ( -9.076 0.000 0.477) 9.089 12.230 ( -0.946 0.000 -6.587) 6.655 12.543 ( -4.632 0.000 -12.143) 12.997 12.578 ( 12.907 0.000 -9.525) 16.041 13.185 ( -1.904 0.000 -4.524) 4.909 13.591 ( 7.006 0.000 -8.871) 11.304 14.037 ( -3.600 0.000 -16.909) 17.288 14.060 ( 4.061 0.000 2.334) 4.684 14.408 ( 8.058 0.000 1.875) 8.274 14.547 ( 8.104 0.000 5.363) 9.718 14.636 ( -2.727 0.000 -0.091) 2.728 15.112 ( -3.533 0.000 20.481) 20.784 15.968 ( -3.462 0.000 -5.643) 6.621 16.239 ( -16.007 0.000 6.031) 17.105 16.487 ( -8.819 0.000 -0.233) 8.822 19.097 ( -1.940 0.000 3.795) 4.262 19.283 ( 2.086 0.000 0.249) 2.101 24.737 ( 0.296 0.000 -6.154) 6.161 24.793 ( 8.182 0.000 -6.023) 10.160 25.993 ( -6.472 0.000 -0.277) 6.478 26.148 ( 1.297 0.000 8.637) 8.734 26.538 ( -0.632 0.000 2.128) 2.220 26.801 ( 1.471 0.000 6.393) 6.560 27.012 ( -1.868 0.000 -3.149) 3.662 27.072 ( -6.904 0.000 -5.336) 8.726 27.262 ( -6.749 0.000 -2.097) 7.067 27.973 ( -9.470 0.000 6.047) 11.236 29.196 ( 17.688 0.000 6.125) 18.719 30.695 ( -4.623 0.000 -0.947) 4.719 32.278 ( 0.327 0.000 1.927) 1.954 32.949 ( -6.424 0.000 -12.298) 13.875 ======================= Grid point 59 (23/150) ======================= q-point: ( 0.36 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.224 ( -8.758 0.000 9.651) 13.032 2.708 ( -6.941 0.000 19.311) 20.520 2.946 ( 25.241 0.000 -6.368) 26.032 3.271 ( 10.964 0.000 1.728) 11.099 3.587 ( -7.968 0.000 -8.510) 11.658 3.715 ( -11.794 0.000 7.469) 13.960 3.768 ( 4.328 0.000 4.778) 6.447 4.006 ( -4.254 0.000 3.575) 5.557 4.080 ( -1.392 0.000 11.670) 11.753 4.117 ( 14.337 0.000 -8.839) 16.843 4.709 ( 20.468 0.000 1.577) 20.528 5.250 ( -4.899 0.000 7.162) 8.677 5.403 ( 4.723 0.000 -13.074) 13.901 5.670 ( -6.914 0.000 -3.509) 7.753 5.807 ( 1.067 0.000 2.606) 2.816 6.233 ( -2.163 0.000 7.718) 8.015 6.397 ( 5.464 0.000 -9.253) 10.746 6.648 ( -0.056 0.000 15.393) 15.393 6.742 ( 5.123 0.000 -12.584) 13.587 6.847 ( 3.718 0.000 0.316) 3.731 7.293 ( -2.546 0.000 4.715) 5.359 7.352 ( -6.686 0.000 5.344) 8.559 7.753 ( -4.387 0.000 -6.929) 8.201 7.841 ( 5.809 0.000 -4.161) 7.145 7.888 ( 1.456 0.000 2.287) 2.712 8.765 ( -15.979 0.000 -5.446) 16.881 9.003 ( -6.768 0.000 -3.063) 7.429 9.428 ( -2.779 0.000 -0.910) 2.924 9.511 ( 2.622 0.000 1.870) 3.220 9.800 ( -6.840 0.000 -6.145) 9.195 10.268 ( -8.627 0.000 4.580) 9.767 10.774 ( 5.955 0.000 -0.562) 5.982 10.930 ( -3.890 0.000 -2.556) 4.654 11.449 ( 6.297 0.000 2.650) 6.832 11.652 ( -3.944 0.000 4.678) 6.119 11.894 ( -12.273 0.000 -2.363) 12.498 12.231 ( 1.931 0.000 -1.710) 2.579 12.520 ( 5.934 0.000 -7.985) 9.948 12.823 ( 13.994 0.000 -8.876) 16.571 13.174 ( 0.742 0.000 -2.060) 2.190 13.694 ( 5.227 0.000 -9.250) 10.625 13.912 ( -4.677 0.000 -15.734) 16.414 14.110 ( 0.339 0.000 5.678) 5.688 14.564 ( 6.480 0.000 7.730) 10.087 14.584 ( -2.628 0.000 -1.348) 2.954 14.711 ( 6.952 0.000 2.619) 7.429 15.098 ( -1.962 0.000 17.266) 17.377 15.912 ( -1.238 0.000 -4.148) 4.329 15.954 ( -14.314 0.000 6.219) 15.607 16.302 ( -9.612 0.000 -0.882) 9.652 19.062 ( -2.390 0.000 3.872) 4.550 19.311 ( 0.926 0.000 -0.215) 0.951 24.739 ( 1.343 0.000 -5.885) 6.036 24.959 ( 10.507 0.000 -9.918) 14.449 25.895 ( -4.054 0.000 1.865) 4.463 26.140 ( -4.998 0.000 13.529) 14.423 26.525 ( -1.118 0.000 1.689) 2.025 26.860 ( 3.501 0.000 5.215) 6.281 26.962 ( -3.224 0.000 -2.196) 3.901 26.999 ( 0.374 0.000 -1.285) 1.338 27.145 ( -4.049 0.000 -3.100) 5.100 27.783 ( -10.623 0.000 3.595) 11.215 29.468 ( 9.447 0.000 -1.105) 9.511 30.599 ( -4.916 0.000 -4.531) 6.686 32.285 ( 0.055 0.000 1.433) 1.434 32.814 ( -4.554 0.000 -8.721) 9.839 ======================= Grid point 60 (24/150) ======================= q-point: ( 0.45 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.145 ( -0.688 0.000 -2.064) 2.175 2.452 ( -18.689 0.000 25.996) 32.017 3.275 ( 5.394 0.000 1.985) 5.748 3.436 ( -11.429 0.000 -1.697) 11.554 3.464 ( 5.060 0.000 -5.472) 7.453 3.572 ( 5.860 0.000 -5.727) 8.194 3.846 ( 2.319 0.000 7.277) 7.638 3.885 ( -7.198 0.000 4.743) 8.620 4.105 ( 1.381 0.000 13.874) 13.943 4.324 ( 9.844 0.000 -16.229) 18.981 5.003 ( 2.736 0.000 0.190) 2.742 5.198 ( 1.629 0.000 -1.016) 1.920 5.365 ( -4.392 0.000 -18.613) 19.124 5.596 ( -1.334 0.000 -3.022) 3.303 5.777 ( -2.673 0.000 -9.386) 9.759 6.162 ( -7.133 0.000 7.636) 10.449 6.498 ( 7.036 0.000 -7.616) 10.369 6.609 ( -4.194 0.000 5.810) 7.165 6.773 ( -0.176 0.000 -16.449) 16.450 6.854 ( -3.958 0.000 -3.859) 5.528 7.170 ( -10.051 0.000 -7.051) 12.277 7.227 ( -3.970 0.000 3.338) 5.186 7.707 ( 1.364 0.000 -1.355) 1.922 7.979 ( 5.254 0.000 6.174) 8.107 8.000 ( 12.132 0.000 -4.527) 12.949 8.426 ( -16.769 0.000 -1.520) 16.838 8.908 ( -2.243 0.000 -3.382) 4.058 9.365 ( -1.536 0.000 2.548) 2.975 9.608 ( 3.436 0.000 -3.882) 5.185 9.697 ( -2.136 0.000 1.107) 2.406 10.153 ( -4.040 0.000 4.085) 5.745 10.844 ( 0.441 0.000 -1.543) 1.605 10.902 ( 1.137 0.000 -2.220) 2.494 11.421 ( -8.380 0.000 -12.229) 14.825 11.619 ( -0.383 0.000 5.578) 5.591 11.783 ( 3.195 0.000 8.494) 9.075 12.291 ( 3.846 0.000 3.238) 5.027 12.686 ( 9.481 0.000 -2.180) 9.728 13.064 ( 11.903 0.000 -5.313) 13.035 13.203 ( 2.609 0.000 2.577) 3.668 13.745 ( 1.912 0.000 -9.976) 10.158 13.821 ( -0.813 0.000 -14.729) 14.751 14.105 ( -1.746 0.000 7.981) 8.170 14.531 ( -2.333 0.000 -2.003) 3.075 14.682 ( 3.630 0.000 11.304) 11.872 14.801 ( 1.790 0.000 0.319) 1.818 15.101 ( -1.298 0.000 15.087) 15.143 15.727 ( -9.892 0.000 3.631) 10.537 15.893 ( -0.568 0.000 -4.301) 4.338 16.147 ( -5.021 0.000 -1.397) 5.211 19.024 ( -2.168 0.000 3.025) 3.721 19.325 ( 0.689 0.000 0.007) 0.689 24.771 ( 3.099 0.000 -4.344) 5.336 25.149 ( 11.353 0.000 -13.384) 17.551 25.841 ( -2.032 0.000 2.827) 3.481 26.004 ( -11.914 0.000 15.602) 19.631 26.507 ( -0.836 0.000 1.166) 1.434 26.938 ( 2.420 0.000 4.292) 4.927 26.948 ( 1.812 0.000 1.947) 2.660 26.998 ( 0.062 0.000 -0.947) 0.949 27.120 ( 1.436 0.000 -0.581) 1.549 27.614 ( -6.151 0.000 1.784) 6.404 29.540 ( -1.191 0.000 -9.200) 9.277 30.483 ( -5.672 0.000 -9.771) 11.298 32.287 ( -0.081 0.000 1.111) 1.114 32.762 ( 1.018 0.000 -4.907) 5.011 ======================= Grid point 61 (25/150) ======================= q-point: (-0.45 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.118 ( -3.672 0.000 -5.217) 6.380 2.199 ( -10.662 0.000 17.288) 20.312 3.198 ( -9.315 0.000 -6.405) 11.304 3.312 ( 1.577 0.000 1.669) 2.296 3.379 ( -12.798 0.000 -7.640) 14.905 3.734 ( -8.350 0.000 3.455) 9.037 3.761 ( 9.788 0.000 -1.673) 9.930 3.929 ( 3.559 0.000 2.147) 4.157 4.166 ( 0.555 0.000 17.010) 17.019 4.438 ( 5.719 0.000 -22.064) 22.793 4.843 ( -14.854 0.000 7.553) 16.664 5.152 ( -10.822 0.000 -9.687) 14.524 5.240 ( -3.442 0.000 -22.131) 22.397 5.515 ( -6.185 0.000 -11.938) 13.445 5.719 ( -0.871 0.000 -9.066) 9.108 6.011 ( -8.227 0.000 3.735) 9.035 6.540 ( -3.723 0.000 2.054) 4.251 6.599 ( -1.446 0.000 -2.227) 2.655 6.664 ( -6.571 0.000 -21.079) 22.079 6.740 ( 1.258 0.000 -8.215) 8.311 7.034 ( -1.226 0.000 -5.965) 6.090 7.184 ( -1.741 0.000 1.859) 2.547 7.757 ( 2.546 0.000 -1.852) 3.148 8.080 ( 3.579 0.000 8.576) 9.293 8.112 ( -10.377 0.000 0.346) 10.383 8.309 ( 15.520 0.000 -5.378) 16.425 8.913 ( 3.482 0.000 -2.419) 4.239 9.391 ( 3.209 0.000 3.458) 4.718 9.588 ( -1.500 0.000 -5.823) 6.013 9.742 ( 3.382 0.000 4.061) 5.285 10.135 ( 1.648 0.000 2.861) 3.301 10.785 ( -5.004 0.000 -4.151) 6.501 10.950 ( 4.008 0.000 -1.571) 4.305 11.201 ( -9.696 0.000 -14.178) 17.176 11.654 ( 2.402 0.000 6.135) 6.588 11.956 ( 9.835 0.000 7.900) 12.614 12.385 ( 4.617 0.000 6.878) 8.284 12.798 ( 2.074 0.000 2.899) 3.565 13.233 ( 5.288 0.000 1.502) 5.498 13.284 ( 3.868 0.000 5.140) 6.433 13.722 ( -2.288 0.000 -10.341) 10.591 13.855 ( 7.637 0.000 -12.741) 14.855 14.101 ( 0.212 0.000 8.353) 8.355 14.490 ( -1.288 0.000 -2.922) 3.193 14.744 ( 0.161 0.000 14.054) 14.055 14.784 ( -3.196 0.000 0.211) 3.203 15.104 ( -1.608 0.000 15.390) 15.473 15.603 ( -2.509 0.000 -1.920) 3.160 15.857 ( -1.284 0.000 -5.919) 6.057 16.131 ( 3.146 0.000 -2.671) 4.127 18.995 ( -1.263 0.000 1.639) 2.069 19.343 ( 1.184 0.000 1.063) 1.591 24.842 ( 4.784 0.000 -1.607) 5.047 25.334 ( 10.588 0.000 -15.738) 18.968 25.762 ( -15.638 0.000 14.687) 21.454 25.830 ( 0.434 0.000 2.720) 2.754 26.507 ( 0.727 0.000 2.310) 2.422 26.923 ( -5.363 0.000 1.665) 5.616 27.015 ( 2.461 0.000 0.637) 2.542 27.032 ( 5.823 0.000 4.956) 7.647 27.185 ( 4.978 0.000 4.174) 6.496 27.589 ( 3.028 0.000 1.008) 3.191 29.381 ( -12.426 0.000 -16.378) 20.558 30.343 ( -6.121 0.000 -15.963) 17.096 32.288 ( -0.048 0.000 1.042) 1.043 32.839 ( 7.552 0.000 -1.918) 7.792 ======================= Grid point 62 (26/150) ======================= q-point: (-0.36 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.942 ( -12.434 0.000 -4.033) 13.072 2.130 ( 0.780 0.000 3.117) 3.213 2.965 ( -27.315 0.000 -12.949) 30.228 3.052 ( -5.290 0.000 -11.383) 12.552 3.368 ( 2.433 0.000 0.465) 2.477 3.485 ( -18.644 0.000 -11.174) 21.736 3.920 ( 6.390 0.000 3.546) 7.308 4.003 ( 4.022 0.000 0.921) 4.126 4.172 ( -2.405 0.000 17.972) 18.132 4.357 ( -12.613 0.000 -15.068) 19.650 4.647 ( -10.600 0.000 -2.940) 11.000 4.769 ( -16.387 0.000 2.223) 16.537 5.142 ( -1.903 0.000 -26.608) 26.676 5.351 ( -5.893 0.000 -18.115) 19.050 5.699 ( -0.203 0.000 -0.929) 0.950 5.910 ( -1.680 0.000 -3.103) 3.529 6.383 ( -11.562 0.000 -8.409) 14.297 6.462 ( -6.937 0.000 -4.600) 8.324 6.592 ( 3.183 0.000 -8.364) 8.950 6.856 ( 4.726 0.000 0.253) 4.733 7.050 ( 1.500 0.000 -1.574) 2.175 7.148 ( -1.202 0.000 0.301) 1.239 7.785 ( 1.874 0.000 -2.114) 2.825 7.948 ( -6.030 0.000 0.836) 6.088 8.154 ( 2.115 0.000 7.395) 7.691 8.639 ( 18.563 0.000 -9.890) 21.033 9.021 ( 7.522 0.000 -1.455) 7.661 9.478 ( 4.252 0.000 3.405) 5.447 9.569 ( 0.829 0.000 -3.106) 3.215 9.807 ( 2.563 0.000 1.066) 2.776 10.229 ( 7.433 0.000 1.765) 7.639 10.670 ( -5.170 0.000 -5.158) 7.303 11.001 ( -8.303 0.000 -14.265) 16.505 11.046 ( 6.203 0.000 -1.248) 6.327 11.725 ( 3.620 0.000 5.250) 6.377 12.107 ( 3.426 0.000 3.599) 4.969 12.488 ( 4.259 0.000 8.228) 9.265 12.833 ( 1.595 0.000 5.416) 5.646 13.253 ( -4.695 0.000 9.428) 10.532 13.342 ( 1.443 0.000 5.245) 5.440 13.630 ( -4.087 0.000 -11.012) 11.746 14.032 ( 11.382 0.000 -10.687) 15.613 14.143 ( 1.417 0.000 9.045) 9.155 14.472 ( 0.243 0.000 -4.594) 4.600 14.691 ( -6.815 0.000 3.016) 7.452 14.757 ( -1.121 0.000 16.259) 16.298 15.102 ( -2.035 0.000 18.859) 18.969 15.648 ( 8.891 0.000 -8.374) 12.213 15.854 ( 2.724 0.000 -6.779) 7.305 16.219 ( 6.216 0.000 -5.716) 8.445 18.985 ( 0.046 0.000 0.167) 0.173 19.374 ( 1.383 0.000 3.259) 3.541 24.946 ( 5.861 0.000 2.247) 6.277 25.414 ( -8.960 0.000 0.747) 8.991 25.558 ( 2.052 0.000 -4.247) 4.716 25.873 ( 3.705 0.000 1.819) 4.128 26.549 ( 2.816 0.000 4.919) 5.667 26.776 ( -8.373 0.000 -1.438) 8.496 27.107 ( 6.246 0.000 5.076) 8.048 27.179 ( 7.774 0.000 6.298) 10.005 27.307 ( 5.886 0.000 7.280) 9.362 27.690 ( 6.166 0.000 -0.119) 6.167 29.011 ( -21.394 0.000 -21.998) 30.686 30.179 ( -6.871 0.000 -22.553) 23.576 32.290 ( -0.057 0.000 1.324) 1.326 33.036 ( 12.697 0.000 -0.261) 12.700 ======================= Grid point 63 (27/150) ======================= q-point: (-0.27 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.718 ( -7.170 0.000 -8.664) 11.246 2.122 ( -14.146 0.000 -8.590) 16.550 2.348 ( -21.782 0.000 -21.865) 30.864 2.872 ( -13.599 0.000 1.762) 13.712 2.999 ( -24.860 0.000 -20.063) 31.946 3.361 ( -2.194 0.000 -5.149) 5.597 3.844 ( -37.871 0.000 4.772) 38.171 3.973 ( -1.380 0.000 4.993) 5.181 4.121 ( 4.355 0.000 0.720) 4.414 4.229 ( -15.095 0.000 5.248) 15.982 4.261 ( 8.669 0.000 10.864) 13.899 4.860 ( 12.219 0.000 -6.325) 13.759 5.066 ( 0.289 0.000 -28.636) 28.638 5.262 ( 1.027 0.000 -15.955) 15.988 5.699 ( -0.645 0.000 6.191) 6.224 5.938 ( 5.155 0.000 -7.855) 9.396 6.142 ( -11.237 0.000 -4.023) 11.936 6.339 ( -4.806 0.000 -8.868) 10.087 6.666 ( 4.145 0.000 -8.399) 9.366 6.820 ( -8.293 0.000 11.517) 14.192 7.045 ( -1.785 0.000 4.381) 4.731 7.206 ( 6.664 0.000 -2.507) 7.120 7.846 ( -5.783 0.000 0.558) 5.810 7.868 ( 6.925 0.000 3.300) 7.671 8.180 ( -0.422 0.000 2.180) 2.221 8.945 ( 14.336 0.000 -19.096) 23.879 9.174 ( 8.317 0.000 -2.436) 8.666 9.554 ( 3.090 0.000 4.795) 5.704 9.620 ( 5.193 0.000 -1.130) 5.315 9.829 ( -0.508 0.000 -0.864) 1.002 10.405 ( 8.909 0.000 0.250) 8.913 10.593 ( -0.883 0.000 -3.941) 4.039 10.818 ( -7.502 0.000 -12.005) 14.157 11.190 ( 9.048 0.000 -0.702) 9.075 11.808 ( 3.911 0.000 3.489) 5.241 12.125 ( -0.442 0.000 0.029) 0.443 12.573 ( 2.669 0.000 7.034) 7.523 12.849 ( -2.104 0.000 3.234) 3.858 13.099 ( -12.787 0.000 12.886) 18.154 13.390 ( 2.709 0.000 5.101) 5.776 13.548 ( -1.880 0.000 -10.123) 10.297 14.158 ( -2.187 0.000 9.781) 10.022 14.191 ( 6.476 0.000 -9.343) 11.368 14.480 ( 1.550 0.000 -6.521) 6.702 14.528 ( -10.683 0.000 5.220) 11.890 14.795 ( 1.417 0.000 16.247) 16.308 15.114 ( -0.931 0.000 25.397) 25.414 15.923 ( 21.319 0.000 -10.612) 23.814 15.935 ( 6.664 0.000 -6.589) 9.371 16.333 ( 6.901 0.000 -8.484) 10.937 18.998 ( 1.357 0.000 -1.006) 1.689 19.403 ( 0.401 0.000 6.866) 6.877 25.078 ( 7.102 0.000 7.372) 10.237 25.156 ( -14.672 0.000 8.960) 17.192 25.674 ( 7.916 0.000 -12.796) 15.046 25.984 ( 7.537 0.000 0.822) 7.582 26.629 ( -5.885 0.000 -2.921) 6.570 26.633 ( 4.413 0.000 7.808) 8.969 27.267 ( 8.542 0.000 9.347) 12.662 27.341 ( 7.326 0.000 5.873) 9.389 27.431 ( 5.160 0.000 8.786) 10.189 27.794 ( 4.328 0.000 -2.174) 4.844 28.483 ( -27.835 0.000 -27.109) 38.855 29.982 ( -8.420 0.000 -28.804) 30.010 32.290 ( -0.341 0.000 1.967) 1.996 33.313 ( 15.653 0.000 0.259) 15.655 ======================= Grid point 64 (28/150) ======================= q-point: (-0.18 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.389 ( -41.835 0.000 -11.653) 43.428 1.617 ( -6.653 0.000 -3.588) 7.559 2.120 ( -12.274 0.000 -19.961) 23.433 2.581 ( -21.461 0.000 0.792) 21.475 2.605 ( -9.315 0.000 7.857) 12.186 3.086 ( -31.040 0.000 7.018) 31.824 3.319 ( 0.331 0.000 -7.620) 7.627 3.945 ( -2.200 0.000 4.256) 4.790 4.024 ( -8.966 0.000 6.075) 10.830 4.247 ( 7.306 0.000 2.814) 7.829 4.440 ( 6.337 0.000 4.009) 7.499 5.052 ( 3.805 0.000 -23.136) 23.447 5.136 ( 17.227 0.000 -4.837) 17.894 5.349 ( 10.743 0.000 -9.612) 14.415 5.691 ( -1.942 0.000 8.939) 9.147 5.905 ( -8.478 0.000 -6.174) 10.487 6.095 ( 7.907 0.000 -2.981) 8.450 6.222 ( -5.720 0.000 -9.508) 11.096 6.649 ( -3.703 0.000 -10.884) 11.496 6.668 ( -8.800 0.000 12.364) 15.176 7.041 ( -0.656 0.000 13.950) 13.966 7.342 ( 7.207 0.000 -1.245) 7.314 7.708 ( -8.521 0.000 1.432) 8.641 8.037 ( 8.065 0.000 7.854) 11.257 8.157 ( -1.400 0.000 -3.586) 3.850 8.982 ( -8.206 0.000 -43.335) 44.106 9.324 ( 7.877 0.000 -4.035) 8.850 9.611 ( 2.390 0.000 -4.112) 4.757 9.744 ( 1.630 0.000 -4.384) 4.677 9.882 ( 12.917 0.000 25.182) 28.301 10.470 ( -1.251 0.000 -5.641) 5.778 10.613 ( -0.548 0.000 -1.969) 2.044 10.769 ( 7.611 0.000 -2.388) 7.977 11.388 ( 11.270 0.000 -0.025) 11.270 11.883 ( 3.014 0.000 1.590) 3.408 12.130 ( 1.796 0.000 -3.321) 3.775 12.603 ( -1.711 0.000 4.907) 5.197 12.766 ( -6.246 0.000 2.820) 6.853 12.855 ( -13.443 0.000 11.751) 17.855 13.442 ( 1.015 0.000 0.936) 1.380 13.518 ( 0.549 0.000 -7.457) 7.477 14.100 ( -5.620 0.000 7.334) 9.239 14.244 ( 0.572 0.000 -4.198) 4.237 14.323 ( -10.733 0.000 5.414) 12.021 14.499 ( 2.148 0.000 -8.121) 8.400 14.845 ( 0.312 0.000 8.697) 8.703 15.193 ( 3.789 0.000 33.404) 33.618 16.064 ( 7.380 0.000 -5.953) 9.482 16.416 ( 31.394 0.000 -5.343) 31.846 16.449 ( 6.976 0.000 -9.031) 11.411 19.031 ( 2.235 0.000 -1.608) 2.753 19.411 ( -1.588 0.000 11.723) 11.830 24.917 ( -11.652 0.000 7.891) 14.073 25.271 ( 11.619 0.000 14.750) 18.777 25.786 ( 6.023 0.000 -10.132) 11.787 26.165 ( 10.787 0.000 1.099) 10.842 26.551 ( -1.331 0.000 -3.639) 3.875 26.742 ( 4.832 0.000 8.829) 10.065 27.446 ( 6.491 0.000 9.901) 11.839 27.469 ( 4.439 0.000 3.212) 5.479 27.548 ( 5.338 0.000 12.756) 13.828 27.828 ( -33.970 0.000 -33.930) 48.012 27.837 ( 1.036 0.000 -5.336) 5.435 29.726 ( -11.958 0.000 -32.416) 34.552 32.283 ( -0.859 0.000 2.794) 2.923 33.623 ( 15.902 0.000 -1.097) 15.940 ======================= Grid point 65 (29/150) ======================= q-point: (-0.09 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.822 ( -7.640 0.000 38.187) 38.944 1.267 ( -29.747 0.000 22.674) 37.403 1.793 ( -42.107 0.000 28.534) 50.865 2.008 ( -6.181 0.000 10.273) 11.989 2.729 ( 20.193 0.000 -8.715) 21.994 2.918 ( 4.535 0.000 -13.296) 14.048 3.366 ( 5.497 0.000 0.769) 5.551 3.890 ( -6.156 0.000 5.301) 8.124 3.892 ( -5.467 0.000 9.367) 10.846 4.421 ( 10.263 0.000 7.943) 12.978 4.505 ( 0.878 0.000 -3.520) 3.628 5.104 ( 4.621 0.000 -11.430) 12.329 5.494 ( 19.115 0.000 -2.300) 19.252 5.609 ( 15.909 0.000 -3.478) 16.284 5.662 ( -1.691 0.000 6.628) 6.840 5.767 ( -2.785 0.000 -7.039) 7.570 6.088 ( -5.488 0.000 -2.226) 5.922 6.196 ( -0.105 0.000 -4.721) 4.723 6.539 ( -7.410 0.000 8.725) 11.447 6.579 ( 1.403 0.000 -5.347) 5.528 7.033 ( -4.018 0.000 19.101) 19.519 7.463 ( 5.017 0.000 -3.360) 6.039 7.546 ( -8.172 0.000 -0.096) 8.172 8.089 ( -2.623 0.000 -4.558) 5.259 8.202 ( 4.894 0.000 5.476) 7.344 8.334 ( -48.966 0.000 -54.184) 73.031 9.458 ( 6.477 0.000 -2.910) 7.100 9.636 ( 1.731 0.000 -7.097) 7.305 9.743 ( -0.239 0.000 6.072) 6.077 10.380 ( 29.984 0.000 27.345) 40.581 10.404 ( -2.385 0.000 -5.770) 6.244 10.645 ( 3.734 0.000 1.847) 4.166 10.938 ( 7.352 0.000 0.150) 7.353 11.606 ( 10.759 0.000 -0.452) 10.769 11.924 ( 1.139 0.000 0.510) 1.247 12.181 ( 4.124 0.000 -5.325) 6.735 12.470 ( -12.383 0.000 8.633) 15.096 12.654 ( -5.376 0.000 3.284) 6.300 12.706 ( -4.200 0.000 2.728) 5.008 13.423 ( -1.958 0.000 -2.452) 3.138 13.540 ( 2.932 0.000 -5.325) 6.079 13.956 ( -10.968 0.000 1.234) 11.037 14.156 ( -7.128 0.000 3.282) 7.847 14.209 ( -3.656 0.000 -0.103) 3.657 14.553 ( 5.817 0.000 -8.791) 10.541 14.826 ( -2.948 0.000 -1.962) 3.541 15.426 ( 13.699 0.000 31.365) 34.226 16.169 ( 4.310 0.000 -6.633) 7.910 16.564 ( 6.385 0.000 -6.491) 9.105 17.127 ( 42.148 0.000 -0.154) 42.148 19.073 ( 2.284 0.000 -1.473) 2.718 19.385 ( -4.490 0.000 14.572) 15.249 24.744 ( -7.692 0.000 6.218) 9.891 25.643 ( 22.404 0.000 15.289) 27.124 25.866 ( 4.149 0.000 -6.274) 7.522 26.405 ( 12.902 0.000 6.449) 14.424 26.560 ( 2.685 0.000 -3.170) 4.154 26.822 ( 0.423 0.000 2.889) 2.920 26.975 ( -43.726 0.000 -36.777) 57.136 27.521 ( 0.113 0.000 4.857) 4.858 27.527 ( 0.376 0.000 0.151) 0.405 27.647 ( -1.372 0.000 13.101) 13.173 27.868 ( 5.632 0.000 -1.643) 5.867 29.419 ( -10.056 0.000 -16.409) 19.246 32.269 ( -1.150 0.000 3.453) 3.639 33.868 ( 7.217 0.000 -10.299) 12.576 ======================= Grid point 66 (30/150) ======================= q-point: ( 0.00 0.20 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.971 ( 3.466 34.729 14.376) 37.746 1.330 ( 15.024 19.351 45.419) 51.605 1.915 ( -7.192 49.670 38.737) 63.399 2.164 ( 21.327 -9.727 25.739) 34.813 2.825 ( 14.037 -12.296 -11.298) 21.815 3.301 ( 10.948 6.606 -3.650) 13.298 3.494 ( 6.801 -5.752 10.145) 13.501 3.545 ( -1.861 -8.101 8.468) 11.866 3.922 ( -5.760 3.740 9.624) 11.823 4.432 ( 2.426 -3.975 1.452) 4.878 4.584 ( -6.128 -1.826 8.592) 10.711 5.091 ( 3.044 -10.623 -2.839) 11.409 5.525 ( 6.547 -8.406 -3.117) 11.102 5.561 ( -0.843 -3.507 -1.050) 3.756 5.650 ( 1.819 -8.513 1.664) 8.863 5.958 ( -1.541 0.614 -6.655) 6.858 6.083 ( -5.147 -0.722 4.373) 6.793 6.243 ( 6.505 5.316 -1.174) 8.483 6.519 ( 6.384 2.833 10.953) 12.990 6.550 ( -3.077 -8.286 2.277) 9.128 6.774 ( 8.560 -6.202 8.481) 13.553 7.110 ( -16.095 -5.000 4.817) 17.529 7.501 ( 1.202 5.049 -3.342) 6.173 7.968 ( 2.178 4.070 -8.507) 9.679 8.097 ( 0.621 15.788 4.190) 16.346 8.463 ( -3.079 11.331 -15.322) 19.303 9.414 ( -0.005 -8.223 -2.020) 8.467 9.631 ( 2.672 -3.805 -0.704) 4.702 9.824 ( -0.071 7.678 7.765) 10.921 10.385 ( 7.244 0.588 9.632) 12.066 10.554 ( 4.015 -11.275 3.554) 12.485 10.806 ( 9.547 -9.445 6.045) 14.727 11.056 ( 1.705 3.201 1.789) 4.044 11.601 ( 0.649 -13.572 2.560) 13.827 11.942 ( -0.481 2.411 -2.499) 3.506 12.235 ( -0.127 -3.843 -1.002) 3.974 12.294 ( -7.556 -0.240 4.277) 8.686 12.381 ( -7.478 -4.811 4.639) 10.030 12.942 ( -3.967 20.647 -0.230) 21.026 13.404 ( 1.251 -0.798 -1.296) 1.970 13.501 ( -1.680 0.164 -0.926) 1.925 13.715 ( -1.969 -1.563 -3.038) 3.944 14.046 ( -6.099 3.671 -4.936) 8.663 14.374 ( 0.289 7.983 -11.011) 13.603 14.657 ( -5.627 -5.033 -6.548) 9.993 14.728 ( 1.228 0.450 -6.574) 6.703 15.906 ( 8.816 13.073 -16.568) 22.872 16.283 ( 1.192 5.233 -12.779) 13.860 16.677 ( 6.318 4.028 -4.618) 8.802 17.268 ( -12.274 -14.488 -7.036) 20.250 19.188 ( -4.650 4.616 2.391) 6.975 19.227 ( -11.130 0.726 8.601) 14.084 24.669 ( -3.895 2.299 4.183) 6.161 24.967 ( -20.375 -11.702 11.005) 25.946 26.241 ( -11.103 16.085 -22.349) 29.690 26.404 ( 7.427 0.993 -10.465) 12.871 26.637 ( -1.156 1.138 -1.191) 2.012 26.709 ( -11.567 -0.425 -4.210) 12.317 27.438 ( 7.127 2.285 -0.960) 7.546 27.475 ( -4.908 1.768 -1.591) 5.454 27.549 ( 18.097 0.938 7.420) 19.582 27.605 ( 6.869 1.958 5.974) 9.312 28.043 ( 10.783 3.249 10.293) 15.257 29.036 ( 30.396 -45.121 35.594) 65.013 32.797 ( 9.531 29.077 -20.821) 37.011 33.534 ( -19.437 -7.903 -4.822) 21.529 ======================= Grid point 67 (31/150) ======================= q-point: ( 0.09 0.20 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.144 ( 5.282 36.856 15.094) 40.176 1.553 ( 23.137 42.241 7.894) 48.805 2.463 ( 36.735 20.192 43.491) 60.404 2.706 ( 26.282 -10.131 26.908) 38.954 3.061 ( 11.855 -6.936 -5.033) 14.628 3.306 ( -10.381 -8.254 16.500) 21.169 3.516 ( -1.526 -1.182 11.787) 11.944 3.761 ( 12.280 -0.833 6.400) 13.872 3.862 ( 0.077 4.017 3.895) 5.596 4.401 ( -7.106 1.800 -1.798) 7.548 4.490 ( -2.196 -6.709 15.225) 16.782 5.135 ( 2.022 -9.443 -1.635) 9.794 5.448 ( -5.300 -0.737 -2.124) 5.757 5.673 ( 4.964 -15.635 -5.161) 17.197 5.692 ( 1.955 -5.002 3.827) 6.595 5.905 ( -0.527 -3.099 -0.072) 3.145 6.091 ( 2.661 3.374 10.542) 11.384 6.352 ( 9.762 2.498 -4.782) 11.154 6.528 ( 1.789 2.634 3.806) 4.962 6.724 ( 2.267 2.995 11.755) 12.341 6.964 ( 8.283 -8.746 10.541) 16.007 7.185 ( 14.758 -8.841 -1.909) 17.310 7.567 ( 5.858 6.705 -2.627) 9.283 7.940 ( -2.181 0.805 -8.465) 8.778 8.170 ( 3.870 6.828 5.457) 9.559 8.407 ( 2.927 6.012 -17.250) 18.501 9.391 ( -2.372 -8.230 -0.629) 8.588 9.634 ( -2.436 -3.805 -0.154) 4.521 9.824 ( -1.899 6.823 8.210) 10.843 10.509 ( -7.351 -8.910 0.613) 11.567 10.571 ( 10.426 2.049 7.395) 12.945 10.829 ( -7.804 -3.870 1.059) 8.775 11.023 ( -7.436 2.859 2.538) 8.361 11.493 ( -11.525 -11.149 4.090) 16.548 11.917 ( -2.866 -0.005 1.924) 3.452 12.185 ( -2.983 -5.843 -1.498) 6.729 12.245 ( 0.895 -3.904 -4.673) 6.155 12.283 ( -1.210 -1.680 -0.790) 2.216 12.899 ( 0.345 20.166 -3.403) 20.454 13.373 ( -2.958 -2.442 -1.676) 4.185 13.508 ( 1.868 4.138 -1.787) 4.879 13.789 ( 7.705 -0.884 -2.776) 8.237 13.979 ( 1.699 5.054 -9.847) 11.198 14.377 ( 1.822 10.547 -10.092) 14.711 14.495 ( -7.795 -8.017 -11.656) 16.153 14.717 ( -1.567 -2.331 -2.487) 3.752 15.769 ( -19.347 27.509 -2.067) 33.694 16.204 ( -5.257 5.214 -9.732) 12.228 16.669 ( -7.701 0.801 3.092) 8.337 16.827 ( -15.174 2.457 6.694) 16.766 19.114 ( 0.306 -0.765 0.723) 1.096 19.161 ( -1.442 -1.377 5.504) 5.854 24.638 ( 0.272 1.431 1.227) 1.904 24.758 ( -3.553 -1.564 2.058) 4.394 26.089 ( -1.671 8.031 -4.253) 9.240 26.376 ( -10.759 -1.483 -11.697) 15.962 26.544 ( 0.243 2.379 2.928) 3.780 26.693 ( 3.162 -1.263 2.216) 4.063 27.271 ( -10.043 0.144 -3.306) 10.574 27.347 ( -7.892 -2.507 -3.909) 9.157 27.555 ( -2.620 4.786 1.974) 5.803 27.987 ( 6.197 -9.503 7.373) 13.531 28.412 ( 23.819 11.304 13.358) 29.557 29.878 ( 35.335 -55.838 12.601) 67.270 32.773 ( -9.541 28.363 -15.646) 33.768 33.194 ( -8.746 0.140 -3.880) 9.569 ======================= Grid point 68 (32/150) ======================= q-point: ( 0.18 0.20 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.484 ( 27.785 12.419 4.930) 30.831 2.126 ( 30.762 28.874 -3.006) 42.297 2.970 ( -17.948 -1.473 19.669) 26.667 3.106 ( 11.776 -3.580 17.602) 21.479 3.243 ( 24.720 -2.978 4.527) 25.307 3.343 ( 9.546 -1.998 21.257) 23.388 3.541 ( 7.025 -7.999 14.473) 17.967 3.857 ( 1.083 1.612 9.970) 10.157 3.975 ( 5.361 2.763 -2.770) 6.637 4.296 ( -1.890 5.961 5.109) 8.075 4.474 ( -3.255 -0.021 10.794) 11.275 5.172 ( 1.902 -4.879 -0.377) 5.250 5.382 ( 0.388 -0.807 -4.421) 4.511 5.685 ( -1.093 -11.713 1.988) 11.931 5.756 ( 3.543 -4.757 -3.538) 6.906 5.971 ( 5.122 -7.394 0.246) 8.998 6.195 ( 5.108 1.295 15.290) 16.172 6.535 ( 8.987 -2.323 -5.799) 10.945 6.608 ( 4.240 14.296 6.460) 16.250 6.752 ( 0.231 5.191 8.737) 10.166 7.126 ( 6.155 -8.954 7.923) 13.447 7.353 ( 1.924 -4.248 7.027) 8.433 7.696 ( 7.595 7.898 -2.406) 11.218 7.889 ( -1.068 3.869 -4.981) 6.397 8.145 ( -5.864 2.387 0.998) 6.410 8.579 ( 14.585 -10.877 -16.514) 24.571 9.307 ( -6.391 -5.368 -0.080) 8.347 9.538 ( -7.095 -3.717 -0.838) 8.054 9.770 ( -5.423 3.131 6.545) 9.058 10.250 ( -18.665 -8.614 -0.402) 20.561 10.644 ( -6.458 5.596 -0.944) 8.597 10.801 ( -3.542 5.798 4.153) 7.963 10.886 ( 8.921 -1.907 2.388) 9.430 11.256 ( -12.282 -5.592 0.773) 13.517 11.831 ( -6.020 -0.614 3.982) 7.244 12.126 ( -2.472 -12.060 -6.103) 13.740 12.272 ( -0.097 0.851 -4.780) 4.856 12.309 ( 5.528 -1.628 -5.832) 8.199 12.913 ( 0.575 20.086 -7.772) 21.545 13.308 ( -4.712 -0.158 -1.594) 4.977 13.511 ( 1.444 2.342 -4.925) 5.642 13.932 ( 6.732 2.668 -2.443) 7.642 14.065 ( 5.403 -0.527 -11.550) 12.762 14.306 ( -2.100 -2.347 -10.377) 10.844 14.468 ( 4.897 3.332 -3.090) 6.681 14.671 ( -2.278 -2.329 -1.013) 3.412 15.423 ( -14.822 25.031 18.174) 34.300 16.091 ( -4.990 2.826 -6.734) 8.845 16.486 ( -12.368 -2.988 7.360) 14.699 16.631 ( -8.967 -0.482 -1.378) 9.085 19.112 ( -0.954 -0.666 2.506) 2.763 19.194 ( 3.060 -3.408 1.049) 4.699 24.683 ( 4.434 0.819 -2.318) 5.070 24.740 ( 0.672 -0.616 -4.191) 4.289 26.094 ( 1.051 1.377 2.452) 3.002 26.154 ( -9.040 -0.126 -3.588) 9.727 26.567 ( 0.593 2.918 2.439) 3.849 26.746 ( 1.557 -1.692 5.261) 5.741 27.095 ( -6.854 -0.341 -3.846) 7.867 27.178 ( -8.250 -3.805 -4.619) 10.192 27.479 ( -5.231 7.384 -0.907) 9.095 28.011 ( -3.710 -8.634 6.503) 11.428 28.900 ( 22.884 12.090 11.576) 28.352 30.329 ( 12.437 -37.101 4.789) 39.422 32.545 ( -9.293 20.638 -2.138) 22.734 33.069 ( -5.520 -1.692 -12.277) 13.567 ======================= Grid point 69 (33/150) ======================= q-point: ( 0.27 0.20 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.109 ( 32.967 -2.706 -2.106) 33.144 2.554 ( -4.507 9.146 13.534) 16.945 2.712 ( 7.636 6.975 1.265) 10.419 3.179 ( -6.113 -5.062 20.102) 21.612 3.367 ( 0.148 -25.844 5.818) 26.492 3.516 ( 3.759 -13.013 -1.727) 13.655 3.917 ( 7.313 5.565 2.937) 9.648 3.971 ( 14.364 11.581 9.511) 20.758 4.015 ( 2.541 5.749 -3.431) 7.161 4.349 ( 0.823 17.349 1.749) 17.456 4.454 ( 5.760 1.872 16.959) 18.008 5.189 ( -0.166 -4.101 3.153) 5.175 5.443 ( 4.773 3.588 -8.028) 10.006 5.690 ( 1.949 -11.961 0.137) 12.120 5.795 ( 0.770 2.463 0.886) 2.729 6.062 ( 4.706 -10.222 -3.288) 11.723 6.305 ( 1.836 1.006 12.008) 12.190 6.649 ( 3.558 -3.758 -3.526) 6.263 6.693 ( 3.128 13.173 10.699) 17.256 6.803 ( 3.982 4.455 1.721) 6.218 7.228 ( 3.214 -6.707 4.057) 8.472 7.344 ( -3.869 -4.549 13.792) 15.030 7.825 ( 4.777 7.437 -2.578) 9.207 7.881 ( 1.482 6.068 -6.639) 9.116 8.012 ( -6.738 4.222 -0.153) 7.953 8.758 ( 4.256 -16.694 -10.509) 20.181 9.163 ( -7.905 -1.068 -1.108) 8.054 9.387 ( -6.483 -5.249 -1.204) 8.428 9.639 ( -8.863 1.539 3.778) 9.757 9.901 ( -14.221 -7.272 -3.585) 16.370 10.524 ( -7.824 7.103 1.441) 10.665 10.723 ( 1.710 4.394 -0.745) 4.773 11.042 ( -8.745 -2.585 -1.778) 9.291 11.184 ( 13.383 -3.626 4.854) 14.691 11.724 ( -4.926 -0.112 3.129) 5.837 12.092 ( 0.935 -10.761 -3.687) 11.413 12.218 ( -4.657 6.288 -3.452) 8.552 12.410 ( 4.875 -4.126 -8.598) 10.710 12.850 ( -3.126 16.916 -12.917) 21.512 13.230 ( -1.884 3.248 -1.151) 3.927 13.572 ( 4.956 -2.462 -5.118) 7.538 13.984 ( -4.846 -3.391 -16.466) 17.496 14.052 ( 3.993 -0.413 -0.103) 4.016 14.417 ( 9.895 -0.999 -0.795) 9.977 14.567 ( 4.100 1.920 0.902) 4.616 14.649 ( 1.214 0.474 -1.616) 2.076 15.255 ( -7.781 15.624 20.542) 26.956 15.982 ( -5.196 0.398 -3.667) 6.372 16.227 ( -14.711 -0.738 6.401) 16.060 16.457 ( -9.178 -3.322 -0.555) 9.777 19.096 ( -1.340 0.103 3.128) 3.404 19.249 ( 2.214 -3.439 -0.207) 4.096 24.749 ( 1.416 1.161 -6.256) 6.518 24.794 ( 7.644 0.073 -6.115) 9.789 25.997 ( -6.404 0.561 0.586) 6.455 26.123 ( -0.605 -2.534 7.216) 7.672 26.575 ( -0.275 3.604 3.662) 5.146 26.782 ( 1.275 -2.016 6.568) 6.988 26.998 ( -2.893 -1.368 -3.011) 4.394 27.033 ( -4.969 -2.487 -4.157) 6.940 27.356 ( -6.839 8.260 -2.960) 11.125 27.898 ( -8.589 -7.514 4.302) 12.195 29.312 ( 17.336 11.916 6.122) 21.909 30.470 ( 3.069 -21.155 0.910) 21.396 32.415 ( -4.557 12.149 0.018) 12.976 32.916 ( -7.271 -3.535 -10.855) 13.535 ======================= Grid point 70 (34/150) ======================= q-point: ( 0.36 0.20 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( -10.473 6.804 9.726) 15.829 2.622 ( 1.706 -6.824 11.005) 13.061 2.916 ( 16.296 -4.990 2.538) 17.231 3.230 ( 8.241 -5.428 -0.293) 9.872 3.388 ( 1.316 -16.799 7.188) 18.320 3.466 ( -5.946 -9.127 -0.829) 10.925 3.965 ( -1.885 7.651 1.396) 8.002 4.051 ( 3.649 4.137 3.627) 6.602 4.157 ( 0.911 10.619 -1.978) 10.841 4.316 ( 1.779 11.243 -1.751) 11.517 4.757 ( 14.444 5.923 4.435) 16.229 5.194 ( -0.615 -3.147 7.475) 8.134 5.469 ( 1.158 1.791 -14.583) 14.738 5.728 ( 0.430 5.879 -1.140) 6.004 5.812 ( 0.807 0.938 1.261) 1.767 6.150 ( 5.070 -9.887 -4.337) 11.927 6.306 ( -2.104 -2.323 5.196) 6.068 6.664 ( -0.935 -3.988 -2.959) 5.053 6.753 ( -0.764 3.220 6.797) 7.560 6.893 ( 5.368 4.602 -3.401) 7.846 7.214 ( -7.025 -6.915 5.668) 11.371 7.319 ( -0.140 -4.337 4.444) 6.211 7.807 ( -2.525 5.937 -4.465) 7.845 7.914 ( -0.633 8.849 -3.455) 9.521 7.972 ( 4.855 5.905 -0.618) 7.670 8.670 ( -10.091 -9.777 -6.289) 15.394 8.994 ( -7.809 -0.411 -2.356) 8.167 9.350 ( 0.970 -10.425 -1.080) 10.526 9.494 ( -5.409 0.920 2.849) 6.182 9.704 ( -6.428 -6.990 -0.887) 9.538 10.395 ( -4.883 10.949 1.203) 12.049 10.804 ( 4.942 2.364 -0.992) 5.568 10.913 ( -3.839 -1.140 -2.484) 4.713 11.328 ( -0.310 -9.994 0.636) 10.019 11.710 ( 3.509 5.535 5.596) 8.618 12.051 ( -9.753 12.396 -2.465) 15.965 12.178 ( 5.607 -5.324 0.076) 7.732 12.457 ( 4.323 -5.087 -7.887) 10.333 12.854 ( 6.005 3.651 -10.780) 12.869 13.205 ( -1.254 1.172 0.487) 1.784 13.652 ( 4.039 -4.479 -6.145) 8.611 13.859 ( -3.376 -4.419 -15.551) 16.515 14.126 ( 2.656 3.600 3.312) 5.566 14.554 ( 2.024 -0.465 -1.076) 2.339 14.620 ( 4.319 -0.005 1.857) 4.701 14.725 ( 4.755 1.351 0.917) 5.027 15.180 ( -4.522 9.915 19.276) 22.143 15.859 ( -8.432 -5.180 3.420) 10.470 16.003 ( -7.559 4.285 0.777) 8.723 16.275 ( -9.139 -2.906 -0.872) 9.629 19.073 ( -1.658 1.296 3.071) 3.723 19.278 ( 1.021 -3.394 -0.381) 3.564 24.770 ( 2.270 3.159 -6.444) 7.527 24.949 ( 9.779 -1.228 -9.783) 13.887 25.896 ( -4.530 0.330 2.885) 5.380 26.082 ( -5.790 -5.270 11.233) 13.692 26.573 ( -0.777 4.460 4.342) 6.272 26.831 ( 2.260 -2.997 5.823) 6.928 26.947 ( -0.475 -0.427 -1.682) 1.799 27.001 ( 0.739 -0.431 -1.362) 1.608 27.222 ( -5.639 7.314 -3.751) 9.968 27.720 ( -9.821 -6.398 2.050) 11.899 29.576 ( 9.063 11.128 -1.171) 14.400 30.479 ( -1.501 -12.200 -4.004) 12.928 32.354 ( -2.039 6.759 0.432) 7.073 32.772 ( -5.071 -4.445 -7.607) 10.166 ======================= Grid point 71 (35/150) ======================= q-point: ( 0.45 0.20 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.161 ( -3.784 2.208 -0.497) 4.409 2.457 ( -14.123 -0.460 20.784) 25.132 3.233 ( -4.625 -12.219 -0.326) 13.069 3.274 ( 4.489 0.329 2.086) 4.961 3.381 ( 7.537 -12.459 -6.334) 15.879 3.521 ( 5.967 -3.122 3.667) 7.668 3.905 ( -4.184 8.688 -0.474) 9.655 4.030 ( -6.813 9.784 3.350) 12.384 4.212 ( 8.334 7.703 7.482) 13.593 4.389 ( 4.608 4.320 -14.690) 15.991 4.889 ( -1.070 -7.746 1.044) 7.889 5.152 ( -6.364 -4.259 5.995) 9.725 5.468 ( 1.080 7.644 -17.695) 19.305 5.710 ( -1.505 11.222 -3.751) 11.927 5.794 ( -1.659 1.567 -8.575) 8.874 6.150 ( -5.614 -1.255 2.885) 6.436 6.360 ( 8.317 -10.629 -7.994) 15.686 6.623 ( -2.123 -5.040 -4.134) 6.855 6.661 ( -8.432 -3.100 0.846) 9.023 6.972 ( 0.959 8.562 -9.697) 12.971 7.049 ( -6.924 -12.082 0.282) 13.929 7.258 ( -6.965 2.752 -2.329) 7.842 7.806 ( 2.971 5.529 -1.038) 6.362 7.934 ( 2.932 2.970 2.605) 4.920 8.092 ( 7.950 4.505 -3.354) 9.734 8.433 ( -11.585 0.693 -1.316) 11.680 8.895 ( -2.021 -0.987 -2.967) 3.723 9.342 ( -0.835 -8.904 -0.031) 8.943 9.445 ( -1.405 -6.012 1.364) 6.323 9.646 ( -0.105 -4.488 3.381) 5.620 10.345 ( -0.714 15.323 0.290) 15.342 10.862 ( 1.065 0.379 -1.679) 2.024 10.882 ( 0.359 -0.761 -2.310) 2.459 11.248 ( -5.400 -11.433 -4.742) 13.504 11.827 ( 0.280 14.154 1.565) 14.243 11.875 ( -0.243 10.039 5.277) 11.344 12.281 ( 4.053 -1.054 3.483) 5.447 12.604 ( 9.982 -8.985 -1.687) 13.536 12.971 ( 6.946 -6.074 -6.500) 11.286 13.197 ( 0.717 -3.912 4.157) 5.754 13.695 ( 2.085 -4.176 -8.505) 9.702 13.805 ( 0.731 -0.951 -13.846) 13.898 14.168 ( 0.964 6.669 5.902) 8.957 14.546 ( -1.010 1.940 -2.101) 3.033 14.708 ( 2.875 -1.591 4.202) 5.334 14.788 ( 1.078 -0.197 1.424) 1.797 15.150 ( -2.655 6.699 17.582) 19.001 15.688 ( -8.778 -4.242 5.137) 11.020 15.927 ( -1.723 3.331 -3.578) 5.183 16.129 ( -4.736 -1.992 -1.498) 5.351 19.048 ( -1.443 2.528 2.465) 3.815 19.294 ( 0.809 -3.261 0.015) 3.360 24.815 ( 3.650 4.564 -5.198) 7.821 25.124 ( 10.598 -2.748 -12.848) 16.881 25.832 ( -2.831 -0.751 3.931) 4.902 25.946 ( -10.648 -5.092 13.392) 17.851 26.563 ( -1.051 5.253 3.914) 6.635 26.878 ( 1.591 -4.210 5.772) 7.319 26.983 ( 2.770 1.314 0.372) 3.088 27.006 ( -0.408 0.660 -0.953) 1.228 27.163 ( 0.818 4.871 -0.965) 5.033 27.565 ( -5.165 -5.036 0.731) 7.250 29.643 ( -1.316 10.522 -9.161) 14.013 30.404 ( -4.746 -8.384 -9.759) 13.714 32.332 ( -0.436 4.620 0.640) 4.685 32.712 ( 0.548 -5.114 -4.165) 6.618 ======================= Grid point 72 (36/150) ======================= q-point: (-0.45 0.20 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.073 ( -7.500 -2.358 -2.965) 8.403 2.278 ( -5.954 3.429 12.254) 14.049 3.067 ( -8.772 -5.537 -4.823) 11.440 3.270 ( -1.525 -2.108 0.294) 2.618 3.477 ( -11.569 3.562 -2.322) 12.326 3.591 ( 8.519 -11.030 2.310) 14.127 3.847 ( -3.879 4.396 0.206) 5.866 3.904 ( -3.498 5.721 0.840) 6.758 4.387 ( -1.730 -2.951 -18.831) 19.140 4.415 ( 6.156 15.329 9.212) 18.914 4.780 ( -7.571 -14.291 -3.262) 16.498 4.976 ( -10.892 -4.290 0.534) 11.719 5.412 ( -1.961 13.820 -16.963) 21.968 5.632 ( -5.571 9.524 -12.729) 16.845 5.736 ( -2.150 2.018 -10.732) 11.130 6.023 ( -6.647 0.300 1.715) 6.871 6.440 ( -5.000 -12.059 -8.488) 15.572 6.521 ( -0.595 -6.997 -3.888) 8.027 6.582 ( -1.610 -0.606 -1.520) 2.296 6.814 ( -6.795 -0.510 -15.639) 17.059 7.056 ( 1.636 -3.486 -1.051) 3.992 7.124 ( -4.146 2.291 -1.822) 5.076 7.854 ( 0.828 6.971 -1.787) 7.244 7.982 ( 0.678 -1.696 5.121) 5.437 8.262 ( -4.115 5.421 2.950) 7.418 8.300 ( 12.802 1.780 -6.280) 14.370 8.903 ( 3.484 -0.769 -2.127) 4.154 9.342 ( 0.661 -13.519 -1.221) 13.590 9.447 ( 1.877 -1.344 2.296) 3.256 9.680 ( 2.213 -4.678 5.246) 7.369 10.357 ( 1.724 16.848 0.091) 16.936 10.818 ( -4.315 3.140 -4.126) 6.746 10.919 ( 3.525 -3.426 -1.997) 5.306 11.130 ( -5.331 -6.497 -9.633) 12.784 11.749 ( -2.141 9.851 4.192) 10.918 12.052 ( 9.724 9.461 6.049) 14.854 12.353 ( 2.140 -3.832 6.282) 7.663 12.737 ( 3.183 -6.274 4.005) 8.096 13.105 ( 7.673 -10.010 -2.014) 12.773 13.247 ( 2.347 -5.906 6.670) 9.213 13.705 ( -0.120 -1.648 -7.132) 7.321 13.835 ( 6.212 -0.170 -13.595) 14.948 14.200 ( 1.216 8.513 7.808) 11.616 14.522 ( -0.837 3.341 -2.570) 4.297 14.732 ( -1.754 -4.620 2.850) 5.705 14.779 ( -1.800 0.735 4.999) 5.364 15.141 ( -2.098 5.091 17.121) 17.984 15.574 ( -3.003 -3.342 0.261) 4.501 15.890 ( -0.746 3.328 -5.232) 6.246 16.112 ( 3.006 -2.062 -2.658) 4.511 19.032 ( -0.533 3.809 1.605) 4.168 19.315 ( 1.392 -3.010 1.113) 3.498 24.890 ( 4.859 5.097 -2.471) 7.463 25.296 ( 9.668 -4.257 -14.301) 17.780 25.736 ( -12.941 -1.902 13.425) 18.744 25.808 ( -0.649 -2.235 3.253) 4.000 26.554 ( -0.447 4.619 3.282) 5.684 26.881 ( -4.327 -4.245 3.469) 6.984 27.013 ( 1.923 -0.044 1.433) 2.398 27.030 ( 3.821 -0.181 2.326) 4.477 27.239 ( 5.996 5.188 3.356) 8.610 27.557 ( 3.777 -3.326 0.798) 5.096 29.485 ( -12.081 10.760 -16.219) 22.908 30.263 ( -7.077 -8.500 -15.992) 19.444 32.338 ( 0.886 5.203 0.786) 5.337 32.780 ( 6.970 -6.020 -1.534) 9.337 ======================= Grid point 73 (37/150) ======================= q-point: (-0.36 0.20 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.890 ( -8.315 -2.061 -6.157) 10.550 2.233 ( -2.207 6.181 2.822) 7.144 2.848 ( -16.967 -8.255 -10.469) 21.578 3.160 ( -12.335 4.417 0.018) 13.102 3.207 ( -9.669 -4.386 -5.767) 12.082 3.528 ( -18.230 -7.350 -6.773) 20.790 3.824 ( 6.493 0.753 0.091) 6.537 3.913 ( -0.286 -4.052 4.366) 5.964 4.226 ( -8.529 -10.333 -19.189) 23.404 4.315 ( -14.436 -0.891 -0.528) 14.474 4.699 ( -1.976 10.337 2.632) 10.848 4.851 ( -2.914 8.111 3.116) 9.165 5.331 ( -3.294 13.584 -26.157) 29.658 5.489 ( -2.929 15.162 -11.202) 19.077 5.680 ( -1.604 -0.484 -4.231) 4.550 5.945 ( -0.626 2.211 0.465) 2.344 6.268 ( -9.669 -10.085 -2.197) 14.143 6.482 ( -3.992 -0.859 -12.512) 13.162 6.515 ( -2.003 -5.589 -4.485) 7.441 6.766 ( 2.190 -7.781 -4.817) 9.409 7.067 ( -1.893 -1.160 -0.739) 2.340 7.091 ( 1.190 -4.672 0.683) 4.870 7.848 ( 0.803 7.202 -1.951) 7.504 7.991 ( -0.821 4.434 1.588) 4.781 8.207 ( -1.992 4.188 4.502) 6.463 8.583 ( 15.860 -6.035 -9.302) 19.352 9.012 ( 7.634 -0.902 -1.283) 7.794 9.359 ( 1.679 -16.093 -2.486) 16.370 9.514 ( 3.648 2.492 3.775) 5.811 9.741 ( 2.629 -4.654 4.949) 7.284 10.417 ( 4.671 14.228 0.438) 14.982 10.714 ( -4.729 4.518 -5.296) 8.415 10.965 ( -3.062 -4.276 -10.852) 12.060 11.027 ( 1.559 -2.042 -3.310) 4.190 11.764 ( 2.076 4.757 5.258) 7.388 12.202 ( 3.273 8.750 2.784) 9.748 12.402 ( 2.842 -8.278 8.268) 12.040 12.784 ( 0.698 -3.849 6.057) 7.210 13.214 ( 3.019 -6.190 1.076) 6.971 13.295 ( 1.526 -4.000 7.273) 8.440 13.641 ( -4.839 2.806 -5.012) 7.511 14.000 ( 12.017 -1.603 -10.440) 15.999 14.243 ( 0.977 6.937 8.170) 10.762 14.508 ( 0.241 3.868 -3.928) 5.518 14.657 ( -5.783 -3.741 2.720) 7.405 14.760 ( -1.530 -0.553 9.047) 9.192 15.136 ( -1.984 4.584 18.410) 19.075 15.598 ( 6.659 -5.272 -6.114) 10.465 15.903 ( 3.495 4.948 -5.627) 8.268 16.202 ( 6.611 -2.058 -5.055) 8.573 19.037 ( 0.870 5.272 0.944) 5.426 19.351 ( 1.780 -2.497 3.224) 4.449 24.988 ( 5.222 4.451 1.767) 7.086 25.367 ( -5.455 -4.906 -0.629) 7.364 25.577 ( 0.430 2.221 -1.957) 2.991 25.832 ( 2.663 -4.159 1.635) 5.202 26.569 ( 1.450 2.179 4.247) 4.988 26.753 ( -7.381 -2.390 -0.764) 7.796 27.094 ( 5.630 -0.823 5.602) 7.984 27.154 ( 7.136 -1.951 7.168) 10.301 27.376 ( 6.689 6.032 5.007) 10.305 27.667 ( 6.377 -2.451 0.238) 6.836 29.127 ( -20.648 11.964 -21.618) 32.200 30.065 ( -9.521 -11.828 -22.008) 26.738 32.368 ( 2.082 8.024 0.833) 8.332 32.964 ( 11.900 -7.382 -0.227) 14.006 ======================= Grid point 74 (38/150) ======================= q-point: (-0.27 0.20 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.780 ( -0.728 6.642 -12.248) 13.952 2.164 ( -10.717 4.290 -3.394) 12.032 2.310 ( -27.072 -3.138 -20.307) 33.987 2.779 ( -28.189 -8.345 6.068) 30.018 2.993 ( -21.826 -5.020 -10.104) 24.570 3.178 ( -2.770 -10.683 -14.841) 18.495 3.766 ( -9.151 -14.769 0.706) 17.389 3.970 ( -15.943 2.387 -2.247) 16.276 4.032 ( 7.041 -3.098 -1.161) 7.779 4.142 ( -1.581 -2.251 1.201) 3.001 4.637 ( -6.359 25.256 8.658) 27.446 4.822 ( 2.234 7.541 -0.250) 7.869 5.223 ( -0.481 3.938 -28.199) 28.477 5.499 ( 4.125 22.916 -9.653) 25.206 5.662 ( -0.262 -1.312 3.266) 3.529 6.010 ( 4.984 3.717 -1.745) 6.458 6.067 ( -8.719 -6.303 1.001) 10.805 6.365 ( -4.530 2.788 -12.601) 13.678 6.515 ( 1.361 -12.785 -5.651) 14.044 6.771 ( -2.434 -6.728 4.571) 8.490 6.982 ( -6.280 -5.837 2.705) 8.990 7.171 ( 7.195 -3.530 -2.095) 8.283 7.907 ( 4.095 7.421 1.305) 8.576 7.952 ( -2.454 6.857 1.024) 7.354 8.177 ( -2.090 -0.841 0.855) 2.409 8.827 ( 10.369 -13.244 -15.420) 22.819 9.173 ( 9.009 -1.274 -3.036) 9.592 9.398 ( 2.937 -14.620 -2.979) 15.207 9.591 ( 3.588 3.008 6.507) 8.017 9.788 ( 1.096 -3.143 4.622) 5.695 10.517 ( 3.483 7.701 -1.811) 8.644 10.651 ( 0.889 6.560 -3.036) 7.283 10.808 ( -7.373 -1.530 -11.283) 13.565 11.139 ( 7.881 -5.269 -0.061) 9.480 11.831 ( 3.609 2.869 3.338) 5.692 12.210 ( -0.858 3.940 1.232) 4.216 12.493 ( 3.583 -4.504 6.140) 8.416 12.758 ( -4.946 -3.850 6.149) 8.781 13.219 ( -3.237 2.500 4.222) 5.878 13.346 ( 2.055 -4.695 4.163) 6.602 13.538 ( -3.255 5.715 -3.428) 7.417 14.181 ( 6.035 2.529 -3.710) 7.523 14.247 ( -1.920 1.251 3.363) 4.069 14.519 ( 0.689 4.590 -4.275) 6.310 14.541 ( -4.565 0.440 -0.010) 4.586 14.769 ( 0.301 -2.486 12.033) 12.291 15.153 ( 0.292 5.419 21.156) 21.841 15.815 ( 17.220 -10.293 -10.571) 22.677 15.999 ( 7.208 6.484 -4.741) 10.792 16.339 ( 8.865 -0.565 -6.803) 11.188 19.071 ( 2.444 7.088 0.865) 7.547 19.390 ( 0.997 -1.558 6.586) 6.840 25.096 ( 4.953 1.720 7.380) 9.053 25.159 ( -13.248 0.155 8.798) 15.904 25.682 ( 8.356 1.033 -11.702) 14.416 25.925 ( 7.033 -5.725 -0.977) 9.121 26.618 ( -0.406 -0.245 2.436) 2.481 26.645 ( -0.222 0.261 2.612) 2.634 27.240 ( 7.533 -1.584 8.839) 11.721 27.317 ( 7.744 -2.284 9.644) 12.577 27.501 ( 4.920 6.002 4.715) 9.081 27.774 ( 4.153 -2.225 -1.272) 4.880 28.619 ( -26.532 13.924 -25.836) 39.564 29.800 ( -13.149 -17.960 -26.509) 34.615 32.421 ( 3.272 12.810 0.473) 13.230 33.223 ( 14.515 -9.259 -0.022) 17.217 ======================= Grid point 75 (39/150) ======================= q-point: (-0.18 0.20 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.473 ( -37.332 8.454 -11.389) 39.936 1.720 ( -16.524 10.604 6.011) 20.533 2.058 ( -11.857 -6.512 -19.110) 23.414 2.328 ( -9.497 -7.173 -0.591) 11.916 2.617 ( -7.875 -12.624 -8.364) 17.069 3.136 ( -5.458 4.945 -2.013) 7.635 3.547 ( -12.845 7.348 5.868) 15.919 3.687 ( -9.362 -10.385 2.198) 14.153 4.057 ( -3.337 -0.217 4.735) 5.797 4.220 ( 6.488 -1.994 2.755) 7.325 4.586 ( 0.302 15.368 4.554) 16.031 4.923 ( 7.442 -2.077 -6.922) 10.374 5.211 ( 4.692 2.229 -20.520) 21.168 5.552 ( 1.048 7.400 1.370) 7.598 5.713 ( 5.986 9.886 2.453) 11.815 5.854 ( -8.698 -5.294 -2.254) 10.429 6.162 ( 1.887 0.191 3.425) 3.915 6.269 ( 0.157 7.806 -12.060) 14.367 6.492 ( -2.577 -9.717 -5.436) 11.428 6.709 ( -4.409 -3.094 4.865) 7.258 6.853 ( -7.941 -10.791 7.200) 15.210 7.347 ( 10.157 -3.444 -1.932) 10.898 7.848 ( -5.350 11.537 3.231) 13.121 8.026 ( 2.323 -1.490 1.516) 3.148 8.125 ( -2.570 -1.804 -1.753) 3.596 8.840 ( -5.499 -16.578 -30.983) 35.567 9.318 ( 6.449 -3.364 -5.848) 9.333 9.465 ( 4.617 -8.541 -3.480) 10.314 9.722 ( 8.047 1.870 10.736) 13.547 9.824 ( 2.975 -1.744 14.006) 14.424 10.506 ( -1.917 2.210 -6.735) 7.343 10.619 ( -3.749 -0.641 -4.285) 5.729 10.819 ( 8.769 4.995 0.403) 10.100 11.314 ( 9.824 -7.347 0.951) 12.305 11.903 ( 3.137 2.516 0.551) 4.058 12.210 ( 0.849 0.837 -0.676) 1.371 12.529 ( -1.358 -3.667 4.035) 5.619 12.636 ( -8.352 -1.367 7.616) 11.385 13.122 ( -6.477 12.316 4.652) 14.672 13.372 ( 0.724 -6.743 0.133) 6.783 13.520 ( 0.466 5.498 -2.736) 6.158 14.102 ( -11.046 1.543 6.072) 12.699 14.250 ( -0.494 -1.516 -2.077) 2.618 14.454 ( -2.234 6.536 -4.383) 8.180 14.579 ( 4.886 7.852 -9.423) 13.203 14.797 ( -0.475 -4.820 8.752) 10.003 15.271 ( 8.620 9.752 21.598) 25.216 16.119 ( 9.592 -0.593 -9.898) 13.796 16.204 ( 18.956 -7.294 -3.948) 20.690 16.544 ( 15.688 1.302 -5.974) 16.838 19.133 ( 3.684 9.188 1.263) 9.979 19.408 ( -1.093 -0.437 11.098) 11.161 24.937 ( -11.159 2.139 8.284) 14.062 25.206 ( 3.856 -5.941 13.545) 15.285 25.832 ( 10.352 4.163 -9.922) 14.931 26.099 ( 11.162 -5.474 -4.003) 13.061 26.597 ( 1.408 3.590 0.674) 3.915 26.733 ( 4.745 -1.060 8.107) 9.453 27.395 ( 5.920 -2.053 7.653) 9.891 27.478 ( 5.603 -2.922 10.129) 11.938 27.573 ( 1.416 4.789 2.793) 5.722 27.799 ( -2.738 -1.956 -3.771) 5.054 28.030 ( -25.752 17.113 -26.464) 40.698 29.434 ( -19.731 -26.608 -25.127) 41.577 32.500 ( 5.219 19.463 -1.401) 20.199 33.503 ( 13.761 -11.925 -1.194) 18.248 ======================= Grid point 76 (40/150) ======================= q-point: (-0.09 0.20 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.977 ( -6.275 14.525 31.347) 35.113 1.221 ( -28.686 10.518 23.027) 38.259 1.883 ( 1.156 -8.552 4.064) 9.539 2.273 ( -15.309 30.586 10.459) 35.766 2.594 ( 8.786 -13.305 -9.849) 18.741 3.053 ( 6.220 12.431 1.585) 13.990 3.449 ( 0.126 8.476 -0.990) 8.534 3.575 ( -4.067 -21.157 7.748) 22.895 3.999 ( -4.070 1.478 8.289) 9.352 4.343 ( 5.617 -4.163 3.526) 7.830 4.616 ( 0.681 7.597 2.685) 8.086 5.030 ( 4.643 -7.670 -7.152) 11.469 5.335 ( 10.922 -4.957 -10.351) 15.843 5.560 ( -0.107 -3.610 5.929) 6.942 5.694 ( -5.499 -3.121 1.912) 6.606 5.925 ( 12.100 11.786 -4.985) 17.612 6.076 ( -4.173 -2.119 0.698) 4.732 6.241 ( -6.774 0.882 -5.062) 8.502 6.506 ( 4.472 1.913 1.244) 5.021 6.630 ( -4.263 -2.610 0.938) 5.086 6.715 ( -6.944 -13.461 11.464) 18.996 7.462 ( -0.322 -7.926 -0.731) 7.966 7.688 ( -21.482 -6.608 -4.403) 22.903 7.927 ( -1.916 8.454 -2.971) 9.163 8.110 ( -0.937 2.475 -0.491) 2.692 8.596 ( -7.868 6.417 -28.383) 30.144 9.397 ( 2.728 -6.024 -3.998) 7.727 9.554 ( 5.041 -4.929 -2.860) 7.608 9.802 ( 0.907 6.034 5.612) 8.290 10.107 ( 17.169 -8.886 29.492) 35.263 10.463 ( 1.153 -0.690 -7.732) 7.847 10.633 ( 5.051 -3.886 2.115) 6.715 10.979 ( 6.358 4.045 1.020) 7.605 11.498 ( 8.223 -10.081 1.455) 13.090 11.944 ( 1.102 2.783 -1.976) 3.586 12.229 ( 0.997 -3.441 -1.832) 4.024 12.448 ( -8.244 -0.403 8.045) 11.526 12.499 ( -6.381 -2.223 4.417) 8.073 13.023 ( -4.578 18.100 2.834) 18.884 13.390 ( 0.993 -3.650 -0.948) 3.900 13.509 ( -0.446 2.303 -2.953) 3.771 13.876 ( -11.894 -2.310 2.308) 12.334 14.184 ( -6.142 1.723 0.253) 6.384 14.406 ( -1.182 6.752 -10.433) 12.484 14.661 ( 4.716 6.767 -8.085) 11.550 14.770 ( -3.104 -5.552 -0.454) 6.378 15.591 ( 20.278 15.388 4.677) 25.882 16.237 ( 5.283 3.988 -9.247) 11.372 16.503 ( 11.934 -3.637 -3.081) 12.851 16.992 ( 29.241 -10.930 -4.435) 31.530 19.200 ( 2.079 9.161 1.110) 9.460 19.387 ( -4.411 0.013 13.750) 14.440 24.769 ( -7.678 2.696 6.680) 10.528 25.243 ( -5.956 -20.327 15.031) 25.973 26.103 ( 19.907 8.781 -10.835) 24.306 26.311 ( 10.620 -4.197 -7.583) 13.708 26.723 ( 12.244 5.643 10.158) 16.880 26.816 ( 0.710 -0.664 2.870) 3.030 27.187 ( -29.188 19.079 -29.557) 45.712 27.498 ( 1.729 -0.685 3.880) 4.302 27.573 ( -2.457 3.059 0.643) 3.976 27.659 ( -3.405 1.341 10.689) 11.298 27.875 ( 4.695 1.847 -0.620) 5.083 28.977 ( -20.238 -33.825 0.450) 39.419 32.627 ( 9.067 26.743 -7.830) 29.304 33.694 ( 4.253 -15.241 -5.717) 16.825 ======================= Grid point 77 (41/150) ======================= q-point: ( 0.00 0.40 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.583 ( 21.004 21.873 27.236) 40.760 1.765 ( 12.519 34.180 13.246) 38.736 1.920 ( 21.885 -15.073 28.062) 38.647 2.387 ( 11.141 -25.712 -6.643) 28.798 2.922 ( 2.741 38.335 9.791) 39.660 3.276 ( 4.233 -6.532 4.164) 8.827 3.437 ( 10.261 2.793 10.917) 15.240 3.533 ( 1.292 -1.062 9.526) 9.672 3.974 ( -6.704 7.331 11.626) 15.292 4.286 ( -2.861 -16.337 13.075) 21.120 4.593 ( -8.733 3.325 2.657) 9.715 4.767 ( -3.434 -17.982 2.456) 18.470 5.418 ( 6.595 0.102 -4.214) 7.827 5.498 ( 2.885 -7.295 -1.906) 8.073 5.619 ( -2.199 6.220 -1.050) 6.681 5.789 ( -3.991 -12.281 -4.202) 13.580 6.150 ( 2.107 4.956 2.897) 6.115 6.225 ( 4.986 -3.438 4.076) 7.300 6.543 ( 1.239 4.315 3.039) 5.421 6.579 ( 2.055 1.165 7.112) 7.494 6.793 ( 3.673 6.204 2.034) 7.491 6.958 ( -4.741 -10.058 4.092) 11.849 7.669 ( 2.413 12.014 -10.267) 15.987 7.886 ( 1.318 -9.613 -11.309) 14.901 8.386 ( -1.551 11.784 2.237) 12.094 8.528 ( -3.890 -3.281 -9.426) 10.712 9.382 ( 0.350 4.536 -0.513) 4.578 9.515 ( 1.633 -8.008 0.791) 8.211 10.034 ( 1.453 14.296 7.099) 16.028 10.308 ( 5.584 -14.024 9.094) 17.623 10.478 ( 6.596 7.094 5.037) 10.918 10.635 ( 7.299 -9.078 5.901) 13.058 11.151 ( 0.260 7.413 2.788) 7.924 11.340 ( -0.408 -12.988 3.674) 13.504 12.022 ( -0.410 5.465 -4.898) 7.350 12.129 ( 0.432 -6.017 -4.382) 7.456 12.308 ( -8.627 1.416 6.574) 10.938 12.337 ( -7.529 -1.662 6.450) 10.052 13.257 ( -2.887 11.423 -0.728) 11.805 13.374 ( -0.657 -2.921 -1.021) 3.163 13.558 ( 0.059 5.575 -2.626) 6.162 13.662 ( -1.104 -4.421 -3.033) 5.474 14.163 ( -4.639 9.322 -5.252) 11.662 14.360 ( -1.858 -9.335 -7.916) 12.380 14.613 ( -3.815 2.730 -5.415) 7.165 14.689 ( -1.186 -3.995 -4.844) 6.389 16.104 ( 7.153 9.441 -14.670) 18.855 16.260 ( 3.747 -6.546 -12.295) 14.424 16.827 ( 7.909 10.387 -10.377) 16.677 17.028 ( 2.713 -11.520 -9.446) 15.143 19.236 ( -7.387 1.044 7.593) 10.645 19.240 ( -10.655 0.467 8.600) 13.700 24.727 ( -5.222 3.930 5.237) 8.375 24.815 ( -8.672 -5.861 7.662) 12.972 26.402 ( 0.559 3.350 -18.395) 18.705 26.422 ( 6.828 0.463 -13.447) 15.089 26.666 ( -9.303 1.768 -2.660) 9.836 26.694 ( -11.192 -1.181 -3.813) 11.882 27.465 ( -5.624 1.164 -1.611) 5.965 27.484 ( -7.079 -0.684 -2.204) 7.446 27.593 ( 8.323 2.745 5.369) 10.278 27.626 ( 7.903 -0.377 5.348) 9.549 28.165 ( 16.974 10.520 17.013) 26.233 28.450 ( 18.803 -21.309 28.243) 40.066 33.166 ( 3.275 13.717 -13.253) 19.352 33.372 ( -6.310 -9.497 -6.582) 13.165 ======================= Grid point 78 (42/150) ======================= q-point: ( 0.09 0.40 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.890 ( 3.848 40.501 5.729) 41.085 2.130 ( 20.963 20.977 25.525) 39.128 2.458 ( 24.917 -15.498 25.950) 39.172 2.588 ( 8.314 -30.308 0.440) 31.431 3.115 ( 14.285 29.527 18.165) 37.495 3.306 ( -1.518 2.793 12.270) 12.676 3.547 ( 0.345 8.635 19.882) 21.679 3.745 ( 12.493 -2.051 6.733) 14.340 3.904 ( -0.590 2.721 3.671) 4.607 4.203 ( -5.149 -23.301 17.330) 29.492 4.528 ( 1.746 8.370 -3.263) 9.152 4.788 ( 4.356 -21.435 1.042) 21.898 5.436 ( -4.419 0.554 -3.097) 5.425 5.487 ( -0.634 -4.751 -7.699) 9.069 5.662 ( 4.831 2.710 3.402) 6.501 5.774 ( 2.802 -8.214 2.733) 9.099 6.199 ( 2.444 6.794 4.746) 8.640 6.313 ( 5.164 -5.113 2.165) 7.583 6.672 ( 10.821 10.177 1.590) 14.940 6.777 ( 9.963 0.753 9.307) 13.654 6.883 ( 4.374 -0.446 5.280) 6.870 6.986 ( 7.739 -10.737 1.339) 13.303 7.735 ( 5.930 10.707 -7.917) 14.577 7.904 ( 2.677 -5.834 -9.786) 11.703 8.311 ( -5.732 6.733 3.577) 9.538 8.413 ( -4.923 -3.889 -8.023) 10.185 9.368 ( -2.072 5.087 0.886) 5.564 9.510 ( -2.614 -8.514 1.912) 9.109 10.023 ( -4.535 13.929 8.416) 16.894 10.295 ( -7.149 -14.147 6.742) 17.225 10.646 ( 8.222 5.061 6.162) 11.453 10.739 ( 1.243 -5.031 5.125) 7.289 11.098 ( -6.836 6.394 3.823) 10.111 11.269 ( -7.331 -11.679 3.557) 14.241 11.972 ( -4.168 4.862 -3.475) 7.286 12.071 ( -5.657 -5.615 -3.544) 8.723 12.229 ( 0.666 0.656 -2.220) 2.409 12.253 ( -0.794 -1.641 -0.851) 2.012 13.199 ( -0.957 10.681 -2.752) 11.071 13.318 ( -2.528 -3.806 -1.804) 4.912 13.620 ( 3.622 8.017 -2.436) 9.129 13.747 ( 8.013 -4.433 -2.953) 9.622 14.093 ( -0.463 8.255 -8.115) 11.585 14.291 ( -4.130 -12.074 -8.985) 15.607 14.537 ( -1.432 6.637 -9.553) 11.720 14.646 ( -1.885 -5.107 -5.293) 7.593 16.105 ( -4.779 10.710 -8.337) 14.389 16.238 ( -3.747 -3.453 -9.107) 10.435 16.765 ( -14.101 7.216 -3.635) 16.252 16.846 ( -13.434 -1.177 -1.130) 13.532 19.112 ( -2.396 0.671 3.068) 3.950 19.134 ( -3.744 -1.468 5.603) 6.897 24.674 ( -0.705 2.367 1.274) 2.779 24.720 ( -2.041 -2.436 1.521) 3.523 26.234 ( -7.719 6.726 -9.307) 13.837 26.329 ( -10.120 -3.695 -11.064) 15.443 26.600 ( 1.439 3.349 2.679) 4.524 26.657 ( 2.433 -2.593 2.431) 4.308 27.279 ( -10.252 0.869 -3.121) 10.752 27.305 ( -9.692 -1.910 -3.178) 10.377 27.665 ( 0.820 7.080 2.750) 7.639 27.814 ( 4.136 -8.916 4.803) 10.940 28.665 ( 27.571 16.816 17.160) 36.571 29.085 ( 34.028 -30.612 20.610) 50.197 33.097 ( -8.891 9.011 -12.332) 17.672 33.184 ( -8.622 -1.763 -6.719) 11.072 ======================= Grid point 79 (43/150) ======================= q-point: ( 0.18 0.40 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.969 ( 6.856 35.362 10.244) 37.449 2.563 ( 17.403 12.038 8.943) 22.973 2.662 ( 0.672 -26.192 8.652) 27.593 2.892 ( 12.814 -14.238 16.017) 24.970 3.192 ( -6.672 1.847 14.295) 15.883 3.253 ( -7.667 -3.604 15.417) 17.592 3.849 ( 23.181 22.992 17.402) 36.998 3.902 ( 4.639 3.580 2.734) 6.466 3.984 ( 6.663 1.494 -0.750) 6.869 4.271 ( 7.399 -11.312 17.226) 21.896 4.585 ( 4.378 13.017 -3.149) 14.090 4.929 ( 9.598 -21.580 3.600) 23.891 5.355 ( -1.838 1.197 -4.786) 5.264 5.446 ( -0.912 -8.150 -10.519) 13.338 5.769 ( 4.832 3.094 4.104) 7.054 5.856 ( 3.824 -5.848 5.959) 9.183 6.288 ( 5.227 7.688 6.455) 11.318 6.435 ( 6.485 -7.461 0.693) 9.909 6.839 ( 4.609 9.316 0.683) 10.416 6.912 ( 2.407 10.998 8.550) 14.137 6.992 ( 7.252 -4.898 5.500) 10.336 7.179 ( 6.773 -13.102 6.802) 16.242 7.854 ( 7.353 8.316 -5.479) 12.379 7.943 ( 2.753 -0.004 -6.696) 7.239 8.207 ( -5.341 4.762 1.852) 7.392 8.355 ( 1.305 -11.298 -6.210) 12.958 9.299 ( -5.305 4.191 1.160) 6.860 9.422 ( -6.793 -7.757 1.406) 10.407 9.886 ( -10.695 8.900 6.921) 15.541 10.072 ( -16.090 -10.420 5.930) 20.065 10.735 ( -1.099 4.901 1.320) 5.193 10.825 ( 5.371 -4.432 2.249) 7.318 10.946 ( -4.144 9.182 3.453) 10.649 11.119 ( -7.268 -8.914 1.270) 11.571 11.858 ( -6.342 3.337 -1.160) 7.259 11.950 ( -5.214 -6.839 -4.386) 9.653 12.277 ( 3.783 0.125 -7.062) 8.012 12.287 ( 4.228 -0.890 -6.250) 7.598 13.207 ( 1.017 9.237 -3.948) 10.097 13.289 ( -1.178 -1.870 -0.531) 2.273 13.610 ( -3.034 11.001 -4.789) 12.376 13.861 ( 1.576 -12.310 -6.233) 13.888 14.113 ( 2.919 6.636 -7.573) 10.483 14.226 ( 3.016 -5.239 -6.268) 8.708 14.540 ( 3.189 3.851 -7.615) 9.110 14.612 ( -0.157 -3.818 -4.998) 6.291 15.884 ( -15.643 19.908 4.723) 25.756 16.103 ( -8.429 -4.098 -3.250) 9.920 16.476 ( -13.292 3.516 5.613) 14.851 16.580 ( -13.313 -5.254 -0.505) 14.321 19.105 ( 0.025 0.247 1.706) 1.724 19.132 ( 2.085 -2.711 0.792) 3.511 24.703 ( 3.579 1.187 -2.753) 4.669 24.724 ( 2.172 -1.070 -3.452) 4.217 26.123 ( -3.775 1.542 -0.436) 4.101 26.146 ( -6.964 -0.840 -2.487) 7.443 26.634 ( 0.946 3.936 4.044) 5.722 26.701 ( 1.214 -3.135 5.057) 6.072 27.094 ( -7.636 0.516 -3.620) 8.466 27.120 ( -8.184 -2.305 -3.801) 9.313 27.638 ( -3.728 9.563 0.080) 10.264 27.826 ( -3.060 -10.535 3.006) 11.375 29.203 ( 23.918 20.663 11.858) 33.759 29.677 ( 23.122 -30.923 10.457) 40.002 32.854 ( -11.942 12.104 -5.721) 17.940 33.009 ( -8.818 -5.249 -9.186) 13.772 ======================= Grid point 80 (44/150) ======================= q-point: ( 0.27 0.40 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.238 ( 18.591 16.555 2.532) 25.023 2.605 ( -5.265 -13.686 9.900) 17.693 2.800 ( -4.307 4.885 17.594) 18.760 2.947 ( -1.185 -10.489 6.900) 12.610 3.134 ( 2.339 1.563 13.309) 13.603 3.281 ( 5.347 -11.653 2.975) 13.162 3.990 ( 4.727 3.890 -0.432) 6.137 4.046 ( 3.728 -1.292 -1.539) 4.236 4.258 ( 10.395 13.571 4.318) 17.631 4.419 ( 2.433 -3.933 7.377) 8.707 4.750 ( 13.612 22.597 3.166) 26.570 5.101 ( 3.827 -10.355 7.896) 13.573 5.417 ( 10.952 -7.166 -3.846) 13.642 5.424 ( 1.611 -6.826 -11.094) 13.125 5.858 ( 3.823 3.476 0.759) 5.222 5.931 ( 3.050 -4.852 2.949) 6.445 6.385 ( 2.333 7.365 5.299) 9.368 6.535 ( 3.035 -7.801 -0.187) 8.373 6.903 ( 2.133 6.158 -0.778) 6.563 6.917 ( -2.592 7.510 10.029) 12.794 7.125 ( 4.330 -2.267 4.816) 6.862 7.219 ( -4.095 -8.418 13.783) 16.661 7.961 ( 2.182 5.338 -3.137) 6.564 7.980 ( 3.621 3.115 -4.104) 6.298 8.135 ( -1.224 10.332 -2.728) 10.756 8.411 ( 4.063 -18.465 -7.275) 20.259 9.173 ( -7.784 2.700 0.450) 8.251 9.266 ( -8.744 -6.799 0.829) 11.108 9.684 ( -10.238 3.584 3.391) 11.365 9.774 ( -13.593 -6.063 2.076) 15.028 10.675 ( -5.090 8.380 0.140) 9.806 10.781 ( -1.514 -0.885 -0.892) 1.967 11.010 ( -2.419 1.182 -0.447) 2.729 11.092 ( 6.687 -5.794 2.573) 9.215 11.765 ( -1.686 4.549 0.495) 4.877 11.893 ( 1.283 -9.290 -1.827) 9.554 12.312 ( 0.964 3.424 -6.575) 7.476 12.358 ( 3.709 -2.130 -8.225) 9.270 13.131 ( -7.963 11.525 -7.859) 16.062 13.252 ( -3.206 -2.056 -0.320) 3.822 13.574 ( 1.355 5.873 -4.537) 7.545 13.786 ( -3.954 -14.071 -10.662) 18.091 14.189 ( 5.467 10.339 -4.475) 12.522 14.350 ( 7.839 -6.321 -2.310) 10.332 14.598 ( 2.971 1.666 -3.159) 4.645 14.633 ( 3.637 -1.865 -3.429) 5.335 15.616 ( -13.033 20.048 13.447) 27.434 15.906 ( -11.534 -10.088 4.615) 16.003 16.257 ( -10.181 4.575 2.876) 11.526 16.366 ( -9.366 -6.162 -0.000) 11.211 19.114 ( 0.282 2.068 1.263) 2.440 19.173 ( 1.815 -4.132 -0.301) 4.523 24.774 ( 3.883 1.297 -6.386) 7.586 24.791 ( 6.168 -0.529 -6.313) 8.841 26.019 ( -5.855 1.921 2.549) 6.668 26.067 ( -3.893 -3.086 4.803) 6.910 26.654 ( 0.160 4.458 5.911) 7.405 26.729 ( 0.709 -3.557 6.757) 7.669 26.981 ( -3.449 -0.017 -3.021) 4.585 26.997 ( -3.116 -1.506 -3.394) 4.848 27.531 ( -6.817 10.278 -2.175) 12.523 27.726 ( -7.343 -10.412 0.725) 12.762 29.612 ( 16.355 19.951 5.418) 26.361 30.029 ( 12.463 -24.456 3.606) 27.685 32.643 ( -8.789 11.328 -3.480) 14.754 32.816 ( -8.826 -7.350 -7.398) 13.662 ======================= Grid point 81 (45/150) ======================= q-point: ( 0.36 0.40 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( -11.971 8.216 8.942) 17.052 2.532 ( 0.835 -2.606 6.419) 6.978 2.801 ( 12.855 -2.374 5.611) 14.226 2.964 ( 3.769 -17.110 3.064) 17.786 3.287 ( 7.104 1.892 6.860) 10.055 3.351 ( 1.544 -4.525 2.964) 5.626 4.073 ( 4.005 4.386 -0.410) 5.953 4.112 ( 3.095 0.756 0.304) 3.200 4.345 ( -0.384 8.312 -4.060) 9.259 4.426 ( -0.199 0.362 -3.690) 3.713 4.931 ( 0.907 11.360 7.199) 13.480 5.114 ( -3.461 -7.122 8.725) 11.782 5.507 ( 9.266 5.236 -11.716) 15.829 5.668 ( 11.887 -9.828 -4.534) 16.077 5.919 ( 2.844 5.879 -2.767) 7.093 5.997 ( 4.517 -4.568 -2.986) 7.084 6.366 ( -5.199 7.940 2.230) 9.749 6.537 ( -2.651 -8.872 -2.252) 9.529 6.828 ( -7.261 5.098 8.989) 12.630 6.930 ( -2.597 -3.527 4.218) 6.081 7.128 ( -2.723 0.980 2.517) 3.835 7.213 ( 3.350 -6.157 1.491) 7.166 7.941 ( -2.913 7.100 -1.778) 7.878 8.019 ( -0.517 -0.383 0.015) 0.644 8.154 ( 3.998 14.586 -6.933) 16.638 8.434 ( -0.081 -14.813 -7.142) 16.445 9.013 ( -7.753 3.177 -0.127) 8.379 9.135 ( -4.657 -10.193 1.398) 11.293 9.530 ( -5.890 2.648 2.318) 6.861 9.596 ( -5.464 -4.626 1.768) 7.375 10.609 ( -1.206 11.111 -0.841) 11.207 10.774 ( 0.643 -6.144 -1.917) 6.468 10.965 ( -1.807 7.109 -1.204) 7.433 11.134 ( -2.524 -10.406 -0.139) 10.709 11.839 ( 8.348 8.329 3.933) 12.431 12.012 ( 10.254 -9.740 1.757) 14.251 12.276 ( -3.927 8.393 -3.847) 10.033 12.378 ( 0.147 -3.745 -7.314) 8.218 12.968 ( -5.035 8.754 -7.800) 12.761 13.142 ( -6.919 -8.103 -0.754) 10.682 13.621 ( 3.749 2.873 -5.507) 7.255 13.735 ( 0.609 -8.004 -9.148) 12.170 14.278 ( 4.345 11.118 -2.438) 12.183 14.471 ( 4.916 -8.475 -3.053) 10.262 14.645 ( 2.192 3.076 0.725) 3.846 14.708 ( 3.531 -3.009 -0.464) 4.662 15.442 ( -8.241 16.121 15.612) 23.907 15.707 ( -10.014 -11.556 9.407) 17.953 16.097 ( -6.647 5.604 -0.258) 8.698 16.199 ( -7.861 -5.078 -0.614) 9.378 19.117 ( -0.146 3.545 1.233) 3.757 19.198 ( 0.871 -4.818 -0.169) 4.899 24.842 ( 4.737 4.184 -7.825) 10.058 24.911 ( 7.671 -2.942 -9.154) 12.300 25.917 ( -5.653 2.142 5.409) 8.112 25.982 ( -6.385 -4.857 8.273) 11.524 26.666 ( -0.194 5.210 6.780) 8.553 26.758 ( 0.762 -4.634 6.832) 8.290 26.957 ( 1.458 1.237 -1.371) 2.353 26.983 ( 1.452 -1.370 -1.281) 2.372 27.385 ( -7.048 9.765 -3.467) 12.532 27.567 ( -8.316 -9.536 -1.112) 12.702 29.849 ( 7.697 17.538 -1.748) 19.232 30.188 ( 4.207 -18.117 -2.868) 18.819 32.504 ( -4.935 8.765 -1.967) 10.249 32.658 ( -5.754 -7.529 -4.944) 10.688 ======================= Grid point 82 (46/150) ======================= q-point: ( 0.45 0.40 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.244 ( -9.660 6.860 3.705) 12.414 2.389 ( -11.879 -7.178 10.336) 17.305 3.091 ( 9.253 -1.372 -1.568) 9.485 3.169 ( 16.254 -8.533 -4.865) 18.991 3.327 ( -1.775 4.361 5.327) 7.110 3.427 ( 3.527 -5.853 6.308) 9.300 4.103 ( -1.912 9.500 -2.893) 10.113 4.164 ( -1.018 3.840 -1.409) 4.215 4.307 ( 2.811 2.750 -2.323) 4.568 4.390 ( -2.909 -4.341 -12.073) 13.155 4.859 ( -8.866 5.422 10.153) 14.529 5.020 ( -7.278 -9.517 10.419) 15.878 5.633 ( 5.221 9.986 -14.163) 18.099 5.787 ( 2.472 -4.484 -9.928) 11.170 5.945 ( -0.074 11.957 -4.482) 12.770 6.105 ( 4.736 -5.428 -9.682) 12.068 6.236 ( -4.812 2.385 -3.498) 6.409 6.423 ( -8.090 -12.981 -3.792) 15.758 6.697 ( -6.500 4.283 4.267) 8.877 6.827 ( -6.824 -10.104 2.774) 12.504 7.129 ( 1.011 7.966 -7.822) 11.210 7.248 ( -1.240 -4.133 -4.976) 6.587 7.885 ( -0.573 5.307 1.441) 5.529 7.977 ( -2.264 -2.789 2.019) 4.121 8.235 ( 4.823 11.545 -6.802) 14.241 8.409 ( -1.009 -5.166 -4.007) 6.616 8.911 ( -2.496 4.175 -0.226) 4.870 9.076 ( -2.073 -13.380 1.279) 13.600 9.469 ( -1.096 3.735 3.496) 5.232 9.552 ( -0.137 -5.122 3.653) 6.293 10.614 ( 1.406 12.573 -1.173) 12.706 10.790 ( 1.305 -6.479 -1.653) 6.813 10.936 ( -1.186 4.738 -2.267) 5.385 11.059 ( -3.626 -8.675 -2.313) 9.683 12.047 ( 10.272 11.433 4.684) 16.067 12.132 ( -5.743 13.245 -1.111) 14.479 12.233 ( 4.801 -4.753 4.484) 8.108 12.385 ( 4.781 -12.983 -2.403) 14.042 12.923 ( 1.004 1.961 -4.555) 5.060 13.048 ( -1.479 -9.981 1.182) 10.159 13.678 ( 3.319 2.450 -6.829) 7.978 13.751 ( 2.556 -4.403 -8.421) 9.841 14.345 ( 2.845 11.378 0.196) 11.730 14.534 ( 2.636 -6.952 -3.309) 8.138 14.671 ( -0.230 2.326 2.903) 3.727 14.749 ( 0.524 -4.263 1.188) 4.456 15.348 ( -5.037 12.811 15.080) 20.418 15.563 ( -7.076 -9.474 9.467) 15.147 16.000 ( -3.101 4.264 -2.495) 5.833 16.075 ( -4.053 -3.639 -1.808) 5.739 19.117 ( -0.044 4.763 1.255) 4.926 19.212 ( 0.778 -5.186 0.316) 5.254 24.925 ( 5.447 6.809 -7.632) 11.588 25.046 ( 8.273 -5.694 -10.779) 14.733 25.825 ( -5.015 0.384 6.693) 8.372 25.860 ( -7.979 -3.514 10.038) 13.296 26.673 ( -0.579 6.249 6.708) 9.186 26.786 ( 0.514 -5.693 7.059) 9.083 27.001 ( 1.990 0.783 -0.479) 2.191 27.011 ( 0.639 -0.182 -0.762) 1.011 27.289 ( -0.866 8.109 -1.840) 8.360 27.442 ( -3.013 -7.905 -1.140) 8.536 29.896 ( -1.787 15.797 -9.300) 18.418 30.186 ( -2.985 -14.547 -9.605) 17.686 32.446 ( -0.802 7.369 -0.645) 7.441 32.589 ( -0.374 -7.674 -2.441) 8.062 ======================= Grid point 83 (47/150) ======================= q-point: (-0.45 0.40 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.079 ( -8.326 3.849 -2.174) 9.427 2.211 ( -6.007 -8.724 2.305) 10.841 3.150 ( -8.476 11.481 3.926) 14.801 3.260 ( 1.449 0.530 -0.951) 1.812 3.403 ( -1.235 -6.134 3.167) 7.013 3.450 ( -0.689 -7.069 6.797) 9.831 3.985 ( -6.047 10.792 -8.166) 14.823 4.075 ( -5.291 9.727 -1.472) 11.170 4.237 ( -9.410 -8.466 -19.909) 23.592 4.409 ( -2.595 -19.679 -9.727) 22.105 4.732 ( 1.924 14.707 10.174) 17.987 4.926 ( -3.004 -5.677 7.577) 9.933 5.665 ( 1.012 9.817 -13.791) 16.958 5.743 ( -4.352 0.523 -15.844) 16.439 5.900 ( -2.525 16.842 -6.245) 18.139 6.025 ( -5.133 1.632 -6.157) 8.181 6.213 ( -5.151 -10.413 -7.558) 13.859 6.304 ( 0.477 -16.400 -2.547) 16.603 6.613 ( -2.809 3.379 -2.407) 5.010 6.704 ( -5.197 -6.827 -8.014) 11.740 7.074 ( -5.066 4.467 -4.256) 7.983 7.147 ( -6.353 -1.989 -4.641) 8.115 7.941 ( 4.484 4.409 2.632) 6.817 8.007 ( 4.298 -0.614 3.237) 5.416 8.299 ( 3.376 4.474 -6.833) 8.838 8.371 ( -1.820 -0.109 -3.669) 4.097 8.914 ( 2.742 3.336 0.088) 4.319 9.062 ( 0.617 -12.667 1.168) 12.736 9.498 ( 2.920 4.249 4.529) 6.862 9.586 ( 2.427 -5.155 5.105) 7.650 10.638 ( 1.055 12.587 -0.823) 12.658 10.817 ( 1.511 -6.970 -1.648) 7.319 10.897 ( -1.985 4.629 -4.623) 6.836 11.003 ( -1.705 -6.631 -5.275) 8.643 11.982 ( -6.337 14.025 3.135) 15.707 12.221 ( -4.274 -10.673 4.329) 12.285 12.280 ( 10.394 14.655 4.183) 18.447 12.557 ( 8.645 -13.581 4.921) 16.835 12.988 ( 6.405 -0.025 -2.374) 6.831 13.090 ( 4.298 -9.090 2.601) 10.386 13.723 ( 2.639 3.547 -5.099) 6.749 13.801 ( 4.716 -3.797 -7.836) 9.903 14.387 ( 0.991 11.038 3.210) 11.538 14.566 ( 1.182 -4.965 -2.143) 5.535 14.644 ( -2.932 1.544 2.910) 4.410 14.736 ( -1.789 -4.959 1.537) 5.491 15.298 ( -3.247 10.387 13.163) 17.079 15.472 ( -3.625 -7.724 5.855) 10.348 15.969 ( 0.699 4.787 -3.855) 6.186 16.054 ( 2.234 -4.107 -2.882) 5.492 19.126 ( 0.833 5.962 1.473) 6.197 19.235 ( 1.534 -5.443 1.269) 5.796 25.019 ( 5.394 8.352 -5.123) 11.185 25.178 ( 7.130 -8.163 -9.652) 14.513 25.722 ( -7.562 0.733 9.305) 12.013 25.758 ( -3.220 -2.767 5.360) 6.837 26.660 ( -2.147 6.444 4.613) 8.211 26.780 ( -3.269 -6.287 4.843) 8.583 27.017 ( 1.390 0.416 1.208) 1.888 27.025 ( 2.088 -0.407 1.114) 2.401 27.354 ( 6.348 6.691 1.752) 9.388 27.472 ( 5.299 -5.746 0.812) 7.859 29.745 ( -10.987 16.170 -16.041) 25.288 30.041 ( -9.135 -14.838 -16.017) 23.667 32.469 ( 3.060 8.520 0.152) 9.054 32.636 ( 5.347 -9.020 -0.688) 10.508 ======================= Grid point 84 (48/150) ======================= q-point: (-0.36 0.40 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.941 ( -3.230 8.424 -8.862) 12.646 2.168 ( 0.719 -12.894 -6.576) 14.492 2.860 ( -21.168 11.577 5.395) 24.723 3.116 ( -17.058 -10.526 1.143) 20.077 3.221 ( -16.581 3.714 6.964) 18.364 3.348 ( -15.324 -8.021 0.648) 17.308 3.858 ( -9.076 4.535 -15.807) 18.783 3.973 ( -2.207 3.331 -20.983) 21.360 4.039 ( -2.569 -4.078 -4.558) 6.634 4.189 ( -9.727 -10.113 -6.613) 15.512 4.913 ( 4.970 9.329 0.525) 10.583 4.980 ( 9.545 2.844 0.875) 9.998 5.553 ( -8.873 9.797 -15.100) 20.068 5.644 ( -2.123 -0.232 -5.159) 5.583 5.861 ( 0.239 14.360 -5.990) 15.561 5.965 ( -0.627 0.658 -3.173) 3.300 6.088 ( -6.065 -3.827 3.056) 7.795 6.297 ( -1.285 -14.404 -4.516) 15.150 6.541 ( -3.443 3.309 -12.223) 13.123 6.622 ( -0.748 -6.334 -11.251) 12.933 6.997 ( -1.616 -2.224 0.178) 2.754 7.023 ( -4.934 -3.861 -0.661) 6.300 8.028 ( 2.893 9.687 0.182) 10.112 8.079 ( 2.354 3.500 2.936) 5.139 8.268 ( -4.592 3.296 -2.990) 6.395 8.417 ( 6.236 -11.207 -8.352) 15.305 9.011 ( 6.958 1.953 0.173) 7.229 9.111 ( 4.326 -9.253 1.136) 10.277 9.577 ( 3.776 3.893 4.829) 7.262 9.655 ( 3.193 -4.501 5.615) 7.873 10.656 ( 1.101 11.114 -0.894) 11.204 10.806 ( -2.138 0.433 -2.968) 3.684 10.866 ( -0.784 -1.633 -8.083) 8.283 10.959 ( -0.830 -5.379 -4.929) 7.343 11.911 ( -1.776 10.940 5.606) 12.420 12.144 ( -4.056 -13.085 6.364) 15.105 12.465 ( 7.665 13.271 3.989) 15.836 12.685 ( 3.148 -8.572 6.587) 11.260 13.115 ( 5.932 -1.448 -2.806) 6.720 13.180 ( 3.754 -6.845 1.492) 7.948 13.760 ( 1.835 8.882 -0.399) 9.078 13.921 ( 8.813 -7.325 -4.543) 12.328 14.391 ( -1.390 9.072 5.020) 10.462 14.551 ( -3.380 -7.500 2.400) 8.569 14.602 ( -0.264 5.814 -1.488) 6.008 14.708 ( -1.015 -4.938 1.436) 5.242 15.281 ( -0.690 9.993 10.246) 14.329 15.463 ( 2.516 -9.002 0.235) 9.350 16.018 ( 5.195 6.879 -3.905) 9.464 16.135 ( 6.524 -5.241 -3.865) 9.218 19.158 ( 2.171 7.135 2.295) 7.803 19.278 ( 2.412 -5.414 3.032) 6.657 25.101 ( 3.228 7.416 0.541) 8.106 25.246 ( -0.344 -7.737 -0.736) 7.779 25.640 ( -0.424 4.498 0.238) 4.524 25.737 ( 0.690 -5.624 1.169) 5.785 26.625 ( -1.598 3.610 2.685) 4.774 26.695 ( -4.841 -3.733 0.856) 6.173 27.092 ( 5.409 0.728 6.354) 8.376 27.118 ( 6.159 -1.815 6.853) 9.391 27.495 ( 7.072 6.393 2.755) 9.924 27.600 ( 6.821 -4.759 1.227) 8.407 29.420 ( -18.462 18.644 -21.098) 33.669 29.774 ( -14.553 -18.554 -21.218) 31.722 32.560 ( 6.203 11.904 0.133) 13.424 32.783 ( 9.684 -11.585 -0.151) 15.100 ======================= Grid point 85 (49/150) ======================= q-point: (-0.27 0.40 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( 3.556 9.715 -15.173) 18.365 2.132 ( -6.038 -10.094 -12.381) 17.077 2.402 ( -24.435 16.689 5.329) 30.066 2.719 ( -31.752 3.672 -3.202) 32.124 2.772 ( -22.433 -17.173 3.686) 28.491 2.919 ( -15.924 -16.740 -15.808) 27.995 3.680 ( -5.530 6.323 -14.074) 16.390 3.855 ( -5.536 -9.956 -14.993) 18.830 4.077 ( 3.625 2.982 2.966) 5.552 4.113 ( 0.245 -1.190 2.242) 2.550 4.967 ( 2.228 12.476 -5.377) 13.767 5.086 ( -0.402 4.946 -0.649) 5.005 5.349 ( -8.953 16.385 -7.886) 20.269 5.607 ( -2.794 -4.830 4.257) 7.018 5.874 ( 0.083 6.367 -6.277) 8.941 5.917 ( -4.529 -4.068 5.452) 8.172 6.043 ( 1.079 3.448 5.309) 6.422 6.259 ( -1.365 -13.388 -4.504) 14.191 6.474 ( 0.525 7.682 -16.038) 17.791 6.620 ( 2.517 -7.853 -7.542) 11.175 6.919 ( -4.306 1.913 -0.180) 4.715 7.053 ( 5.322 -9.127 -1.464) 10.667 8.040 ( -1.177 5.717 -1.654) 6.067 8.124 ( 0.220 0.126 2.480) 2.493 8.158 ( -4.311 10.754 -4.163) 12.311 8.482 ( 1.418 -20.498 -7.275) 21.797 9.162 ( 8.074 1.824 -0.930) 8.330 9.234 ( 7.967 -5.390 -0.415) 9.628 9.657 ( 3.704 3.793 5.759) 7.828 9.725 ( 3.017 -3.547 5.741) 7.392 10.642 ( -2.975 6.295 -6.052) 9.226 10.749 ( -6.394 -4.788 -9.707) 12.571 10.818 ( 3.325 10.331 0.045) 10.853 11.004 ( 5.256 -9.100 0.443) 10.518 11.926 ( 1.764 7.510 4.004) 8.691 12.103 ( -1.407 -10.875 4.953) 12.032 12.577 ( 2.585 8.943 4.363) 10.281 12.702 ( -2.741 -3.987 6.949) 8.467 13.189 ( 2.636 -1.416 -2.119) 3.666 13.230 ( 1.669 -5.616 -1.086) 5.959 13.786 ( 0.060 16.365 2.764) 16.597 14.063 ( 3.984 -12.462 -0.610) 13.097 14.363 ( -2.342 8.308 5.147) 10.050 14.493 ( -2.232 -5.112 3.059) 6.362 14.616 ( 2.208 4.851 -4.127) 6.741 14.705 ( 0.046 -4.458 2.484) 5.103 15.333 ( 5.320 12.982 5.398) 15.033 15.586 ( 11.218 -13.623 -6.715) 18.882 16.146 ( 8.559 8.539 -2.913) 12.436 16.283 ( 9.596 -5.559 -4.140) 11.837 19.219 ( 3.369 7.849 3.968) 9.418 19.336 ( 2.429 -4.568 5.777) 7.755 25.132 ( -1.087 1.870 7.623) 7.924 25.156 ( -8.443 -0.642 8.259) 11.828 25.720 ( 8.506 3.296 -8.688) 12.598 25.808 ( 7.425 -6.060 -4.710) 10.679 26.623 ( 0.220 0.708 2.624) 2.726 26.639 ( 0.040 -0.812 2.440) 2.572 27.234 ( 7.121 0.962 9.507) 11.917 27.269 ( 7.340 -2.548 9.967) 12.638 27.617 ( 4.531 6.004 2.253) 7.852 27.713 ( 4.172 -4.300 0.452) 6.009 28.960 ( -24.105 21.932 -23.924) 40.428 29.395 ( -20.098 -24.046 -23.864) 39.391 32.703 ( 8.562 16.376 -0.898) 18.500 32.996 ( 12.052 -14.678 -0.693) 19.005 ======================= Grid point 86 (50/150) ======================= q-point: (-0.18 0.40 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( -26.668 11.734 -12.162) 31.572 1.886 ( -15.719 -11.178 -15.780) 24.921 1.981 ( -25.622 16.453 11.615) 32.590 2.303 ( -13.959 -16.625 -0.849) 21.725 2.434 ( 10.310 16.064 -14.478) 23.957 2.890 ( 8.269 -27.798 -5.628) 29.543 3.546 ( -7.023 9.263 -3.273) 12.076 3.717 ( -6.658 -5.596 -6.041) 10.589 4.104 ( -1.336 5.239 8.330) 9.931 4.180 ( 4.129 -2.720 4.400) 6.619 4.963 ( -11.251 17.889 9.452) 23.150 4.984 ( -0.704 6.195 -2.818) 6.843 5.241 ( 0.947 5.811 -14.504) 15.653 5.522 ( -6.448 -10.816 3.672) 13.117 5.778 ( -6.015 1.253 4.582) 7.664 5.918 ( 1.154 -3.342 0.903) 3.649 6.047 ( -2.067 0.392 5.841) 6.208 6.218 ( -2.409 -11.518 -4.959) 12.770 6.509 ( 4.829 9.618 -8.239) 13.554 6.672 ( 2.772 -5.850 -4.438) 7.848 6.828 ( -5.306 13.854 -1.125) 14.878 7.164 ( 4.596 -16.499 -2.172) 17.264 7.933 ( -9.855 1.364 -5.274) 11.261 8.005 ( -6.227 -4.895 -8.237) 11.427 8.214 ( 5.210 13.218 4.347) 14.858 8.490 ( 3.037 -17.001 -6.443) 18.433 9.297 ( 5.657 2.768 -1.959) 6.596 9.378 ( 6.312 -4.663 -3.320) 8.521 9.776 ( 8.122 2.941 9.232) 12.643 9.810 ( 5.028 -0.675 7.329) 8.913 10.548 ( -4.581 2.350 -7.295) 8.929 10.590 ( -6.364 -2.122 -6.758) 9.522 10.946 ( 7.804 8.868 2.800) 12.140 11.138 ( 7.666 -10.996 2.410) 13.619 11.976 ( 2.588 5.368 0.445) 5.976 12.102 ( 0.365 -8.065 1.521) 8.215 12.572 ( -4.016 3.989 5.848) 8.139 12.620 ( -6.859 -1.285 7.665) 10.366 13.223 ( 1.579 1.594 -0.885) 2.412 13.266 ( 2.836 -3.941 -1.566) 5.102 13.755 ( -3.804 16.310 1.124) 16.785 14.017 ( -8.130 -10.620 1.692) 13.481 14.329 ( -2.440 8.307 3.229) 9.241 14.466 ( -1.830 -4.571 0.369) 4.937 14.666 ( 3.285 1.816 -4.947) 6.210 14.707 ( -0.704 -3.537 2.830) 4.584 15.540 ( 16.080 17.127 -4.012) 23.832 15.859 ( 17.871 -17.069 -13.136) 27.988 16.333 ( 11.380 10.038 -1.265) 15.227 16.492 ( 13.284 -6.385 -3.944) 15.258 19.295 ( 3.063 7.105 5.876) 9.715 19.383 ( 0.566 -2.661 9.197) 9.591 24.995 ( -9.423 4.186 9.467) 13.998 25.090 ( -5.177 -5.961 11.373) 13.845 25.915 ( 13.916 4.589 -9.772) 17.612 26.001 ( 13.396 -4.852 -8.478) 16.579 26.657 ( 3.686 2.833 4.498) 6.468 26.703 ( 4.485 -2.108 6.557) 8.219 27.385 ( 5.984 0.905 8.477) 10.416 27.421 ( 5.586 -2.761 8.982) 10.932 27.668 ( 0.298 4.968 1.208) 5.121 27.748 ( -0.828 -3.600 -0.606) 3.743 28.418 ( -25.902 24.010 -21.393) 41.293 28.905 ( -25.567 -28.374 -19.578) 42.919 32.880 ( 10.025 20.112 -3.507) 22.744 33.226 ( 11.473 -17.181 -2.333) 20.791 ======================= Grid point 87 (51/150) ======================= q-point: (-0.09 0.40 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( -4.074 19.580 17.741) 26.734 1.638 ( -3.211 -4.511 9.713) 11.180 1.674 ( -4.288 19.914 5.581) 21.121 2.229 ( 4.946 -26.375 -7.329) 27.818 2.739 ( 17.347 19.893 -7.737) 27.504 3.094 ( 11.711 -18.507 1.129) 21.930 3.401 ( -7.342 12.911 9.017) 17.375 3.582 ( -6.045 -1.373 1.277) 6.329 4.067 ( -4.894 10.062 13.092) 17.222 4.259 ( 2.539 -6.912 6.802) 10.024 4.760 ( -9.796 8.521 7.181) 14.837 4.908 ( -8.377 -5.976 3.627) 10.910 5.294 ( 6.434 1.428 -10.290) 12.219 5.443 ( 0.133 -11.360 -2.246) 11.581 5.691 ( -4.213 5.622 2.291) 7.389 5.884 ( -4.683 -14.317 2.061) 15.203 6.089 ( 5.635 4.217 2.150) 7.360 6.155 ( -2.139 -4.183 -1.849) 5.049 6.564 ( -0.149 4.434 1.361) 4.641 6.641 ( -5.831 -0.657 3.306) 6.735 6.754 ( -0.139 15.510 -3.221) 15.841 7.124 ( -9.306 -21.841 1.432) 23.784 7.719 ( -6.754 8.533 -10.474) 15.104 7.906 ( -1.599 -9.524 -10.694) 14.409 8.337 ( 5.491 15.222 3.478) 16.552 8.558 ( 3.027 -8.160 -7.810) 11.694 9.363 ( 1.981 3.136 -2.088) 4.256 9.462 ( 3.610 -5.885 -2.474) 7.334 9.939 ( 6.442 7.543 6.464) 11.840 10.036 ( 14.973 -2.592 15.709) 21.856 10.456 ( -2.489 1.349 -4.999) 5.745 10.530 ( 1.260 -5.909 0.125) 6.043 11.088 ( 5.547 8.020 2.522) 10.072 11.279 ( 5.590 -12.217 3.071) 13.782 12.017 ( 1.660 4.741 -2.857) 5.779 12.116 ( 1.047 -6.132 -1.715) 6.453 12.466 ( -8.007 1.004 8.283) 11.564 12.480 ( -8.696 -0.672 7.642) 11.596 13.257 ( 1.868 6.672 0.087) 6.929 13.331 ( 3.848 -2.846 -1.280) 4.954 13.647 ( -6.715 10.932 -1.518) 12.919 13.814 ( -11.493 -5.848 0.347) 12.900 14.265 ( -4.603 7.363 -0.202) 8.686 14.415 ( -2.559 -5.941 -4.988) 8.169 14.681 ( -2.420 -1.115 -0.015) 2.664 14.701 ( 1.096 -1.496 -4.637) 4.994 15.881 ( 18.421 14.935 -14.699) 27.901 16.139 ( 12.145 -12.337 -14.754) 22.747 16.590 ( 15.215 10.533 -3.332) 18.803 16.792 ( 18.174 -10.747 -6.723) 22.159 19.326 ( -2.301 4.394 6.862) 8.467 19.376 ( -4.173 -1.400 11.182) 12.017 24.843 ( -8.012 5.382 8.208) 12.671 24.978 ( -8.819 -9.745 11.220) 17.281 26.205 ( 16.659 3.462 -12.148) 20.906 26.255 ( 13.701 -2.406 -11.277) 17.907 26.776 ( 5.053 1.575 5.370) 7.540 26.799 ( 2.067 -1.096 3.476) 4.190 27.433 ( -3.389 6.194 -5.357) 8.863 27.488 ( 1.561 -1.069 2.801) 3.380 27.634 ( -4.452 3.197 0.055) 5.481 27.675 ( -5.833 -0.734 2.111) 6.247 28.026 ( -6.589 16.031 0.660) 17.344 28.420 ( -17.676 -25.682 3.581) 31.382 33.059 ( 9.132 19.912 -8.252) 23.409 33.392 ( 5.309 -16.833 -5.117) 18.377 ======================= Grid point 110 (52/150) ======================= q-point: ( 0.00 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.499 ( -10.923 0.000 31.977) 33.791 1.636 ( -30.225 0.000 39.646) 49.853 2.346 ( 13.612 0.000 0.990) 13.648 2.852 ( 23.415 0.000 44.879) 50.620 2.954 ( 20.187 0.000 -8.199) 21.789 3.094 ( 17.957 0.000 28.142) 33.383 3.720 ( 7.724 0.000 7.909) 11.055 3.923 ( -2.981 0.000 7.023) 7.629 4.103 ( -6.183 0.000 15.720) 16.892 4.398 ( -0.985 0.000 0.981) 1.390 4.779 ( 10.424 0.000 3.355) 10.951 5.048 ( 7.640 0.000 -6.890) 10.288 5.543 ( -1.030 0.000 -10.841) 10.890 5.552 ( 3.119 0.000 -9.311) 9.820 5.655 ( -1.506 0.000 4.000) 4.275 5.847 ( 11.528 0.000 -4.532) 12.387 6.220 ( -3.950 0.000 8.887) 9.726 6.241 ( 7.690 0.000 9.727) 12.400 6.574 ( 3.445 0.000 -3.316) 4.781 6.787 ( 15.513 0.000 13.064) 20.280 7.059 ( -10.202 0.000 0.291) 10.206 7.432 ( 3.119 0.000 16.962) 17.246 7.475 ( 0.523 0.000 1.200) 1.309 7.773 ( -1.432 0.000 4.518) 4.740 7.895 ( -3.153 0.000 -6.711) 7.414 8.348 ( -3.038 0.000 7.217) 7.831 9.513 ( 1.493 0.000 -7.146) 7.300 9.532 ( 5.218 0.000 -1.896) 5.552 9.933 ( -0.129 0.000 9.312) 9.313 10.381 ( 7.311 0.000 -0.547) 7.332 10.714 ( -0.681 0.000 -1.468) 1.619 10.860 ( -2.975 0.000 -6.918) 7.530 11.053 ( 0.769 0.000 2.709) 2.816 11.686 ( 3.714 0.000 -4.193) 5.602 12.003 ( 4.819 0.000 1.676) 5.102 12.145 ( 5.552 0.000 -5.840) 8.058 12.458 ( -13.145 0.000 12.620) 18.223 12.542 ( -9.998 0.000 -3.209) 10.500 12.626 ( -5.121 0.000 1.500) 5.336 13.377 ( 5.384 0.000 -1.868) 5.699 13.516 ( -4.687 0.000 -1.382) 4.886 13.645 ( -4.898 0.000 -5.132) 7.094 13.850 ( -14.282 0.000 -10.399) 17.667 14.235 ( 0.333 0.000 3.015) 3.033 14.462 ( -7.919 0.000 -16.055) 17.902 14.485 ( 7.824 0.000 -9.508) 12.313 15.749 ( -4.590 0.000 2.137) 5.063 16.002 ( -1.181 0.000 -10.152) 10.221 16.587 ( 6.149 0.000 -3.331) 6.993 17.189 ( -0.863 0.000 -14.546) 14.571 19.115 ( 2.535 0.000 1.667) 3.034 19.387 ( -12.003 0.000 6.903) 13.846 24.754 ( -5.460 0.000 6.405) 8.417 25.219 ( -26.797 0.000 1.332) 26.830 25.864 ( 7.036 0.000 -3.404) 7.816 26.149 ( 4.045 0.000 -13.149) 13.757 26.617 ( 5.771 0.000 0.223) 5.775 26.671 ( -7.420 0.000 -0.509) 7.438 27.389 ( -2.051 0.000 -3.322) 3.904 27.411 ( -9.017 0.000 -3.913) 9.829 27.714 ( -6.870 0.000 7.480) 10.157 27.746 ( 38.497 0.000 11.001) 40.038 28.274 ( 5.555 0.000 16.030) 16.966 29.701 ( 30.305 0.000 -7.407) 31.198 32.356 ( -0.783 0.000 6.084) 6.134 33.413 ( -12.836 0.000 -12.575) 17.969 ======================= Grid point 111 (53/150) ======================= q-point: ( 0.09 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.275 ( -8.206 0.000 35.290) 36.232 1.483 ( 4.656 0.000 31.113) 31.459 2.621 ( 16.855 0.000 -12.965) 21.265 3.372 ( 22.862 0.000 -12.894) 26.248 3.391 ( 20.575 0.000 35.436) 40.976 3.491 ( 13.995 0.000 27.533) 30.885 3.678 ( -13.364 0.000 8.081) 15.617 3.949 ( 5.020 0.000 11.433) 12.487 4.095 ( 1.075 0.000 16.217) 16.253 4.330 ( -5.581 0.000 0.809) 5.639 4.899 ( 0.903 0.000 9.469) 9.512 5.105 ( -0.692 0.000 -2.770) 2.855 5.435 ( -8.871 0.000 0.463) 8.883 5.516 ( 2.181 0.000 -15.546) 15.699 5.783 ( 10.252 0.000 -4.347) 11.136 6.058 ( 10.429 0.000 -9.159) 13.880 6.161 ( -2.845 0.000 16.716) 16.957 6.450 ( 10.465 0.000 15.134) 18.400 6.611 ( 1.106 0.000 1.282) 1.693 6.872 ( -4.142 0.000 4.884) 6.404 7.258 ( 14.924 0.000 7.366) 16.643 7.498 ( 2.947 0.000 1.413) 3.268 7.539 ( 3.673 0.000 17.513) 17.894 7.811 ( -3.990 0.000 -7.178) 8.213 7.901 ( 16.727 0.000 -7.579) 18.364 8.282 ( -5.028 0.000 6.693) 8.371 9.505 ( -0.765 0.000 -6.873) 6.915 9.550 ( -3.640 0.000 -1.156) 3.819 9.931 ( -2.099 0.000 7.909) 8.183 10.535 ( 3.782 0.000 -1.617) 4.113 10.569 ( -22.302 0.000 -14.378) 26.535 10.679 ( 3.847 0.000 0.231) 3.854 10.999 ( -6.823 0.000 2.432) 7.243 11.638 ( -9.014 0.000 -1.247) 9.100 12.076 ( 0.729 0.000 3.938) 4.005 12.237 ( 4.103 0.000 -3.963) 5.705 12.266 ( -5.338 0.000 6.767) 8.619 12.332 ( -11.231 0.000 -1.169) 11.292 12.544 ( -3.639 0.000 -4.168) 5.533 13.350 ( -4.050 0.000 -2.689) 4.862 13.410 ( -9.311 0.000 -3.396) 9.911 13.695 ( 7.348 0.000 -8.702) 11.389 13.752 ( 9.393 0.000 -2.147) 9.635 14.178 ( -4.752 0.000 -6.786) 8.284 14.402 ( 3.543 0.000 -2.668) 4.435 14.606 ( 5.558 0.000 -8.506) 10.161 15.605 ( -9.070 0.000 4.630) 10.184 15.940 ( -2.726 0.000 -11.643) 11.958 16.648 ( 0.628 0.000 -2.378) 2.460 16.969 ( -15.671 0.000 1.166) 15.714 19.162 ( 1.744 0.000 3.108) 3.564 19.262 ( -2.421 0.000 4.786) 5.363 24.690 ( -2.429 0.000 5.075) 5.627 24.860 ( -11.841 0.000 4.628) 12.713 26.000 ( 7.509 0.000 -0.039) 7.509 26.146 ( -2.103 0.000 -11.387) 11.580 26.586 ( -1.615 0.000 2.716) 3.160 26.730 ( 5.510 0.000 0.622) 5.545 27.223 ( -9.180 0.000 -1.604) 9.319 27.276 ( -6.921 0.000 -4.656) 8.341 27.573 ( -8.735 0.000 3.610) 9.452 28.350 ( -0.936 0.000 12.840) 12.874 28.429 ( 28.689 0.000 5.641) 29.239 30.245 ( 24.231 0.000 -22.315) 32.941 32.352 ( -0.834 0.000 6.297) 6.352 33.118 ( -13.518 0.000 -6.254) 14.895 ======================= Grid point 112 (54/150) ======================= q-point: ( 0.18 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.531 ( 26.695 0.000 7.425) 27.708 1.793 ( 20.908 0.000 15.963) 26.305 2.964 ( 21.648 0.000 -15.293) 26.505 3.340 ( -22.410 0.000 14.062) 26.457 3.627 ( 1.273 0.000 13.688) 13.748 3.696 ( 10.254 0.000 -8.736) 13.471 3.807 ( 12.481 0.000 22.363) 25.610 4.078 ( -5.553 0.000 7.513) 9.342 4.135 ( 7.469 0.000 18.830) 20.257 4.265 ( -0.497 0.000 4.787) 4.813 4.883 ( -4.656 0.000 17.286) 17.902 5.069 ( -0.596 0.000 -3.920) 3.965 5.292 ( -4.693 0.000 -2.325) 5.238 5.539 ( 2.760 0.000 -18.059) 18.268 5.958 ( 8.178 0.000 -7.052) 10.798 6.152 ( -3.096 0.000 18.468) 18.726 6.191 ( 5.512 0.000 -12.324) 13.501 6.584 ( -0.056 0.000 4.722) 4.723 6.721 ( 9.084 0.000 15.746) 18.178 6.828 ( -1.248 0.000 2.506) 2.799 7.368 ( -0.068 0.000 2.782) 2.783 7.604 ( 5.517 0.000 3.174) 6.365 7.620 ( 1.256 0.000 12.692) 12.754 7.717 ( -4.276 0.000 -8.120) 9.177 8.177 ( -7.460 0.000 5.886) 9.503 8.319 ( 24.195 0.000 -17.840) 30.061 9.383 ( -12.436 0.000 -2.513) 12.688 9.452 ( -3.596 0.000 -6.348) 7.296 9.878 ( -4.896 0.000 5.729) 7.536 10.071 ( -22.948 0.000 -11.953) 25.874 10.511 ( -0.091 0.000 -2.439) 2.441 10.822 ( -11.154 0.000 2.970) 11.543 10.934 ( 17.080 0.000 0.983) 17.109 11.381 ( -15.509 0.000 2.994) 15.795 12.032 ( -6.315 0.000 9.224) 11.178 12.152 ( -4.729 0.000 -4.446) 6.491 12.261 ( -1.563 0.000 -0.242) 1.581 12.304 ( 6.013 0.000 1.946) 6.320 12.430 ( -7.148 0.000 -11.799) 13.795 13.190 ( -8.161 0.000 -5.037) 9.591 13.356 ( 3.995 0.000 -4.141) 5.754 13.823 ( 1.136 0.000 -9.468) 9.535 13.940 ( 9.787 0.000 0.487) 9.799 14.187 ( 9.798 0.000 -3.687) 10.469 14.517 ( 7.166 0.000 5.099) 8.795 14.647 ( 0.173 0.000 -4.655) 4.658 15.477 ( -5.153 0.000 8.363) 9.823 15.861 ( -2.631 0.000 -11.740) 12.032 16.602 ( -4.780 0.000 -1.904) 5.145 16.669 ( -15.988 0.000 5.829) 17.017 19.190 ( 0.256 0.000 4.529) 4.536 19.265 ( 1.037 0.000 1.636) 1.937 24.680 ( 0.629 0.000 2.521) 2.598 24.716 ( -4.811 0.000 0.655) 4.855 26.063 ( -3.896 0.000 -4.859) 6.228 26.154 ( 7.934 0.000 3.781) 8.789 26.581 ( -0.258 0.000 1.782) 1.801 26.826 ( 4.334 0.000 0.939) 4.435 27.071 ( -6.231 0.000 0.977) 6.307 27.128 ( -7.087 0.000 -3.600) 7.949 27.397 ( -9.583 0.000 -0.318) 9.588 28.288 ( -7.669 0.000 9.890) 12.515 28.898 ( 19.720 0.000 1.147) 19.753 30.488 ( 6.762 0.000 -22.038) 23.052 32.349 ( -0.828 0.000 5.619) 5.680 32.895 ( -8.516 0.000 -7.130) 11.107 ======================= Grid point 113 (55/150) ======================= q-point: ( 0.27 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.163 ( 35.768 0.000 -10.834) 37.373 2.287 ( 26.587 0.000 3.618) 26.832 2.909 ( -24.347 0.000 16.221) 29.256 3.382 ( 23.837 0.000 -11.375) 26.412 3.610 ( -5.439 0.000 11.364) 12.598 3.675 ( -8.298 0.000 -3.283) 8.924 3.999 ( -5.229 0.000 4.679) 7.016 4.000 ( 4.150 0.000 10.594) 11.378 4.225 ( -1.888 0.000 16.469) 16.577 4.289 ( 0.953 0.000 7.959) 8.016 4.808 ( -6.228 0.000 16.813) 17.929 5.088 ( 3.182 0.000 -9.521) 10.038 5.256 ( 1.330 0.000 -4.923) 5.100 5.538 ( 1.013 0.000 -15.826) 15.859 6.043 ( -4.099 0.000 4.687) 6.227 6.096 ( 0.415 0.000 -3.238) 3.265 6.236 ( 2.580 0.000 -14.826) 15.049 6.553 ( -3.821 0.000 2.537) 4.586 6.824 ( 0.253 0.000 -0.401) 0.475 6.891 ( 4.172 0.000 11.820) 12.535 7.358 ( -0.844 0.000 0.052) 0.846 7.563 ( -9.133 0.000 -1.119) 9.201 7.680 ( 1.539 0.000 -1.083) 1.882 7.698 ( 3.939 0.000 -0.500) 3.970 8.023 ( -8.188 0.000 4.431) 9.310 8.616 ( 8.078 0.000 -21.336) 22.814 9.124 ( -12.182 0.000 -3.500) 12.674 9.351 ( -3.595 0.000 -5.964) 6.964 9.719 ( -10.246 0.000 5.084) 11.438 9.804 ( -4.440 0.000 -1.836) 4.805 10.535 ( -2.969 0.000 4.900) 5.729 10.642 ( -2.274 0.000 -2.367) 3.282 11.110 ( -12.432 0.000 3.552) 12.930 11.246 ( 12.928 0.000 -3.375) 13.361 11.898 ( -7.838 0.000 9.792) 12.543 12.142 ( -10.878 0.000 2.035) 11.066 12.143 ( 3.200 0.000 -2.909) 4.325 12.290 ( -1.625 0.000 -12.232) 12.339 12.466 ( 10.328 0.000 -0.360) 10.334 13.113 ( 0.381 0.000 -2.203) 2.235 13.448 ( 5.772 0.000 -5.090) 7.696 13.748 ( -4.409 0.000 -11.144) 11.985 14.116 ( 7.662 0.000 3.629) 8.477 14.436 ( 13.345 0.000 0.854) 13.372 14.612 ( -2.523 0.000 -1.826) 3.114 14.675 ( 7.478 0.000 7.049) 10.277 15.426 ( -2.640 0.000 10.351) 10.683 15.802 ( -1.014 0.000 -10.482) 10.531 16.371 ( -16.143 0.000 6.135) 17.270 16.464 ( -8.828 0.000 -1.700) 8.990 19.188 ( -1.547 0.000 5.258) 5.481 19.288 ( 1.001 0.000 -0.124) 1.009 24.653 ( -1.765 0.000 -2.368) 2.954 24.722 ( 3.506 0.000 -1.059) 3.662 25.991 ( -2.938 0.000 -0.033) 2.938 26.309 ( 6.324 0.000 8.039) 10.228 26.569 ( -1.317 0.000 0.292) 1.349 26.907 ( 3.937 0.000 2.319) 4.569 26.989 ( -2.567 0.000 1.833) 3.155 27.008 ( -4.426 0.000 -0.869) 4.510 27.211 ( -8.950 0.000 -3.055) 9.457 28.109 ( -12.175 0.000 7.358) 14.225 29.199 ( 11.734 0.000 -5.572) 12.990 30.478 ( -2.208 0.000 -19.057) 19.185 32.342 ( -0.918 0.000 4.423) 4.517 32.745 ( -5.556 0.000 -8.015) 9.752 ======================= Grid point 114 (56/150) ======================= q-point: ( 0.36 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.453 ( -19.792 0.000 13.178) 23.778 2.770 ( 27.217 0.000 -11.667) 29.612 2.844 ( 25.143 0.000 -4.036) 25.464 3.457 ( -12.513 0.000 14.831) 19.405 3.488 ( -8.947 0.000 -1.230) 9.031 3.797 ( 18.349 0.000 -2.767) 18.556 3.838 ( -12.467 0.000 4.567) 13.277 4.024 ( -2.083 0.000 -0.385) 2.118 4.172 ( -5.134 0.000 12.458) 13.475 4.325 ( 0.921 0.000 11.408) 11.445 4.731 ( -2.706 0.000 0.112) 2.708 5.094 ( -1.102 0.000 -15.839) 15.877 5.296 ( 2.711 0.000 -1.549) 3.122 5.527 ( 0.254 0.000 -10.218) 10.221 5.809 ( -16.820 0.000 -3.488) 17.178 6.176 ( 6.817 0.000 -11.848) 13.669 6.242 ( 1.141 0.000 -16.416) 16.455 6.451 ( -6.145 0.000 -4.200) 7.443 6.815 ( -1.248 0.000 -4.336) 4.512 6.896 ( -5.145 0.000 3.158) 6.036 7.315 ( -15.935 0.000 -3.489) 16.312 7.328 ( -2.513 0.000 -1.449) 2.900 7.677 ( -0.520 0.000 -0.855) 1.001 7.774 ( 5.227 0.000 -2.137) 5.647 7.985 ( 3.710 0.000 5.584) 6.704 8.557 ( -7.172 0.000 -13.212) 15.033 8.929 ( -7.084 0.000 -3.545) 7.922 9.335 ( 1.841 0.000 -9.131) 9.315 9.598 ( -5.033 0.000 6.433) 8.167 9.766 ( 0.469 0.000 5.139) 5.160 10.379 ( -9.345 0.000 5.668) 10.929 10.738 ( 6.645 0.000 -2.654) 7.156 10.933 ( -6.288 0.000 1.750) 6.527 11.314 ( -4.490 0.000 -13.973) 14.676 11.799 ( -4.280 0.000 9.710) 10.611 11.973 ( -6.045 0.000 8.174) 10.166 12.236 ( 6.356 0.000 0.463) 6.373 12.358 ( 11.220 0.000 -8.615) 14.146 12.693 ( 13.282 0.000 -2.810) 13.576 13.167 ( 4.663 0.000 1.259) 4.830 13.538 ( 4.199 0.000 -5.417) 6.854 13.637 ( -4.460 0.000 -10.573) 11.475 14.240 ( 3.798 0.000 7.061) 8.018 14.557 ( -2.704 0.000 -0.347) 2.726 14.663 ( 9.416 0.000 1.729) 9.574 14.818 ( 5.521 0.000 7.954) 9.682 15.405 ( -1.923 0.000 11.997) 12.150 15.779 ( 0.378 0.000 -8.935) 8.943 16.076 ( -15.524 0.000 5.533) 16.481 16.273 ( -9.898 0.000 -1.754) 10.053 19.154 ( -2.968 0.000 5.093) 5.894 19.302 ( 0.724 0.000 -0.884) 1.143 24.638 ( 1.004 0.000 -3.921) 4.048 24.807 ( 5.798 0.000 -5.234) 7.811 25.948 ( -1.972 0.000 3.262) 3.812 26.392 ( -1.195 0.000 11.919) 11.979 26.539 ( -1.335 0.000 -0.242) 1.357 26.964 ( -0.131 0.000 1.931) 1.936 26.966 ( -0.702 0.000 -0.180) 0.725 26.990 ( 3.507 0.000 4.676) 5.845 27.078 ( -2.203 0.000 -3.133) 3.830 27.875 ( -12.597 0.000 5.921) 13.919 29.320 ( 2.589 0.000 -13.141) 13.393 30.354 ( -6.347 0.000 -19.194) 20.216 32.332 ( -0.940 0.000 3.175) 3.311 32.655 ( -1.837 0.000 -6.759) 7.004 ======================= Grid point 115 (57/150) ======================= q-point: ( 0.45 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.150 ( -11.845 0.000 3.930) 12.480 2.987 ( -11.462 0.000 21.769) 24.603 3.271 ( 14.374 0.000 -7.580) 16.250 3.330 ( 3.507 0.000 -5.668) 6.665 3.365 ( -2.800 0.000 3.255) 4.293 3.571 ( -11.475 0.000 0.712) 11.497 3.874 ( -6.597 0.000 -7.700) 10.139 4.054 ( 1.147 0.000 0.066) 1.149 4.084 ( -6.012 0.000 7.626) 9.711 4.382 ( 2.542 0.000 12.835) 13.085 4.763 ( 8.569 0.000 -20.666) 22.372 4.983 ( -6.215 0.000 -17.598) 18.663 5.265 ( -13.422 0.000 4.078) 14.028 5.464 ( -5.500 0.000 -10.340) 11.711 5.512 ( -3.047 0.000 -15.100) 15.404 6.151 ( -9.581 0.000 -12.385) 15.658 6.310 ( 9.723 0.000 -10.296) 14.161 6.356 ( -0.243 0.000 -15.557) 15.559 6.735 ( -6.136 0.000 -8.165) 10.214 6.752 ( -8.983 0.000 0.973) 9.035 7.012 ( -11.346 0.000 -3.562) 11.892 7.261 ( -3.439 0.000 0.043) 3.439 7.699 ( 2.058 0.000 1.139) 2.352 7.918 ( 10.141 0.000 -3.286) 10.660 8.108 ( 6.238 0.000 4.995) 7.992 8.373 ( -9.621 0.000 -2.692) 9.991 8.839 ( -1.328 0.000 -2.698) 3.007 9.349 ( 1.765 0.000 -9.486) 9.649 9.531 ( -2.760 0.000 3.742) 4.650 9.819 ( 2.528 0.000 9.184) 9.526 10.243 ( -5.396 0.000 4.333) 6.920 10.793 ( -1.279 0.000 -3.107) 3.360 10.872 ( -0.398 0.000 -1.140) 1.208 11.116 ( -10.149 0.000 -17.017) 19.814 11.770 ( -0.970 0.000 8.909) 8.962 11.956 ( 2.717 0.000 7.347) 7.834 12.376 ( 7.333 0.000 3.495) 8.123 12.616 ( 14.337 0.000 -5.453) 15.339 12.956 ( 14.299 0.000 -4.764) 15.072 13.279 ( 5.881 0.000 4.416) 7.355 13.556 ( -0.904 0.000 -10.393) 10.432 13.578 ( 0.968 0.000 -5.458) 5.543 14.293 ( 0.243 0.000 10.177) 10.180 14.513 ( -1.939 0.000 1.400) 2.391 14.792 ( 3.439 0.000 0.930) 3.563 14.930 ( 4.534 0.000 10.976) 11.876 15.403 ( -0.849 0.000 13.516) 13.543 15.757 ( -1.407 0.000 -9.041) 9.150 15.802 ( -13.553 0.000 3.514) 14.001 16.110 ( -5.619 0.000 -2.198) 6.034 19.100 ( -3.431 0.000 4.281) 5.486 19.320 ( 1.457 0.000 -0.620) 1.583 24.679 ( 4.200 0.000 -4.336) 6.037 24.920 ( 7.292 0.000 -9.370) 11.873 25.927 ( -1.125 0.000 5.626) 5.737 26.283 ( -12.052 0.000 11.642) 16.757 26.531 ( 0.600 0.000 1.292) 1.425 26.966 ( 2.049 0.000 -0.421) 2.092 27.008 ( 4.030 0.000 3.338) 5.233 27.021 ( -1.725 0.000 1.214) 2.110 27.144 ( 6.815 0.000 3.460) 7.642 27.693 ( -6.239 0.000 7.204) 9.530 29.242 ( -7.274 0.000 -19.833) 21.125 30.163 ( -9.002 0.000 -21.492) 23.301 32.321 ( -0.681 0.000 2.216) 2.318 32.658 ( 3.530 0.000 -5.187) 6.274 ======================= Grid point 116 (58/150) ======================= q-point: (-0.45 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.013 ( -3.564 0.000 -3.471) 4.975 2.679 ( -20.374 0.000 27.533) 34.251 3.102 ( -18.994 0.000 -2.785) 19.197 3.236 ( -17.228 0.000 -6.642) 18.464 3.351 ( 2.286 0.000 1.565) 2.770 3.722 ( 15.249 0.000 -4.596) 15.927 3.727 ( -18.462 0.000 -14.799) 23.661 3.852 ( -0.035 0.000 -7.029) 7.029 4.099 ( 1.091 0.000 -4.207) 4.346 4.462 ( 2.566 0.000 10.066) 10.388 4.809 ( -7.923 0.000 -14.582) 16.596 4.848 ( -1.309 0.000 -17.990) 18.038 4.926 ( -13.095 0.000 0.640) 13.111 5.284 ( -9.725 0.000 -12.089) 15.515 5.591 ( 7.844 0.000 -2.597) 8.263 5.873 ( -13.365 0.000 -17.095) 21.699 6.323 ( -1.973 0.000 -9.495) 9.698 6.517 ( 8.925 0.000 -5.839) 10.666 6.565 ( -4.238 0.000 -9.158) 10.091 6.593 ( -6.339 0.000 0.590) 6.367 6.927 ( 2.146 0.000 -3.566) 4.162 7.216 ( -1.601 0.000 1.314) 2.071 7.736 ( 1.641 0.000 1.334) 2.115 8.088 ( 1.261 0.000 -3.364) 3.593 8.208 ( 2.810 0.000 2.905) 4.041 8.225 ( 1.335 0.000 -1.881) 2.307 8.874 ( 4.968 0.000 -0.949) 5.058 9.370 ( 2.296 0.000 -10.735) 10.978 9.522 ( 1.207 0.000 5.750) 5.875 9.881 ( 1.831 0.000 9.004) 9.189 10.201 ( 0.444 0.000 3.310) 3.339 10.695 ( -6.743 0.000 -4.382) 8.042 10.897 ( -8.937 0.000 -16.046) 18.366 10.901 ( 3.596 0.000 -3.122) 4.762 11.784 ( 0.566 0.000 6.522) 6.546 12.067 ( 5.875 0.000 2.751) 6.488 12.519 ( 6.193 0.000 5.143) 8.050 12.820 ( 6.936 0.000 -1.312) 7.059 13.203 ( 11.454 0.000 -4.588) 12.339 13.389 ( 4.037 0.000 5.405) 6.746 13.555 ( -2.097 0.000 -5.148) 5.558 13.598 ( 7.964 0.000 -12.159) 14.535 14.309 ( -0.388 0.000 11.615) 11.622 14.485 ( -1.620 0.000 3.639) 3.983 14.813 ( -1.100 0.000 2.375) 2.617 15.030 ( 2.805 0.000 14.079) 14.356 15.433 ( 1.057 0.000 15.730) 15.765 15.583 ( -8.812 0.000 -0.326) 8.818 15.691 ( -2.235 0.000 -10.587) 10.820 16.059 ( 0.370 0.000 -4.185) 4.202 19.045 ( -2.843 0.000 3.170) 4.258 19.363 ( 3.046 0.000 0.676) 3.121 24.782 ( 7.263 0.000 -3.802) 8.198 25.046 ( 8.037 0.000 -12.722) 15.048 25.929 ( 0.167 0.000 7.085) 7.087 26.019 ( -16.522 0.000 10.351) 19.497 26.574 ( 3.339 0.000 4.069) 5.264 26.914 ( -8.573 0.000 -2.451) 8.916 27.054 ( 6.595 0.000 3.179) 7.321 27.125 ( 7.057 0.000 3.788) 8.009 27.302 ( 7.901 0.000 6.108) 9.986 27.685 ( 2.807 0.000 10.425) 10.796 28.964 ( -16.648 0.000 -24.331) 29.482 29.926 ( -10.442 0.000 -24.741) 26.855 32.316 ( -0.154 0.000 1.743) 1.750 32.769 ( 8.880 0.000 -4.719) 10.056 ======================= Grid point 117 (59/150) ======================= q-point: (-0.36 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.911 ( -9.267 0.000 1.195) 9.344 2.383 ( -14.820 0.000 19.956) 24.857 2.724 ( -31.325 0.000 -9.627) 32.771 2.798 ( -7.878 0.000 -10.036) 12.758 3.151 ( -31.194 0.000 -20.607) 37.386 3.416 ( 2.544 0.000 2.425) 3.514 3.960 ( 7.289 0.000 -8.414) 11.132 3.981 ( 12.157 0.000 -1.015) 12.199 4.103 ( 0.077 0.000 -2.316) 2.317 4.486 ( -1.664 0.000 2.854) 3.304 4.627 ( -8.611 0.000 -7.261) 11.264 4.651 ( -13.467 0.000 0.831) 13.492 4.774 ( -5.929 0.000 -2.119) 6.297 5.096 ( -5.852 0.000 -9.595) 11.239 5.658 ( -3.838 0.000 -18.370) 18.766 5.742 ( 7.158 0.000 4.458) 8.433 6.233 ( -5.470 0.000 -3.633) 6.567 6.346 ( -9.390 0.000 -6.555) 11.451 6.527 ( -0.761 0.000 -3.620) 3.699 6.831 ( 16.495 0.000 -3.161) 16.796 7.013 ( 6.068 0.000 -1.228) 6.191 7.175 ( -3.854 0.000 2.185) 4.430 7.800 ( 5.349 0.000 3.782) 6.551 7.963 ( -7.385 0.000 0.732) 7.421 8.222 ( -1.509 0.000 -1.042) 1.833 8.394 ( 10.619 0.000 -13.478) 17.159 8.997 ( 7.106 0.000 -0.512) 7.124 9.386 ( 1.751 0.000 -11.255) 11.390 9.598 ( 4.816 0.000 7.570) 8.973 9.932 ( 1.967 0.000 9.196) 9.404 10.275 ( 6.316 0.000 2.442) 6.772 10.565 ( -4.833 0.000 -4.627) 6.691 10.709 ( -7.150 0.000 -14.655) 16.307 10.995 ( 6.844 0.000 -3.334) 7.613 11.812 ( 1.311 0.000 3.481) 3.720 12.138 ( 0.769 0.000 -0.492) 0.913 12.625 ( 3.645 0.000 4.756) 5.992 12.900 ( 2.019 0.000 1.477) 2.501 13.346 ( 3.241 0.000 -0.863) 3.354 13.449 ( 1.170 0.000 4.634) 4.779 13.482 ( -4.227 0.000 -3.892) 5.746 13.778 ( 12.056 0.000 -13.897) 18.398 14.334 ( 0.421 0.000 9.293) 9.302 14.457 ( -2.391 0.000 4.994) 5.537 14.759 ( -5.415 0.000 3.054) 6.217 15.086 ( -0.359 0.000 15.436) 15.441 15.481 ( -0.797 0.000 2.627) 2.746 15.533 ( 6.795 0.000 11.215) 13.113 15.677 ( 3.752 0.000 -10.408) 11.063 16.081 ( 2.813 0.000 -7.365) 7.884 19.008 ( -1.492 0.000 2.036) 2.524 19.440 ( 4.487 0.000 2.910) 5.348 24.941 ( 9.701 0.000 -2.462) 10.009 25.170 ( 7.085 0.000 -14.274) 15.936 25.724 ( -15.144 0.000 10.022) 18.160 25.970 ( 2.743 0.000 7.871) 8.336 26.672 ( 5.397 0.000 6.675) 8.584 26.726 ( -9.215 0.000 -3.425) 9.831 27.227 ( 10.193 0.000 5.874) 11.764 27.281 ( 7.818 0.000 3.461) 8.550 27.456 ( 6.532 0.000 6.335) 9.099 27.793 ( 4.870 0.000 12.813) 13.708 28.512 ( -24.507 0.000 -26.707) 36.247 29.668 ( -10.623 0.000 -27.287) 29.282 32.322 ( 0.368 0.000 1.850) 1.886 32.971 ( 12.783 0.000 -5.696) 13.994 ======================= Grid point 118 (60/150) ======================= q-point: (-0.27 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.676 ( -12.277 0.000 4.559) 13.096 2.078 ( -31.819 0.000 3.615) 32.023 2.155 ( -13.125 0.000 6.863) 14.811 2.624 ( -15.396 0.000 -13.923) 20.758 2.783 ( 5.737 0.000 -5.007) 7.614 3.404 ( -5.552 0.000 5.723) 7.973 3.930 ( -15.251 0.000 2.952) 15.534 4.134 ( 3.148 0.000 0.649) 3.214 4.135 ( 0.646 0.000 9.227) 9.250 4.337 ( -13.024 0.000 6.907) 14.742 4.470 ( -4.711 0.000 3.239) 5.717 4.492 ( 6.101 0.000 -16.719) 17.797 4.788 ( 7.453 0.000 -3.372) 8.181 5.058 ( 3.674 0.000 -6.003) 7.038 5.654 ( 6.079 0.000 -15.296) 16.459 5.873 ( 4.371 0.000 10.595) 11.461 6.113 ( -6.028 0.000 -1.801) 6.291 6.169 ( -7.319 0.000 -8.100) 10.917 6.517 ( 0.079 0.000 -6.429) 6.429 7.047 ( -6.832 0.000 9.934) 12.056 7.126 ( 10.759 0.000 -4.612) 11.706 7.140 ( 6.705 0.000 4.106) 7.862 7.843 ( -5.705 0.000 -1.057) 5.803 7.969 ( 10.462 0.000 5.817) 11.971 8.156 ( -4.155 0.000 -4.196) 5.905 8.481 ( 0.338 0.000 -22.744) 22.746 9.123 ( 6.070 0.000 -2.226) 6.465 9.397 ( 1.869 0.000 -11.053) 11.210 9.727 ( 6.455 0.000 8.615) 10.765 10.024 ( 6.678 0.000 12.833) 14.466 10.390 ( 1.655 0.000 -3.061) 3.480 10.540 ( 4.208 0.000 0.206) 4.213 10.583 ( -0.905 0.000 -10.942) 10.979 11.153 ( 10.090 0.000 -2.667) 10.436 11.849 ( 2.018 0.000 0.916) 2.217 12.111 ( -2.480 0.000 -1.427) 2.861 12.676 ( 0.787 0.000 3.012) 3.113 12.905 ( -2.052 0.000 2.613) 3.323 13.284 ( -9.604 0.000 4.901) 10.782 13.426 ( -0.320 0.000 -3.084) 3.101 13.459 ( -0.652 0.000 1.142) 1.315 13.970 ( 9.981 0.000 -12.795) 16.227 14.327 ( -3.741 0.000 5.650) 6.776 14.410 ( -2.934 0.000 2.452) 3.824 14.613 ( -9.990 0.000 2.862) 10.392 15.061 ( -5.103 0.000 8.016) 9.502 15.530 ( 4.421 0.000 5.074) 6.730 15.795 ( 9.269 0.000 -5.050) 10.556 15.811 ( 20.521 0.000 8.007) 22.027 16.137 ( 5.002 0.000 -10.296) 11.446 18.998 ( 0.194 0.000 1.133) 1.150 19.539 ( 4.553 0.000 5.659) 7.263 25.147 ( 12.072 0.000 -0.818) 12.100 25.205 ( -3.463 0.000 -6.776) 7.610 25.545 ( -2.329 0.000 2.892) 3.713 26.080 ( 7.275 0.000 9.057) 11.617 26.570 ( -5.905 0.000 -2.919) 6.587 26.793 ( 5.165 0.000 7.208) 8.867 27.420 ( 5.390 0.000 1.564) 5.612 27.461 ( 12.377 0.000 6.853) 14.148 27.569 ( 3.778 0.000 4.823) 6.126 27.898 ( 2.640 0.000 15.555) 15.778 27.920 ( -30.882 0.000 -27.478) 41.337 29.420 ( -8.965 0.000 -25.925) 27.432 32.336 ( 0.528 0.000 2.537) 2.591 33.224 ( 14.317 0.000 -8.211) 16.505 ======================= Grid point 119 (61/150) ======================= q-point: (-0.18 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.567 ( 0.991 0.000 0.667) 1.195 1.669 ( -10.529 0.000 35.473) 37.002 1.994 ( -0.916 0.000 8.402) 8.452 2.501 ( 1.103 0.000 -3.052) 3.245 2.864 ( -3.699 0.000 15.849) 16.275 3.294 ( -0.681 0.000 5.155) 5.200 3.418 ( -34.879 0.000 20.599) 40.507 4.103 ( -5.345 0.000 3.141) 6.200 4.136 ( -0.246 0.000 15.458) 15.460 4.335 ( 7.093 0.000 5.289) 8.848 4.401 ( -1.288 0.000 -9.011) 9.102 4.676 ( 12.103 0.000 -11.705) 16.837 5.019 ( 16.649 0.000 -7.628) 18.313 5.205 ( 12.107 0.000 -4.603) 12.952 5.763 ( 4.588 0.000 -6.470) 7.932 5.905 ( -5.043 0.000 10.017) 11.215 6.027 ( -0.319 0.000 -4.728) 4.738 6.074 ( 0.762 0.000 -3.762) 3.838 6.497 ( -0.551 0.000 -4.128) 4.165 6.882 ( -9.838 0.000 7.298) 12.249 7.273 ( 5.146 0.000 7.907) 9.434 7.311 ( 7.114 0.000 0.510) 7.132 7.702 ( -9.263 0.000 -3.471) 9.892 8.042 ( -3.821 0.000 -7.344) 8.279 8.208 ( 9.335 0.000 8.796) 12.827 8.278 ( -15.859 0.000 -22.061) 27.169 9.236 ( 7.017 0.000 -4.268) 8.213 9.425 ( 3.330 0.000 -9.324) 9.901 9.845 ( 3.518 0.000 8.202) 8.924 10.294 ( 17.997 0.000 15.487) 23.743 10.339 ( -3.023 0.000 -6.913) 7.545 10.570 ( 3.642 0.000 -2.887) 4.647 10.757 ( 11.879 0.000 1.607) 11.987 11.361 ( 11.457 0.000 -2.621) 11.753 11.890 ( 2.004 0.000 -0.659) 2.110 12.068 ( -1.026 0.000 -2.858) 3.037 12.670 ( -1.818 0.000 1.248) 2.205 12.837 ( -5.290 0.000 4.021) 6.645 13.060 ( -14.277 0.000 8.441) 16.586 13.424 ( -2.944 0.000 -2.600) 3.928 13.429 ( 1.179 0.000 -2.451) 2.720 14.099 ( 5.774 0.000 -10.761) 12.212 14.197 ( -10.315 0.000 2.079) 10.522 14.370 ( -0.921 0.000 -2.803) 2.951 14.406 ( -11.527 0.000 2.376) 11.769 14.919 ( -9.893 0.000 -2.688) 10.251 15.645 ( 5.450 0.000 8.639) 10.215 15.954 ( 6.481 0.000 -3.178) 7.218 16.251 ( 9.301 0.000 -9.720) 13.453 16.339 ( 31.860 0.000 0.123) 31.860 19.019 ( 1.693 0.000 0.674) 1.823 19.620 ( 1.743 0.000 7.315) 7.520 25.046 ( -10.126 0.000 3.830) 10.826 25.405 ( 14.659 0.000 -1.428) 14.728 25.610 ( 6.806 0.000 -5.916) 9.018 26.301 ( 13.354 0.000 11.629) 17.707 26.497 ( -0.983 0.000 -1.742) 2.000 26.871 ( 0.754 0.000 3.277) 3.362 27.193 ( -34.506 0.000 -24.301) 42.205 27.509 ( 0.682 0.000 -1.389) 1.548 27.612 ( 0.028 0.000 -0.497) 0.498 27.706 ( 9.999 0.000 6.723) 12.049 27.962 ( 1.202 0.000 20.561) 20.596 29.249 ( -3.132 0.000 -16.508) 16.802 32.350 ( 0.178 0.000 3.699) 3.703 33.462 ( 11.580 0.000 -12.536) 17.066 ======================= Grid point 120 (62/150) ======================= q-point: (-0.09 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.616 ( -1.648 0.000 10.069) 10.203 1.805 ( 8.192 0.000 47.955) 48.650 2.151 ( 9.191 0.000 11.849) 14.996 2.543 ( -1.297 0.000 24.011) 24.046 2.753 ( -2.352 0.000 12.343) 12.565 2.897 ( -12.593 0.000 23.554) 26.709 3.473 ( 13.379 0.000 8.203) 15.693 4.000 ( -5.761 0.000 6.144) 8.422 4.166 ( -2.041 0.000 16.678) 16.803 4.385 ( 1.301 0.000 -5.155) 5.317 4.535 ( 12.187 0.000 3.436) 12.663 4.877 ( 11.073 0.000 -11.099) 15.678 5.346 ( 17.190 0.000 -10.404) 20.093 5.456 ( 13.016 0.000 -8.430) 15.508 5.754 ( -2.086 0.000 1.472) 2.553 5.773 ( -8.077 0.000 2.770) 8.539 6.104 ( 6.751 0.000 -3.858) 7.776 6.153 ( 5.803 0.000 8.017) 9.897 6.508 ( 2.737 0.000 -1.624) 3.183 6.721 ( -7.492 0.000 8.038) 10.988 7.352 ( -9.643 0.000 -4.845) 10.792 7.358 ( 2.053 0.000 11.747) 11.925 7.480 ( -5.859 0.000 -2.994) 6.580 7.916 ( -14.457 0.000 -0.804) 14.479 7.963 ( -2.728 0.000 -7.126) 7.630 8.346 ( 2.399 0.000 8.626) 8.954 9.389 ( 9.144 0.000 -3.942) 9.957 9.478 ( 3.484 0.000 -7.863) 8.600 9.905 ( 1.156 0.000 9.115) 9.188 10.303 ( 1.156 0.000 -4.079) 4.240 10.663 ( 5.209 0.000 -0.793) 5.269 10.694 ( 17.603 0.000 7.760) 19.238 10.961 ( 7.987 0.000 2.520) 8.375 11.561 ( 9.362 0.000 -3.693) 10.064 11.928 ( 2.503 0.000 -0.290) 2.520 12.074 ( 2.618 0.000 -4.996) 5.641 12.611 ( -4.806 0.000 1.934) 5.180 12.732 ( -6.162 0.000 4.045) 7.371 12.787 ( -15.250 0.000 8.311) 17.367 13.356 ( -2.157 0.000 -4.054) 4.592 13.468 ( 3.478 0.000 -2.448) 4.253 13.940 ( -16.033 0.000 -2.750) 16.268 14.109 ( -7.132 0.000 -7.663) 10.468 14.226 ( -3.013 0.000 0.294) 3.028 14.383 ( 3.775 0.000 -6.856) 7.827 14.691 ( -11.575 0.000 -11.182) 16.094 15.750 ( 2.972 0.000 6.248) 6.918 16.017 ( 1.624 0.000 -7.219) 7.399 16.434 ( 10.142 0.000 -5.537) 11.555 16.940 ( 27.651 0.000 -12.511) 30.349 19.062 ( 2.531 0.000 0.810) 2.658 19.593 ( -7.197 0.000 5.823) 9.258 24.875 ( -8.356 0.000 6.331) 10.484 25.616 ( 0.716 0.000 -8.623) 8.653 25.737 ( 7.232 0.000 -5.898) 9.332 26.280 ( -22.873 0.000 -12.869) 26.245 26.522 ( 3.555 0.000 -0.572) 3.601 26.816 ( -3.973 0.000 -1.072) 4.115 26.941 ( 24.007 0.000 15.046) 28.332 27.499 ( -1.283 0.000 -2.450) 2.765 27.560 ( -5.050 0.000 -3.685) 6.251 27.794 ( -2.203 0.000 7.479) 7.796 28.096 ( 7.901 0.000 20.188) 21.679 29.292 ( 11.337 0.000 -3.118) 11.758 32.356 ( -0.409 0.000 5.052) 5.069 33.568 ( 0.991 0.000 -16.632) 16.661 ======================= Grid point 121 (63/150) ======================= q-point: ( 0.00 0.20 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.464 ( -11.482 9.777 31.276) 34.722 2.057 ( -3.300 24.016 24.513) 34.475 2.315 ( 7.637 -1.362 -2.062) 8.027 2.764 ( 25.442 -1.251 26.354) 36.652 3.014 ( 21.809 -3.548 28.187) 35.816 3.297 ( 6.324 23.195 12.771) 27.223 3.679 ( 0.033 -12.648 4.422) 13.399 3.745 ( 7.929 -2.671 14.946) 17.128 4.227 ( -7.273 5.775 17.301) 19.636 4.378 ( 0.218 -0.677 -1.858) 1.989 4.772 ( 5.507 -1.581 5.395) 7.870 4.986 ( 7.983 -6.805 -6.575) 12.381 5.377 ( 10.315 -7.251 -7.722) 14.785 5.584 ( -6.315 -3.353 0.964) 7.215 5.628 ( -2.988 0.584 -6.397) 7.084 5.910 ( 7.191 1.619 3.990) 8.382 6.232 ( 2.401 -3.218 9.761) 10.555 6.288 ( 1.657 4.485 5.170) 7.042 6.535 ( 1.761 -1.673 -2.638) 3.586 6.761 ( 10.241 -0.799 11.727) 15.589 6.952 ( 0.851 -11.422 7.506) 13.694 7.215 ( -7.168 -6.159 6.083) 11.238 7.482 ( 2.905 -5.573 2.999) 6.963 7.757 ( 0.658 -2.283 -8.889) 9.201 8.124 ( 0.120 16.727 -2.390) 16.898 8.442 ( -2.915 6.681 7.454) 10.426 9.358 ( 1.460 -5.842 -2.884) 6.677 9.601 ( 4.504 -0.291 -2.550) 5.184 9.998 ( 0.267 6.743 8.627) 10.953 10.392 ( 6.288 0.620 -1.384) 6.468 10.639 ( 0.759 -5.629 0.495) 5.701 10.826 ( 3.122 -4.834 -3.583) 6.778 11.102 ( 0.851 4.762 2.854) 5.617 11.606 ( 2.280 -8.267 -1.528) 8.711 11.875 ( 2.894 -4.508 -4.044) 6.712 12.158 ( -0.971 -7.232 -5.834) 9.342 12.462 ( -5.902 2.617 3.343) 7.270 12.472 ( -12.199 1.473 12.225) 17.333 12.934 ( -7.714 19.837 -0.402) 21.288 13.373 ( 3.700 -0.487 -1.707) 4.104 13.475 ( -1.742 -1.952 -1.435) 2.984 13.633 ( -4.460 -1.473 -4.999) 6.860 13.899 ( -11.194 4.185 -9.531) 15.286 14.239 ( 2.534 0.068 -4.340) 5.026 14.430 ( -11.473 -1.309 -13.845) 18.029 14.599 ( 4.239 6.712 -5.746) 9.799 15.698 ( 1.483 -1.357 -6.302) 6.615 16.053 ( 0.790 1.525 -10.707) 10.843 16.596 ( 5.576 1.623 -3.495) 6.778 17.052 ( 2.489 -12.137 -12.172) 17.368 19.217 ( -1.078 8.449 1.387) 8.630 19.395 ( -11.327 0.637 6.772) 13.213 24.780 ( -6.042 2.759 6.482) 9.281 25.121 ( -19.086 -8.318 4.967) 21.405 25.957 ( 2.891 7.438 -8.717) 11.818 26.147 ( 4.213 -0.271 -13.283) 13.937 26.624 ( 3.250 0.749 0.007) 3.335 26.668 ( -6.634 -0.342 -0.582) 6.668 27.390 ( -3.471 0.244 -3.630) 5.028 27.413 ( -8.092 0.034 -4.294) 9.161 27.721 ( -0.729 1.347 8.613) 8.749 27.785 ( 24.410 2.676 10.818) 26.834 28.315 ( 9.979 5.219 15.435) 19.107 29.382 ( 24.856 -27.829 4.705) 37.609 32.586 ( 1.349 19.515 -3.077) 19.802 33.352 ( -10.042 -6.294 -11.637) 16.609 ======================= Grid point 122 (64/150) ======================= q-point: ( 0.09 0.20 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.472 ( 4.984 21.306 20.711) 30.128 1.945 ( -4.461 38.931 27.021) 47.599 2.578 ( 18.946 -5.490 -14.987) 24.773 3.252 ( 16.553 -7.903 17.579) 25.406 3.451 ( 15.740 -3.563 21.077) 26.546 3.527 ( 10.663 8.659 11.189) 17.716 3.665 ( -1.761 -1.746 7.424) 7.827 3.913 ( 6.115 0.258 15.848) 16.989 4.117 ( -5.807 0.589 15.444) 16.510 4.355 ( -1.510 3.360 -0.901) 3.793 4.836 ( -0.610 -7.160 12.327) 14.269 5.089 ( 3.299 -3.881 -1.656) 5.357 5.412 ( -5.229 -2.613 -3.198) 6.663 5.452 ( -2.613 -5.131 -8.787) 10.506 5.716 ( 9.654 -4.472 -5.471) 11.964 6.040 ( 3.889 -3.090 10.285) 11.422 6.235 ( -0.711 3.072 3.948) 5.053 6.392 ( 6.879 -5.593 8.192) 12.071 6.599 ( 6.053 2.494 4.597) 8.000 6.927 ( -0.828 4.680 6.297) 7.889 7.089 ( 9.012 -13.180 5.091) 16.759 7.280 ( 12.954 -10.451 6.573) 17.895 7.570 ( 5.883 -2.503 3.786) 7.431 7.764 ( 0.993 -0.037 -7.745) 7.809 8.143 ( 4.150 12.908 -5.932) 14.800 8.364 ( -6.597 5.833 7.915) 11.840 9.359 ( -1.072 -5.326 -2.163) 5.848 9.614 ( -2.835 -0.235 -2.049) 3.506 9.993 ( -2.919 6.470 7.814) 10.556 10.447 ( -7.940 -4.800 -5.044) 10.560 10.643 ( 5.346 3.054 -1.573) 6.355 10.741 ( -6.045 4.039 -6.396) 9.683 11.034 ( -7.835 4.072 1.075) 8.896 11.543 ( -9.119 -9.661 0.065) 13.285 11.955 ( 4.526 -7.511 -0.728) 8.800 12.120 ( -2.260 -9.824 -5.640) 11.551 12.266 ( -9.703 1.017 8.612) 13.013 12.326 ( -7.120 1.220 5.270) 8.942 12.817 ( -3.870 19.497 -4.889) 20.469 13.331 ( -3.164 -2.080 -2.432) 4.500 13.466 ( -2.408 4.504 -2.706) 5.780 13.726 ( 7.903 1.028 -4.456) 9.131 13.766 ( 4.149 3.787 -8.693) 10.350 14.194 ( -8.128 -0.433 -11.888) 14.408 14.325 ( 6.352 -3.728 -2.467) 7.767 14.640 ( 0.846 -0.387 -4.201) 4.303 15.676 ( -2.173 8.322 -5.586) 10.256 16.006 ( -3.018 5.148 -9.335) 11.079 16.637 ( -0.557 -0.710 -3.019) 3.151 16.911 ( -12.523 -5.859 -1.555) 13.913 19.177 ( -2.051 1.848 4.681) 5.435 19.277 ( -2.839 0.884 5.403) 6.167 24.703 ( -2.993 1.478 5.057) 6.059 24.840 ( -10.332 -1.986 4.767) 11.551 26.024 ( 5.194 2.360 -2.367) 6.177 26.142 ( -1.978 -0.529 -10.665) 10.859 26.605 ( -0.286 1.890 2.486) 3.136 26.720 ( 5.244 -1.004 0.717) 5.387 27.223 ( -9.263 0.093 -1.707) 9.420 27.265 ( -7.738 -1.039 -3.960) 8.755 27.621 ( -7.170 5.069 4.005) 9.651 28.159 ( 5.961 -11.966 9.294) 16.282 28.634 ( 20.562 13.783 8.732) 26.250 29.895 ( 24.564 -30.328 -7.458) 39.734 32.575 ( -1.976 18.041 -3.416) 18.467 33.101 ( -12.192 -1.961 -6.840) 14.116 ======================= Grid point 123 (65/150) ======================= q-point: ( 0.18 0.20 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.681 ( 14.358 18.815 13.076) 27.039 2.137 ( 18.421 29.277 7.990) 35.501 2.941 ( 20.598 -5.500 -15.415) 26.308 3.331 ( -13.842 0.345 13.916) 19.631 3.529 ( 0.569 -8.169 14.276) 16.458 3.635 ( -1.433 -8.291 3.266) 9.025 3.870 ( 12.651 4.511 8.098) 15.683 4.040 ( -0.490 -1.416 9.454) 9.573 4.084 ( 1.993 -0.535 18.645) 18.759 4.368 ( 3.358 8.574 3.212) 9.752 4.817 ( -3.907 -6.886 16.124) 17.963 5.129 ( 1.282 4.114 -0.333) 4.322 5.296 ( -3.276 0.558 -3.517) 4.838 5.444 ( 3.078 -11.361 -15.558) 19.509 5.862 ( 5.676 -7.282 -3.758) 9.968 6.090 ( -1.401 -3.212 15.711) 16.097 6.252 ( 2.189 3.893 -6.266) 7.695 6.537 ( 5.992 -5.937 3.299) 9.058 6.757 ( 6.679 3.425 7.286) 10.461 6.911 ( -0.683 8.398 6.686) 10.756 7.189 ( 2.999 -11.695 0.531) 12.085 7.528 ( 7.184 -6.519 5.854) 11.330 7.704 ( 5.629 1.725 2.416) 6.364 7.752 ( -0.101 4.582 -6.167) 7.684 8.220 ( -8.565 3.145 4.348) 10.107 8.299 ( 11.900 -2.023 -11.672) 16.791 9.291 ( -6.007 -3.087 -1.581) 6.936 9.495 ( -7.960 -0.181 -3.416) 8.664 9.906 ( -7.449 3.157 6.461) 10.354 10.107 ( -20.303 2.078 -9.569) 22.540 10.594 ( -1.548 7.618 -3.235) 8.420 10.842 ( -10.420 1.909 0.667) 10.614 10.927 ( 15.103 -0.396 1.712) 15.205 11.301 ( -14.150 -7.926 1.797) 16.318 11.990 ( -9.817 -5.176 7.597) 13.449 12.016 ( 2.385 -6.368 -1.509) 6.966 12.220 ( 2.181 -4.542 0.103) 5.040 12.245 ( -2.200 -1.662 0.045) 2.758 12.724 ( -5.412 20.969 -10.482) 24.059 13.278 ( -5.000 3.787 -1.543) 6.459 13.387 ( 1.778 5.197 -6.870) 8.796 13.793 ( -2.073 -1.780 -11.098) 11.430 13.920 ( 8.831 -2.247 -0.558) 9.130 14.180 ( 9.974 -1.176 -3.605) 10.670 14.471 ( 8.246 -2.848 1.316) 8.822 14.628 ( -0.721 -3.450 -1.954) 4.030 15.611 ( -3.810 13.400 2.505) 14.155 15.925 ( -2.989 5.737 -8.891) 10.995 16.572 ( -5.434 -3.033 -1.715) 6.455 16.640 ( -15.139 -3.212 3.395) 15.844 19.175 ( 0.157 -0.940 4.089) 4.198 19.258 ( -0.539 -1.133 3.922) 4.118 24.685 ( 0.220 0.498 2.323) 2.386 24.714 ( -4.115 -0.226 0.829) 4.203 26.065 ( -3.021 0.389 -4.414) 5.363 26.139 ( 5.638 -1.449 1.972) 6.146 26.625 ( 1.140 4.139 2.447) 4.942 26.814 ( 4.275 -1.267 1.246) 4.630 27.067 ( -6.499 -0.298 0.912) 6.569 27.106 ( -7.491 -1.775 -2.189) 8.004 27.470 ( -8.743 7.313 -0.461) 11.407 28.156 ( -6.081 -12.158 7.658) 15.602 29.034 ( 18.155 12.835 1.976) 22.322 30.222 ( 11.523 -24.283 -13.441) 30.051 32.505 ( -4.288 13.223 -0.366) 13.906 32.887 ( -8.596 -0.971 -7.119) 11.203 ======================= Grid point 124 (66/150) ======================= q-point: ( 0.27 0.20 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.098 ( 26.084 3.535 1.262) 26.353 2.563 ( 23.100 18.962 -4.769) 30.264 2.923 ( -21.712 0.469 14.177) 25.935 3.359 ( 16.598 -4.360 -6.258) 18.266 3.499 ( -10.650 -15.797 4.640) 19.609 3.556 ( -2.010 -5.366 11.907) 13.215 3.958 ( -3.590 -2.783 1.746) 4.866 4.032 ( 0.691 -2.409 5.097) 5.680 4.204 ( 4.116 9.871 12.443) 16.407 4.452 ( 2.091 9.677 6.240) 11.703 4.777 ( -2.038 -2.308 13.047) 13.406 5.129 ( 0.082 3.077 -5.526) 6.325 5.274 ( 0.331 -0.044 -7.959) 7.966 5.514 ( 6.867 -3.508 -12.744) 14.895 5.922 ( 1.438 -11.171 -2.523) 11.543 6.039 ( -6.356 -0.862 7.022) 9.511 6.277 ( 2.061 3.922 -12.865) 13.607 6.595 ( -1.082 -1.279 1.307) 2.125 6.816 ( 0.207 0.061 -0.541) 0.582 6.959 ( 1.519 7.510 9.736) 12.389 7.236 ( 2.006 -8.485 -3.119) 9.260 7.536 ( -6.934 -2.695 2.499) 7.848 7.752 ( 1.753 6.369 -2.860) 7.199 7.789 ( 2.126 7.078 -1.446) 7.530 8.050 ( -7.477 1.927 2.632) 8.158 8.474 ( 6.332 -12.944 -17.781) 22.886 9.128 ( -9.685 1.036 -2.327) 10.014 9.343 ( -5.548 -1.908 -3.494) 6.829 9.735 ( -10.646 1.395 5.418) 12.027 9.808 ( -7.656 0.325 -1.348) 7.780 10.590 ( -4.934 5.424 4.722) 8.722 10.677 ( -0.243 3.793 -3.483) 5.155 11.056 ( -10.913 -4.913 1.831) 12.107 11.206 ( 10.771 -4.274 -2.716) 11.902 11.846 ( -5.045 -2.149 8.374) 10.010 12.078 ( 4.346 -5.415 1.751) 7.161 12.181 ( -3.641 0.797 -0.679) 3.789 12.284 ( 1.736 -3.446 -2.389) 4.538 12.593 ( -2.330 16.094 -11.733) 20.053 13.216 ( -0.352 7.330 0.014) 7.338 13.461 ( 5.460 1.458 -5.405) 7.820 13.670 ( -6.099 -7.389 -12.624) 15.848 14.089 ( 7.954 -1.504 3.170) 8.694 14.412 ( 11.295 -3.378 -0.440) 11.797 14.583 ( 1.875 -1.598 -0.559) 2.526 14.671 ( 6.526 -1.371 4.575) 8.087 15.546 ( -3.995 11.954 8.701) 15.315 15.862 ( -1.650 5.494 -7.836) 9.711 16.348 ( -15.625 -2.424 4.914) 16.558 16.430 ( -8.684 -3.500 -1.761) 9.527 19.177 ( -1.104 -0.870 4.628) 4.837 19.264 ( 0.419 -2.468 1.345) 2.842 24.663 ( -1.099 1.059 -2.382) 2.829 24.720 ( 3.096 -0.289 -1.330) 3.382 26.005 ( -2.671 1.569 0.237) 3.107 26.239 ( 3.128 -5.795 4.696) 8.088 26.654 ( 1.476 7.108 3.710) 8.153 26.896 ( 3.980 -1.172 2.972) 5.103 26.977 ( -3.583 -1.182 1.304) 3.992 26.990 ( -3.493 -1.184 0.880) 3.792 27.290 ( -9.027 7.873 -3.747) 12.551 27.996 ( -11.158 -11.116 5.371) 16.641 29.316 ( 11.066 11.739 -5.391) 17.009 30.313 ( 1.766 -16.124 -15.610) 22.512 32.428 ( -3.582 7.841 1.650) 8.777 32.732 ( -6.050 -1.518 -7.394) 9.674 ======================= Grid point 125 (67/150) ======================= q-point: ( 0.36 0.20 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.505 ( -17.730 5.247 11.515) 21.783 2.630 ( 22.505 -7.239 -4.410) 24.049 2.952 ( 15.665 4.385 -6.358) 17.466 3.298 ( -7.719 -15.469 5.750) 18.219 3.489 ( -6.637 0.121 8.694) 10.938 3.558 ( -0.304 -12.739 5.662) 13.945 3.944 ( 4.496 4.727 -5.717) 8.674 4.040 ( 0.610 -2.539 3.746) 4.567 4.251 ( -1.255 11.165 7.186) 13.337 4.420 ( -6.326 4.845 9.169) 12.147 4.813 ( 3.226 8.591 0.415) 9.186 5.108 ( -0.965 2.239 -15.640) 15.829 5.268 ( 1.185 -3.474 -3.968) 5.405 5.601 ( 2.879 5.004 -11.188) 12.590 5.798 ( -14.166 -1.237 -3.360) 14.612 6.005 ( 4.597 -11.487 -9.433) 15.559 6.270 ( -0.427 2.762 -13.189) 13.482 6.516 ( -5.795 2.019 -2.252) 6.537 6.798 ( -2.552 -0.074 -3.741) 4.529 6.928 ( -5.483 3.524 0.879) 6.577 7.245 ( 0.038 -7.736 -5.953) 9.761 7.299 ( -17.151 -2.793 0.555) 17.386 7.763 ( 1.159 8.366 -0.756) 8.480 7.822 ( 3.113 5.615 -3.452) 7.289 8.021 ( 2.852 2.412 3.058) 4.828 8.462 ( -2.573 -9.498 -12.553) 15.950 8.946 ( -7.752 2.171 -1.757) 8.240 9.288 ( -0.472 -5.481 -5.813) 8.004 9.595 ( -5.771 0.378 6.940) 9.034 9.737 ( -0.737 -2.897 5.716) 6.450 10.450 ( -6.933 7.027 3.480) 10.467 10.764 ( 5.356 2.207 -2.613) 6.354 10.898 ( -5.623 -2.660 0.054) 6.220 11.245 ( -4.841 -6.324 -8.329) 11.524 11.856 ( 2.689 4.692 8.535) 10.104 12.057 ( -6.976 6.458 2.786) 9.906 12.225 ( 7.664 -0.547 2.013) 7.943 12.327 ( 7.733 -3.760 -4.022) 9.493 12.656 ( 8.798 0.148 -7.862) 11.800 13.243 ( 2.062 3.777 3.224) 5.377 13.533 ( -3.007 -7.381 -8.726) 11.818 13.552 ( 2.777 0.149 -9.153) 9.566 14.230 ( 5.544 -0.038 6.361) 8.438 14.528 ( 1.282 -3.197 -0.537) 3.486 14.666 ( 6.452 0.360 2.059) 6.783 14.808 ( 5.665 -1.439 6.418) 8.680 15.495 ( -3.335 9.093 11.573) 15.091 15.827 ( -0.766 4.137 -6.009) 7.335 16.063 ( -14.694 -1.105 4.325) 15.357 16.245 ( -9.538 -2.979 -1.941) 10.179 19.152 ( -2.303 0.009 4.571) 5.118 19.275 ( 0.641 -2.770 -0.137) 2.846 24.660 ( 1.496 2.184 -4.307) 5.055 24.796 ( 5.366 -1.200 -5.363) 7.681 25.962 ( -2.204 1.671 3.612) 4.549 26.258 ( -2.337 -8.859 6.334) 11.138 26.690 ( 0.161 10.183 7.277) 12.517 26.938 ( -0.336 -1.267 1.531) 2.016 26.968 ( 0.866 -0.703 3.434) 3.610 26.986 ( 3.402 -0.494 2.247) 4.107 27.138 ( -4.235 6.179 -4.416) 8.696 27.777 ( -11.559 -9.830 4.054) 15.706 29.428 ( 2.240 10.918 -13.049) 17.161 30.251 ( -4.266 -10.550 -18.106) 21.385 32.376 ( -2.086 4.433 1.910) 5.258 32.633 ( -2.453 -2.390 -5.902) 6.823 ======================= Grid point 126 (68/150) ======================= q-point: ( 0.45 0.20 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.192 ( -13.342 4.799 4.703) 14.938 2.851 ( -6.590 -12.663 13.233) 19.465 3.184 ( 8.924 -9.449 -9.193) 15.920 3.229 ( -1.615 -13.138 -1.861) 13.368 3.364 ( -4.773 3.644 5.581) 8.198 3.540 ( 2.676 2.266 -2.741) 4.451 3.940 ( -5.873 2.703 3.880) 7.540 4.098 ( -1.095 2.108 -3.681) 4.380 4.176 ( -6.792 9.616 3.988) 12.430 4.370 ( 4.406 -1.508 4.647) 6.578 4.838 ( -1.687 7.425 -6.204) 9.821 5.032 ( -1.877 5.872 -22.478) 23.308 5.246 ( -8.678 -2.412 2.231) 9.279 5.499 ( -5.866 -1.183 -18.230) 19.187 5.576 ( -4.859 9.871 -10.290) 15.064 6.104 ( 6.779 -13.376 -11.241) 18.741 6.159 ( -9.675 1.014 -8.534) 12.941 6.447 ( 1.493 0.999 -8.195) 8.390 6.666 ( -8.592 -2.539 -5.571) 10.550 6.806 ( -8.779 3.633 -6.673) 11.610 6.998 ( -8.501 -3.442 -2.177) 9.426 7.208 ( -3.086 -3.777 -0.906) 4.961 7.807 ( 2.605 9.368 0.634) 9.744 7.924 ( 7.997 2.183 -2.470) 8.650 8.095 ( 3.005 -1.892 2.580) 4.389 8.375 ( -4.281 -0.989 -4.182) 6.066 8.846 ( -1.860 1.609 -1.031) 2.667 9.269 ( -0.095 -8.480 -7.120) 11.073 9.529 ( -2.190 1.263 6.932) 7.379 9.770 ( 1.735 -4.629 8.791) 10.086 10.364 ( -2.459 11.093 1.225) 11.429 10.810 ( -1.002 1.489 -3.405) 3.849 10.832 ( -0.990 -3.527 -3.142) 4.826 11.080 ( -8.285 -3.731 -10.942) 14.223 11.896 ( -2.223 12.150 6.088) 13.770 12.004 ( 3.618 4.950 5.244) 8.068 12.362 ( 6.643 -1.589 2.450) 7.256 12.575 ( 14.766 -5.447 -1.429) 15.804 12.835 ( 10.628 -8.299 -6.242) 14.859 13.285 ( 1.466 -6.548 3.607) 7.619 13.477 ( 1.496 -1.534 -11.250) 11.452 13.593 ( 1.384 0.971 -5.042) 5.318 14.330 ( 3.308 3.445 9.269) 10.427 14.534 ( -0.246 1.816 2.140) 2.817 14.763 ( 2.634 -2.542 1.936) 4.141 14.911 ( 3.486 -2.521 8.847) 9.838 15.467 ( -2.228 6.513 12.927) 14.646 15.780 ( -7.312 -0.261 1.355) 7.441 15.819 ( -7.193 3.790 -4.879) 9.482 16.087 ( -5.352 -2.441 -2.483) 6.385 19.112 ( -2.481 1.448 3.806) 4.769 19.293 ( 1.451 -2.780 -0.189) 3.142 24.707 ( 4.454 2.831 -5.060) 7.311 24.901 ( 7.006 -1.952 -9.180) 11.712 25.934 ( -1.751 0.900 6.130) 6.438 26.175 ( -8.049 -7.940 9.091) 14.508 26.663 ( -3.576 10.305 5.156) 12.065 26.962 ( 2.392 -0.457 0.782) 2.558 26.991 ( 1.028 -0.941 0.106) 1.398 27.030 ( 0.417 -0.085 4.096) 4.118 27.170 ( 6.588 3.148 2.276) 7.648 27.616 ( -4.562 -7.645 5.666) 10.553 29.346 ( -7.274 10.605 -19.626) 23.464 30.086 ( -8.476 -8.144 -21.273) 24.305 32.354 ( -0.641 3.416 1.556) 3.808 32.624 ( 2.819 -3.458 -4.356) 6.235 ======================= Grid point 127 (69/150) ======================= q-point: (-0.45 0.20 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( -6.405 0.929 -0.918) 6.536 2.617 ( -17.433 -12.137 16.226) 26.730 3.022 ( -12.238 4.005 1.696) 12.988 3.203 ( -2.434 -7.434 -7.831) 11.069 3.378 ( -13.059 2.828 -5.898) 14.606 3.593 ( 9.002 -7.390 -7.096) 13.638 3.780 ( -16.352 3.192 -8.188) 18.564 3.929 ( -4.135 6.416 0.344) 7.641 4.111 ( -1.660 -1.389 -0.584) 2.242 4.542 ( 9.223 -0.924 -3.558) 9.928 4.687 ( -12.500 -2.424 -0.827) 12.759 4.937 ( -11.046 4.264 -6.379) 13.449 5.017 ( -1.108 11.844 -16.367) 20.233 5.396 ( -6.520 10.410 -11.302) 16.692 5.546 ( 4.704 -3.323 -6.703) 8.837 5.921 ( -9.434 4.263 -11.969) 15.825 6.206 ( 4.363 -9.801 -9.363) 14.239 6.461 ( -3.954 -6.867 -5.540) 9.669 6.518 ( -3.213 -2.867 -6.492) 7.790 6.610 ( -5.068 -2.570 -3.105) 6.475 6.981 ( 4.460 4.739 -3.429) 7.356 7.148 ( -2.548 -3.574 2.747) 5.178 7.836 ( 0.075 8.664 0.258) 8.668 8.049 ( 0.599 -1.620 0.993) 1.993 8.169 ( 8.503 -3.024 -4.594) 10.127 8.293 ( -3.374 2.833 -1.467) 4.644 8.875 ( 4.554 0.832 -0.189) 4.633 9.262 ( 0.858 -9.775 -6.325) 11.674 9.546 ( 2.294 2.949 7.171) 8.086 9.826 ( 2.178 -4.828 8.970) 10.417 10.356 ( 1.431 13.344 -0.169) 13.422 10.720 ( -5.987 2.546 -5.039) 8.229 10.813 ( -2.009 -4.980 -10.288) 11.605 10.939 ( -2.325 0.044 -6.858) 7.241 11.862 ( -1.726 8.385 6.317) 10.640 12.135 ( 6.920 7.155 1.524) 10.070 12.479 ( 4.177 -4.737 4.964) 8.033 12.791 ( 6.810 -2.643 0.774) 7.346 13.038 ( 11.231 -14.026 -4.688) 18.570 13.335 ( 3.283 -10.970 0.368) 11.457 13.549 ( 7.730 0.685 -8.734) 11.684 13.587 ( -0.257 2.721 -5.788) 6.401 14.394 ( 1.039 7.030 10.445) 12.633 14.532 ( -0.718 4.755 4.746) 6.757 14.779 ( -1.219 -3.418 2.963) 4.685 14.981 ( 1.626 -5.160 12.504) 13.624 15.452 ( -2.158 2.412 11.823) 12.258 15.588 ( -8.503 0.233 0.440) 8.518 15.757 ( -0.293 6.104 -6.789) 9.135 16.042 ( 0.810 -1.881 -3.981) 4.478 19.078 ( -1.609 3.434 2.874) 4.758 19.336 ( 3.052 -2.816 0.816) 4.232 24.811 ( 7.302 2.966 -4.771) 9.214 25.026 ( 7.998 -2.213 -12.128) 14.695 25.921 ( -1.107 -0.747 7.654) 7.769 25.984 ( -13.198 -3.040 10.631) 17.218 26.627 ( -0.228 5.033 3.393) 6.074 26.890 ( -8.471 -2.419 -2.195) 9.078 27.060 ( 6.551 0.650 3.641) 7.523 27.121 ( 6.773 -0.658 4.555) 8.189 27.330 ( 8.223 3.157 5.575) 10.424 27.638 ( 4.101 -4.703 9.049) 10.992 29.073 ( -16.145 11.141 -23.931) 30.943 29.847 ( -11.166 -8.384 -24.593) 28.281 32.358 ( 0.751 4.323 1.175) 4.542 32.722 ( 8.035 -4.834 -3.983) 10.188 ======================= Grid point 128 (70/150) ======================= q-point: (-0.36 0.20 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.857 ( -11.653 -3.663 2.649) 12.499 2.362 ( -9.780 -7.404 5.854) 13.592 2.725 ( -23.866 8.303 1.257) 25.301 2.944 ( -13.456 10.630 -9.283) 19.499 3.181 ( -17.287 -5.088 -21.332) 27.925 3.271 ( -15.518 -2.743 1.878) 15.870 3.739 ( 5.943 -16.007 -12.925) 21.415 3.981 ( 3.672 -1.661 2.243) 4.612 4.086 ( -1.801 -4.686 6.971) 8.590 4.373 ( -18.069 -13.338 5.559) 23.136 4.665 ( 5.256 8.866 -14.145) 17.502 4.718 ( -7.052 5.522 -6.989) 11.361 5.044 ( 0.294 20.514 -0.593) 20.525 5.288 ( -1.026 18.864 -8.231) 20.607 5.616 ( 3.610 -2.058 -6.899) 8.054 5.836 ( 2.934 7.300 -5.881) 9.823 6.194 ( -4.160 -3.557 -2.195) 5.897 6.313 ( -7.431 -3.594 -5.698) 10.031 6.446 ( -2.425 -7.969 -4.921) 9.675 6.669 ( 8.542 -14.328 -4.216) 17.206 7.069 ( 2.509 0.790 0.506) 2.679 7.137 ( 0.764 -1.652 3.849) 4.257 7.843 ( 1.847 4.724 1.682) 5.344 7.998 ( -3.549 3.986 -0.918) 5.415 8.224 ( -3.639 -0.790 -2.960) 4.757 8.354 ( 9.748 -4.492 -12.181) 16.235 8.993 ( 6.919 0.061 -0.203) 6.922 9.276 ( 1.811 -8.831 -5.432) 10.525 9.633 ( 4.791 3.514 7.912) 9.895 9.892 ( 2.852 -3.783 9.427) 10.550 10.413 ( 4.040 11.036 -1.148) 11.809 10.605 ( -3.609 4.713 -4.443) 7.415 10.695 ( -5.808 -1.677 -14.202) 15.435 10.978 ( 5.635 -2.022 -2.757) 6.591 11.854 ( -0.251 5.157 3.712) 6.359 12.226 ( 1.869 8.594 -0.656) 8.819 12.543 ( 1.919 -8.636 5.163) 10.243 12.868 ( 1.446 -1.774 2.636) 3.491 13.206 ( 6.211 -12.431 -2.523) 14.124 13.382 ( 1.026 -9.103 0.927) 9.207 13.547 ( -1.813 6.304 -4.187) 7.782 13.760 ( 14.195 -0.493 -11.825) 18.482 14.406 ( -1.667 6.241 8.010) 10.290 14.520 ( -1.872 6.403 6.225) 9.125 14.727 ( -5.195 -3.386 3.464) 7.103 15.025 ( -0.205 -6.455 14.897) 16.236 15.430 ( -2.313 -3.098 5.395) 6.637 15.508 ( 2.204 -1.302 -1.403) 2.919 15.799 ( 5.560 9.131 -1.675) 10.821 16.082 ( 4.266 -0.269 -6.259) 7.579 19.067 ( 0.050 5.968 1.986) 6.290 19.414 ( 4.563 -2.843 2.665) 6.001 24.965 ( 9.433 2.569 -3.527) 10.393 25.152 ( 7.275 -1.905 -13.228) 15.216 25.735 ( -13.374 1.310 10.065) 16.789 25.934 ( 0.647 -3.598 8.198) 8.977 26.670 ( 3.170 0.034 5.225) 6.111 26.719 ( -7.318 -0.795 -2.293) 7.710 27.226 ( 9.189 0.145 6.257) 11.118 27.279 ( 8.380 -0.519 3.953) 9.280 27.490 ( 6.693 3.577 6.296) 9.861 27.759 ( 5.266 -3.403 10.954) 12.622 28.640 ( -23.128 12.919 -25.677) 36.893 29.565 ( -12.412 -10.770 -26.702) 31.353 32.387 ( 1.965 6.644 0.958) 6.994 32.908 ( 11.789 -6.549 -4.978) 14.376 ======================= Grid point 129 (71/150) ======================= q-point: (-0.27 0.20 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.664 ( -4.895 1.347 1.240) 5.226 2.095 ( -25.691 0.639 2.960) 25.869 2.236 ( -17.617 8.499 10.136) 22.030 2.641 ( -20.556 1.821 -10.067) 22.961 2.894 ( 6.240 7.856 -5.393) 11.390 3.118 ( -14.450 -21.730 9.083) 27.631 3.762 ( -0.637 -21.777 -7.955) 23.193 3.883 ( -11.784 -14.923 6.627) 20.136 4.140 ( 5.685 0.061 5.902) 8.195 4.206 ( -0.182 -1.209 4.583) 4.743 4.621 ( -1.646 9.604 -10.450) 14.288 4.742 ( 5.408 5.961 -12.075) 14.512 4.951 ( -8.625 23.635 7.097) 26.142 5.342 ( 7.268 24.193 -5.001) 25.751 5.698 ( 5.862 4.365 -6.402) 9.716 5.934 ( 5.866 6.320 2.244) 8.910 6.071 ( -7.225 -2.536 -2.628) 8.096 6.188 ( -4.057 0.383 -4.338) 5.952 6.412 ( -0.504 -10.434 -4.876) 11.528 6.841 ( 6.995 -17.389 2.415) 18.898 7.097 ( 3.363 -2.279 -4.518) 6.076 7.136 ( -3.326 -5.229 10.496) 12.188 7.905 ( -0.677 5.345 -3.259) 6.296 7.960 ( 3.480 -0.220 -0.143) 3.490 8.141 ( -3.544 -1.396 -3.698) 5.309 8.437 ( 1.115 -5.045 -18.170) 18.891 9.120 ( 6.184 -0.020 -1.830) 6.449 9.308 ( 2.729 -6.349 -5.317) 8.719 9.758 ( 6.214 3.145 9.184) 11.526 9.988 ( 5.595 -3.439 12.541) 14.157 10.430 ( -2.044 2.687 -6.477) 7.304 10.562 ( -3.307 -0.541 -8.973) 9.579 10.655 ( 7.882 9.440 -0.179) 12.299 11.120 ( 9.251 -3.607 -1.684) 10.071 11.863 ( 0.599 2.731 0.202) 2.803 12.220 ( -1.459 8.068 -0.308) 8.205 12.578 ( 0.606 -7.990 2.269) 8.328 12.861 ( -2.833 -1.807 4.492) 5.610 13.268 ( 0.459 -7.359 0.004) 7.374 13.371 ( -2.153 -7.370 -0.309) 7.685 13.505 ( -1.498 10.767 -2.187) 11.088 13.992 ( 11.181 0.799 -11.782) 16.262 14.362 ( -4.710 3.313 3.977) 6.998 14.482 ( -3.006 7.448 4.727) 9.320 14.591 ( -8.813 -2.258 2.314) 9.388 15.018 ( -3.821 -4.917 9.453) 11.320 15.429 ( 2.698 -6.779 1.175) 7.390 15.654 ( 11.636 -10.093 -2.326) 15.578 15.953 ( 10.086 9.564 2.556) 14.132 16.191 ( 8.923 3.252 -6.769) 11.662 19.090 ( 1.972 8.914 1.173) 9.205 19.515 ( 4.745 -2.729 4.961) 7.388 25.156 ( 10.631 0.933 -1.609) 10.793 25.203 ( -1.844 -0.210 -6.337) 6.603 25.575 ( -2.287 3.272 3.251) 5.149 25.985 ( 3.137 -8.668 6.991) 11.570 26.610 ( -2.049 3.412 -0.026) 3.980 26.775 ( 4.919 -1.880 6.728) 8.544 27.400 ( 6.255 -0.951 4.327) 7.665 27.456 ( 8.821 -1.447 2.121) 9.187 27.604 ( 3.785 4.036 6.978) 8.905 27.847 ( -0.514 -2.617 6.923) 7.419 28.112 ( -23.599 16.454 -18.887) 34.415 29.276 ( -11.590 -14.765 -24.427) 30.806 32.435 ( 2.739 9.963 0.840) 10.366 33.142 ( 13.228 -8.475 -7.293) 17.320 ======================= Grid point 130 (72/150) ======================= q-point: (-0.18 0.20 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.724 ( -1.895 11.740 12.364) 17.155 1.737 ( 1.316 10.768 19.990) 22.744 2.009 ( -5.202 1.926 13.783) 14.858 2.407 ( -6.060 -7.770 3.788) 10.557 2.696 ( -22.733 -18.020 18.803) 34.570 3.135 ( 13.539 -1.527 3.092) 13.971 3.674 ( -11.011 5.497 3.491) 12.793 3.750 ( -2.180 -23.452 6.882) 24.538 4.247 ( 1.079 2.232 12.217) 12.466 4.258 ( 5.342 -0.824 1.453) 5.597 4.592 ( 0.466 14.322 -5.773) 15.449 4.772 ( 0.335 10.703 -5.213) 11.910 4.926 ( 8.214 0.247 -6.764) 10.644 5.520 ( 11.247 20.966 -2.769) 23.953 5.760 ( 0.141 -0.144 0.038) 0.206 5.905 ( -7.995 -0.653 1.156) 8.104 6.068 ( 5.590 4.741 -1.209) 7.428 6.152 ( 1.603 7.463 -4.392) 8.806 6.398 ( 0.505 -8.992 -2.309) 9.297 6.858 ( -5.021 -4.800 7.534) 10.247 7.065 ( -6.076 -16.101 12.937) 21.529 7.248 ( 11.294 -7.194 -7.096) 15.155 7.802 ( -8.035 2.966 -10.163) 13.291 7.955 ( -6.716 -9.348 -6.914) 13.427 8.125 ( 0.053 2.158 -0.391) 2.193 8.382 ( 0.611 3.741 -7.438) 8.348 9.227 ( 5.602 -0.465 -3.411) 6.576 9.368 ( 4.869 -3.944 -5.538) 8.363 9.882 ( 4.217 3.734 8.493) 10.191 10.201 ( 13.743 -7.361 16.237) 22.510 10.356 ( -2.994 1.696 -7.265) 8.038 10.543 ( 2.922 -2.900 -3.687) 5.526 10.846 ( 10.075 7.852 2.404) 12.998 11.313 ( 10.527 -4.976 -1.202) 11.706 11.871 ( 0.420 0.892 -3.186) 3.335 12.195 ( -0.795 5.469 -0.737) 5.575 12.571 ( -1.472 -4.739 0.278) 4.970 12.786 ( -5.967 -1.067 7.138) 9.364 13.204 ( -6.593 4.909 3.274) 8.848 13.352 ( 0.966 -7.017 -1.824) 7.314 13.467 ( -2.444 8.604 -3.182) 9.493 14.121 ( 2.656 -1.459 -8.464) 8.990 14.206 ( -10.639 3.802 1.132) 11.355 14.415 ( -7.794 1.833 -1.465) 8.140 14.458 ( -0.843 7.054 -1.143) 7.195 14.899 ( -9.101 -2.233 -0.289) 9.375 15.528 ( 5.939 -8.753 4.062) 11.331 15.878 ( 11.101 -13.265 -11.103) 20.554 16.194 ( 13.712 4.579 1.834) 14.572 16.431 ( 17.865 2.809 -4.025) 18.527 19.143 ( 3.193 11.509 0.340) 11.949 19.599 ( 2.052 -2.431 6.364) 7.114 25.071 ( -9.296 2.657 3.877) 10.417 25.350 ( 8.329 -5.039 0.166) 9.736 25.656 ( 9.288 4.143 -6.177) 11.899 26.077 ( 4.916 -13.725 2.021) 14.718 26.669 ( 8.289 8.456 6.496) 13.506 26.858 ( 1.374 -1.344 3.602) 4.083 27.304 ( -25.128 9.485 -19.016) 32.909 27.504 ( 0.769 -0.550 -1.210) 1.535 27.656 ( -2.361 4.963 -1.165) 5.618 27.732 ( 5.702 2.887 3.224) 7.158 27.978 ( 1.201 2.790 19.224) 19.462 29.055 ( -6.043 -19.217 -13.195) 24.081 32.492 ( 2.974 13.866 0.460) 14.189 33.363 ( 10.687 -10.194 -10.941) 18.381 ======================= Grid point 131 (73/150) ======================= q-point: (-0.09 0.20 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.722 ( -14.125 9.529 22.057) 27.872 1.868 ( 9.241 6.220 41.171) 42.651 2.153 ( 11.346 -1.997 16.573) 20.184 2.368 ( 7.956 -3.491 7.122) 11.235 2.611 ( 10.652 -9.074 17.329) 22.273 3.326 ( -6.131 22.122 20.788) 30.970 3.512 ( 5.330 5.663 5.818) 9.712 3.724 ( -2.598 -20.609 8.216) 22.338 4.277 ( -1.650 5.120 18.980) 19.727 4.346 ( 3.409 -1.501 -1.962) 4.210 4.642 ( 5.628 9.049 -0.274) 10.661 4.841 ( 7.729 -2.522 -9.993) 12.882 5.138 ( 14.022 -6.897 -8.946) 18.006 5.687 ( -1.817 3.433 -3.265) 5.074 5.726 ( -0.861 -2.517 8.092) 8.518 5.781 ( 0.411 8.343 -6.913) 10.843 6.171 ( 6.065 1.302 8.276) 10.342 6.185 ( 1.356 3.968 -0.971) 4.305 6.464 ( 6.057 -0.471 -2.830) 6.702 6.748 ( -6.593 1.035 7.135) 9.770 6.973 ( -5.305 -20.652 13.485) 25.229 7.410 ( 5.716 -7.945 -2.420) 10.082 7.497 ( -19.087 -4.102 -9.339) 21.642 7.804 ( -4.416 -4.831 -7.299) 9.804 8.118 ( 0.372 13.166 0.619) 13.185 8.438 ( 2.226 6.192 4.220) 7.817 9.315 ( 3.868 -3.850 -3.658) 6.570 9.480 ( 7.494 -1.405 -4.421) 8.814 9.958 ( 2.041 5.510 8.618) 10.431 10.322 ( 1.239 1.761 -4.434) 4.930 10.515 ( 12.191 -11.104 10.068) 19.321 10.657 ( 9.690 -5.080 0.266) 10.944 11.018 ( 6.629 5.604 3.121) 9.224 11.499 ( 8.383 -6.422 -1.495) 10.666 11.865 ( 0.029 -0.776 -5.382) 5.438 12.181 ( -0.525 -0.855 -2.774) 2.950 12.531 ( -2.607 0.248 1.029) 2.814 12.658 ( -9.200 0.009 10.163) 13.709 13.078 ( -6.957 15.655 2.902) 17.375 13.360 ( -1.203 -1.267 -2.002) 2.657 13.430 ( 1.991 0.472 -4.355) 4.812 13.898 ( -16.103 -3.368 -0.873) 16.475 14.126 ( -7.060 2.208 -6.404) 9.784 14.252 ( -4.542 2.239 -5.544) 7.509 14.502 ( 5.013 8.230 -7.013) 11.919 14.687 ( -11.372 0.476 -7.659) 13.719 15.641 ( 4.759 -7.371 0.576) 8.793 16.013 ( 5.663 -5.064 -12.206) 14.377 16.439 ( 11.013 2.307 -2.372) 11.499 16.826 ( 20.917 -9.293 -9.196) 24.667 19.201 ( 2.287 11.854 -0.137) 12.073 19.581 ( -6.248 -1.487 5.367) 8.369 24.907 ( -8.390 3.453 6.485) 11.152 25.399 ( -5.874 -14.514 1.718) 15.751 25.860 ( 11.365 6.412 -11.179) 17.183 26.133 ( 0.052 -7.715 -8.664) 11.601 26.710 ( -15.042 7.694 -8.391) 18.864 26.811 ( -4.712 -0.490 -1.463) 4.958 27.086 ( 21.939 16.147 11.677) 29.638 27.498 ( -1.154 -0.343 -2.815) 3.062 27.586 ( -4.813 3.051 -2.658) 6.288 27.790 ( -1.868 -0.564 8.003) 8.238 28.110 ( 7.784 2.230 19.326) 20.953 29.048 ( 7.705 -22.814 2.999) 24.266 32.548 ( 2.707 17.575 -0.839) 17.802 33.467 ( 1.637 -10.204 -14.151) 17.523 ======================= Grid point 132 (74/150) ======================= q-point: ( 0.00 0.40 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.787 ( 1.143 20.697 12.700) 24.310 2.103 ( 10.415 -11.599 -1.717) 15.683 2.492 ( 11.462 12.378 33.593) 37.592 2.691 ( 19.956 -9.196 24.954) 33.249 3.084 ( 19.655 12.670 12.272) 26.409 3.360 ( 8.556 -15.833 4.936) 18.661 3.708 ( 2.321 12.280 7.781) 14.722 3.791 ( 7.870 3.145 19.323) 21.099 4.313 ( -6.689 9.090 18.071) 21.305 4.415 ( 2.796 1.982 1.147) 3.614 4.711 ( -5.302 -2.481 3.901) 7.034 4.823 ( -4.444 -10.993 3.720) 12.427 5.351 ( 9.853 5.037 -0.444) 11.075 5.526 ( -3.118 -6.617 3.282) 8.017 5.616 ( -3.386 -0.237 -0.188) 3.400 5.715 ( -0.010 -15.362 1.812) 15.468 6.232 ( 2.922 4.689 5.241) 7.615 6.307 ( 3.483 -2.273 4.358) 6.024 6.605 ( 0.614 7.133 2.315) 7.524 6.722 ( 3.358 -5.246 5.676) 8.427 6.885 ( 7.330 6.476 7.755) 12.482 7.075 ( -1.594 -11.231 8.020) 13.893 7.476 ( 3.999 6.423 -7.743) 10.826 7.643 ( 3.024 -9.310 -10.709) 14.509 8.373 ( -2.116 9.690 -2.592) 10.251 8.487 ( -3.059 -2.400 2.797) 4.789 9.380 ( 2.147 7.019 0.258) 7.344 9.527 ( 3.706 -7.034 -0.165) 7.952 10.165 ( 1.492 10.517 5.399) 11.915 10.344 ( 2.758 -7.188 -0.179) 7.701 10.597 ( 6.889 2.508 1.846) 7.560 10.700 ( 7.363 -7.392 -0.368) 10.439 11.224 ( 0.004 8.540 3.928) 9.400 11.413 ( 0.030 -11.373 2.910) 11.739 11.881 ( 0.033 4.152 -8.593) 9.543 11.999 ( -1.146 -8.054 -8.506) 11.770 12.497 ( -10.676 1.350 11.275) 15.586 12.507 ( -9.318 0.627 9.842) 13.568 13.241 ( -6.121 11.178 -0.746) 12.766 13.350 ( -0.526 -2.430 -1.202) 2.762 13.494 ( 1.039 4.044 -3.443) 5.412 13.583 ( -2.376 -4.109 -4.580) 6.596 14.005 ( -7.701 7.651 -10.325) 14.982 14.165 ( -2.865 -8.094 -11.439) 14.302 14.485 ( -7.520 7.015 -5.464) 11.646 14.616 ( -3.225 -4.893 -1.836) 6.141 15.780 ( 9.258 9.677 -15.520) 20.499 15.978 ( 7.589 -9.237 -14.679) 18.931 16.672 ( 4.213 6.630 -5.520) 9.601 16.831 ( 4.300 -10.532 -8.818) 14.393 19.348 ( -5.714 4.911 3.589) 8.345 19.397 ( -9.198 -0.797 5.893) 10.953 24.854 ( -7.844 5.181 6.797) 11.600 24.970 ( -11.568 -7.380 6.944) 15.379 26.074 ( 2.386 4.719 -12.800) 13.849 26.131 ( 3.858 -1.695 -13.485) 14.128 26.641 ( -1.243 0.986 -0.409) 1.638 26.658 ( -4.583 -0.766 -0.629) 4.689 27.399 ( -5.600 0.642 -4.283) 7.080 27.409 ( -7.011 -0.421 -4.571) 8.379 27.762 ( 1.585 2.733 10.021) 10.507 27.803 ( 9.315 -1.063 11.012) 14.462 28.500 ( 17.489 15.172 14.623) 27.385 28.872 ( 20.249 -24.783 13.372) 34.685 32.932 ( 0.207 16.543 -9.140) 18.901 33.188 ( -4.480 -11.320 -10.411) 16.019 ======================= Grid point 133 (75/150) ======================= q-point: ( 0.09 0.40 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.942 ( 11.160 26.418 3.669) 28.913 2.363 ( 16.917 -17.229 -10.493) 26.327 2.628 ( -0.700 29.332 23.986) 37.897 3.043 ( 9.696 -16.514 21.432) 28.741 3.425 ( 9.890 3.999 12.671) 16.564 3.544 ( 9.415 -6.301 9.233) 14.615 3.775 ( 2.420 11.909 0.349) 12.157 3.954 ( 2.960 -4.324 11.577) 12.707 4.201 ( -4.770 18.026 25.587) 31.661 4.476 ( 3.871 7.754 -1.600) 8.813 4.639 ( -4.080 -12.977 17.377) 22.068 4.820 ( 4.892 -23.340 2.953) 24.030 5.378 ( -4.534 1.277 -2.628) 5.394 5.410 ( -7.378 -1.344 -0.505) 7.517 5.693 ( 9.255 3.106 -0.386) 9.770 5.850 ( 8.538 -13.160 8.120) 17.664 6.281 ( 1.780 4.140 3.163) 5.506 6.349 ( 2.028 -2.176 2.200) 3.699 6.716 ( 8.420 8.980 3.556) 12.814 6.888 ( 8.410 -9.194 0.742) 12.482 7.013 ( 4.377 4.607 9.410) 11.355 7.121 ( 7.252 -7.223 8.925) 13.580 7.592 ( 8.557 5.574 -5.814) 11.751 7.716 ( 5.761 -5.739 -8.032) 11.430 8.309 ( -3.325 6.259 -2.329) 7.460 8.396 ( -6.763 -2.598 3.792) 8.178 9.390 ( -1.480 7.194 0.904) 7.400 9.539 ( -2.626 -7.161 0.342) 7.635 10.158 ( -4.258 10.505 4.828) 12.321 10.337 ( -5.741 -7.882 -0.808) 9.784 10.701 ( 5.762 3.264 -1.004) 6.698 10.755 ( -0.375 -2.022 -3.206) 3.809 11.147 ( -8.447 8.007 0.485) 11.649 11.332 ( -8.821 -11.663 1.262) 14.677 11.894 ( 2.433 0.994 -4.699) 5.385 11.968 ( -0.635 -6.404 -6.196) 8.933 12.296 ( -10.808 1.879 9.190) 14.311 12.325 ( -9.987 -1.050 8.212) 12.972 13.126 ( -3.063 12.197 -4.339) 13.303 13.271 ( -2.552 -4.727 -2.789) 6.053 13.567 ( 2.409 6.835 -2.758) 7.754 13.686 ( 8.013 -4.737 -2.838) 9.732 13.899 ( 0.036 8.756 -10.951) 14.021 14.075 ( -3.491 -9.759 -11.941) 15.812 14.386 ( -0.046 7.924 -4.259) 8.996 14.549 ( -2.590 -8.331 -3.276) 9.319 15.882 ( 4.027 11.867 -12.174) 17.471 16.038 ( 1.368 -3.429 -10.039) 10.696 16.658 ( -4.278 3.976 -5.250) 7.853 16.777 ( -7.739 -7.839 -5.613) 12.363 19.227 ( -5.729 3.123 6.629) 9.302 19.273 ( -5.035 -1.460 6.699) 8.507 24.742 ( -4.677 2.562 5.009) 7.317 24.793 ( -7.335 -2.845 4.933) 9.286 26.075 ( 1.238 2.865 -6.304) 7.034 26.121 ( -1.193 -1.870 -8.989) 9.258 26.649 ( 2.329 2.585 1.818) 3.925 26.692 ( 4.292 -1.999 1.101) 4.861 27.229 ( -9.318 0.548 -2.075) 9.562 27.244 ( -8.870 -1.063 -2.838) 9.373 27.753 ( -3.525 8.951 5.534) 11.098 27.942 ( 1.281 -11.274 7.598) 13.656 28.927 ( 22.289 18.549 8.622) 30.252 29.343 ( 23.912 -26.761 5.309) 36.278 32.868 ( -4.822 12.407 -8.805) 15.959 33.033 ( -8.741 -5.860 -8.233) 13.361 ======================= Grid point 134 (76/150) ======================= q-point: ( 0.18 0.40 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.157 ( 9.074 29.321 5.985) 31.271 2.649 ( 12.249 -10.075 -5.861) 16.908 2.712 ( 8.220 15.514 9.025) 19.741 3.174 ( 1.263 -22.498 14.820) 26.971 3.462 ( -6.955 7.476 13.222) 16.706 3.566 ( -8.824 -2.303 11.931) 15.017 3.879 ( 7.203 -0.302 -4.154) 8.321 3.943 ( -1.118 -6.356 1.001) 6.530 4.308 ( 6.354 18.952 20.074) 28.329 4.563 ( 3.573 6.084 1.436) 7.200 4.658 ( 3.575 -3.071 15.287) 15.997 4.995 ( 11.610 -22.645 0.967) 25.467 5.275 ( -4.582 0.169 -4.336) 6.311 5.300 ( -2.690 -0.838 -3.728) 4.673 5.841 ( 4.864 5.277 2.916) 7.747 5.988 ( 3.049 -8.318 9.566) 13.038 6.327 ( 2.835 4.525 -2.391) 5.851 6.421 ( 4.750 -5.606 -0.673) 7.379 6.841 ( 2.727 5.764 0.163) 6.379 6.962 ( 1.194 -6.450 -2.382) 6.979 7.150 ( 8.085 9.892 9.011) 15.634 7.357 ( 10.974 -11.150 7.441) 17.324 7.756 ( 9.010 4.141 -4.670) 10.961 7.807 ( 4.679 0.175 -6.512) 8.021 8.239 ( -6.572 -0.148 -1.845) 6.828 8.261 ( -4.147 -1.928 -0.772) 4.638 9.321 ( -5.790 5.333 0.503) 7.888 9.435 ( -7.688 -5.674 -0.543) 9.570 9.998 ( -12.381 6.172 4.089) 14.426 10.097 ( -16.728 -3.477 -2.122) 17.217 10.734 ( 0.257 6.680 -1.603) 6.875 10.833 ( 2.053 -3.726 -1.258) 4.436 10.980 ( -2.612 6.717 0.226) 7.210 11.133 ( -9.853 -9.226 -0.438) 13.506 11.915 ( -3.217 -1.634 1.580) 3.938 11.931 ( -0.852 -3.216 6.403) 7.215 12.182 ( -1.241 0.170 -1.198) 1.733 12.207 ( -2.557 -2.127 -0.221) 3.333 13.079 ( -2.532 15.474 -8.073) 17.636 13.260 ( 0.438 -4.767 -2.452) 5.379 13.512 ( -4.003 7.662 -5.350) 10.166 13.692 ( -6.803 -10.115 -10.055) 15.802 13.971 ( 8.367 8.420 -4.705) 12.769 14.120 ( 9.422 -5.907 -4.639) 12.049 14.457 ( 6.631 1.730 -1.299) 6.975 14.531 ( 1.886 -5.707 -1.806) 6.276 15.884 ( -2.199 13.042 -3.675) 13.727 16.005 ( -2.559 0.554 -5.518) 6.107 16.519 ( -8.438 -1.238 -1.995) 8.758 16.559 ( -12.896 -4.696 -1.041) 13.764 19.178 ( -1.287 1.447 5.239) 5.585 19.220 ( -1.995 -2.647 5.871) 6.742 24.696 ( -0.907 0.658 1.841) 2.155 24.707 ( -2.521 -0.495 1.280) 2.870 26.080 ( -1.021 1.201 -3.185) 3.554 26.108 ( 1.849 -1.734 -1.032) 2.737 26.709 ( 3.087 4.446 2.716) 6.056 26.777 ( 4.013 -2.814 2.017) 5.300 27.065 ( -7.115 0.168 0.590) 7.142 27.077 ( -7.572 -1.194 -0.372) 7.674 27.652 ( -7.354 12.090 1.111) 14.195 27.901 ( -6.095 -14.334 4.274) 16.152 29.332 ( 17.738 19.180 1.039) 26.146 29.743 ( 16.524 -25.083 -3.507) 30.241 32.727 ( -7.616 9.459 -5.592) 13.369 32.847 ( -8.574 -3.869 -6.949) 11.695 ======================= Grid point 135 (77/150) ======================= q-point: ( 0.27 0.40 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.344 ( 10.283 21.560 6.531) 24.764 2.781 ( -2.574 -20.057 5.605) 20.984 2.891 ( 9.537 15.316 -1.683) 18.121 3.130 ( -9.727 -12.227 8.997) 18.029 3.368 ( 0.024 0.826 7.556) 7.601 3.453 ( -3.799 -6.097 14.216) 15.928 3.935 ( 2.846 1.217 -4.167) 5.191 3.984 ( 2.771 -3.092 -2.023) 4.618 4.411 ( 1.101 10.188 9.894) 14.244 4.552 ( -4.329 -3.160 7.521) 9.235 4.854 ( 11.311 14.773 2.730) 18.805 5.157 ( 2.677 -10.154 -2.517) 10.799 5.211 ( -0.587 2.198 -9.482) 9.751 5.345 ( 9.534 -11.256 -6.444) 16.097 5.886 ( -0.483 5.695 2.179) 6.117 5.996 ( -3.568 -4.399 4.345) 7.139 6.365 ( 1.682 5.680 -7.597) 9.633 6.492 ( 1.988 -7.628 -1.924) 8.114 6.855 ( 0.418 4.663 -3.149) 5.642 6.975 ( 1.466 -6.948 -3.208) 7.792 7.261 ( -1.549 10.945 6.164) 12.657 7.448 ( -4.757 -7.526 6.435) 10.986 7.871 ( 3.603 5.323 -4.680) 7.951 7.902 ( 6.586 3.603 -3.805) 8.416 8.079 ( -6.329 2.926 -3.604) 7.849 8.227 ( 0.447 -12.046 -10.791) 16.178 9.178 ( -8.560 4.357 0.006) 9.605 9.273 ( -7.844 -5.141 -0.240) 9.382 9.766 ( -11.152 2.006 4.887) 12.340 9.801 ( -11.502 -1.367 1.931) 11.743 10.699 ( -6.482 5.513 1.814) 8.701 10.752 ( -1.112 1.664 -2.296) 3.046 10.993 ( -4.065 0.708 -0.730) 4.190 11.093 ( 5.687 -7.403 -1.919) 9.531 11.859 ( -0.654 3.340 8.673) 9.316 11.957 ( 2.202 -6.713 8.109) 10.755 12.190 ( 2.025 0.783 -5.535) 5.945 12.221 ( 3.138 -2.635 -5.038) 6.494 12.945 ( -8.368 19.326 -9.941) 23.288 13.229 ( -3.911 -8.582 -1.994) 9.639 13.489 ( 1.872 1.571 -3.920) 4.620 13.543 ( -3.399 -4.646 -11.842) 13.168 14.133 ( 8.270 7.023 -0.307) 10.854 14.297 ( 8.289 -8.707 -2.447) 12.268 14.583 ( 6.047 1.530 0.967) 6.312 14.627 ( 7.109 -2.845 2.447) 8.039 15.798 ( -6.027 12.891 4.997) 15.082 15.934 ( -3.930 -0.366 -1.386) 4.183 16.303 ( -12.899 -0.978 0.995) 12.974 16.348 ( -9.073 -4.741 -1.866) 10.405 19.173 ( -0.621 0.826 4.054) 4.183 19.210 ( -0.331 -2.901 3.369) 4.458 24.687 ( 0.429 1.383 -2.288) 2.708 24.709 ( 1.990 -0.908 -1.891) 2.892 26.051 ( -1.765 3.481 0.960) 4.019 26.133 ( 0.067 -5.248 2.183) 5.684 26.779 ( 3.394 5.761 5.292) 8.528 26.860 ( 3.966 -2.987 4.361) 6.608 26.962 ( -3.786 -0.198 1.653) 4.136 26.970 ( -3.170 -0.915 1.738) 3.729 27.485 ( -9.420 12.853 -2.402) 16.115 27.747 ( -9.989 -14.701 1.421) 17.830 29.597 ( 10.056 17.953 -6.617) 21.615 29.959 ( 7.396 -20.460 -10.187) 24.023 32.577 ( -6.566 7.312 -2.554) 10.154 32.682 ( -6.925 -4.036 -5.572) 9.762 ======================= Grid point 136 (78/150) ======================= q-point: ( 0.36 0.40 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.578 ( 11.138 2.565 0.227) 11.432 2.613 ( -13.923 3.091 8.269) 16.486 2.938 ( -4.763 -3.769 3.469) 6.995 3.014 ( -0.859 -11.611 1.740) 11.772 3.439 ( 5.241 -0.079 6.928) 8.688 3.474 ( 1.125 -1.976 8.486) 8.785 4.011 ( 2.681 2.057 -4.972) 6.011 4.023 ( 4.938 0.241 -3.725) 6.190 4.406 ( -3.510 5.047 7.453) 9.661 4.457 ( -6.519 -0.600 6.282) 9.073 5.007 ( 3.673 10.351 -0.380) 10.990 5.166 ( 1.008 -6.868 -5.848) 9.077 5.222 ( 2.752 10.880 -14.290) 18.170 5.489 ( 4.274 -15.026 -14.299) 21.178 5.842 ( -3.802 4.590 -4.396) 7.406 5.896 ( -4.269 -2.116 -7.065) 8.522 6.348 ( -2.464 6.031 -5.216) 8.346 6.472 ( -3.481 -5.942 -1.406) 7.029 6.862 ( -0.185 7.159 -4.511) 8.464 7.000 ( -1.885 -1.427 2.815) 3.676 7.101 ( -8.787 -1.550 -9.214) 12.827 7.207 ( -18.023 -6.917 0.601) 19.315 7.920 ( 0.746 7.462 -0.172) 7.501 7.994 ( 5.562 10.859 -7.472) 14.307 8.026 ( -0.101 -1.181 -0.479) 1.279 8.243 ( 3.524 -13.287 -10.506) 17.301 9.021 ( -7.144 5.879 1.068) 9.314 9.153 ( -4.687 -7.987 -0.030) 9.261 9.620 ( -5.134 2.237 6.619) 8.670 9.674 ( -3.204 -3.452 6.375) 7.926 10.603 ( -2.867 8.535 -0.236) 9.007 10.739 ( -0.077 -5.550 -2.067) 5.923 10.935 ( -2.600 7.272 -1.595) 7.886 11.100 ( -3.977 -9.155 -2.924) 10.401 11.953 ( 7.642 5.918 6.609) 11.710 12.069 ( 7.653 -5.290 1.964) 9.508 12.240 ( 4.022 1.238 -0.520) 4.240 12.260 ( 1.444 -1.856 -1.681) 2.890 12.801 ( -2.947 14.758 -8.731) 17.399 13.111 ( -6.197 -16.100 -3.266) 17.558 13.502 ( 1.675 3.324 -5.884) 6.962 13.553 ( 3.204 -1.368 -6.028) 6.963 14.283 ( 7.035 6.219 3.118) 9.894 14.425 ( 5.703 -7.655 -0.214) 9.548 14.694 ( 4.441 2.866 3.443) 6.308 14.759 ( 5.171 -3.591 4.543) 7.763 15.696 ( -5.755 11.052 9.191) 15.484 15.849 ( -5.207 -4.009 3.828) 7.605 16.075 ( -10.311 3.645 -1.633) 11.057 16.168 ( -8.837 -5.172 -2.567) 10.556 19.165 ( -0.899 1.661 3.263) 3.770 19.214 ( 0.200 -3.377 1.539) 3.716 24.710 ( 2.747 3.025 -5.062) 6.505 24.762 ( 4.220 -2.412 -5.463) 7.312 26.014 ( -2.689 3.989 4.341) 6.480 26.112 ( -2.891 -6.698 4.988) 8.837 26.845 ( 0.958 6.019 10.135) 11.827 26.915 ( 0.030 -1.915 5.677) 5.991 26.956 ( 2.315 -0.000 2.689) 3.548 26.971 ( 3.225 -1.119 0.745) 3.494 27.305 ( -7.251 11.771 -4.222) 14.456 27.549 ( -9.531 -13.728 -0.083) 16.712 29.688 ( 1.402 16.221 -13.844) 21.371 29.995 ( -0.705 -16.142 -15.839) 22.626 32.474 ( -3.576 5.583 -0.830) 6.682 32.569 ( -3.526 -4.421 -3.692) 6.754 ======================= Grid point 137 (79/150) ======================= q-point: ( 0.45 0.40 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.338 ( -14.935 11.110 6.282) 19.646 2.586 ( -11.506 -14.826 8.135) 20.454 3.013 ( 3.326 -6.172 -7.432) 10.217 3.020 ( 12.268 -6.564 -10.577) 17.477 3.471 ( -3.289 6.206 8.106) 10.726 3.555 ( 3.579 -2.043 4.829) 6.348 4.013 ( -1.815 5.434 -1.688) 5.972 4.099 ( 0.158 -2.634 -4.161) 4.927 4.304 ( -8.346 3.522 3.154) 9.592 4.340 ( -5.157 -1.395 2.725) 5.997 5.001 ( -5.292 9.225 3.982) 11.356 5.149 ( -6.336 -4.793 0.546) 7.963 5.221 ( 3.870 10.372 -23.981) 26.413 5.424 ( -2.622 -8.007 -25.110) 26.486 5.748 ( -3.226 7.080 -13.703) 15.757 5.881 ( 4.035 -9.377 -10.939) 14.963 6.230 ( -9.210 7.540 1.551) 12.003 6.383 ( -4.746 -6.800 -0.589) 8.313 6.678 ( -12.850 3.369 -8.213) 15.619 6.789 ( -18.674 -7.259 -6.484) 21.058 6.994 ( 4.519 6.502 -3.803) 8.784 7.126 ( 2.198 -6.039 -3.275) 7.213 7.935 ( 1.766 5.074 3.137) 6.222 8.027 ( 0.283 -3.701 2.828) 4.667 8.080 ( 3.934 11.278 -8.061) 14.410 8.286 ( 1.754 -8.873 -7.666) 11.856 8.927 ( -2.481 7.021 1.712) 7.640 9.087 ( -1.975 -9.876 -0.432) 10.081 9.582 ( -0.542 4.091 7.624) 8.669 9.672 ( 0.811 -5.448 8.153) 9.839 10.582 ( 0.443 10.933 -2.429) 11.208 10.738 ( 0.365 -6.174 -4.083) 7.411 10.871 ( -3.491 4.815 -3.775) 7.045 10.984 ( -5.899 -6.409 -4.825) 9.957 12.131 ( 5.341 8.458 -0.014) 10.003 12.143 ( 2.387 12.209 4.407) 13.198 12.304 ( 3.152 -4.988 -0.783) 5.952 12.391 ( 11.383 -12.320 5.610) 17.687 12.806 ( 4.207 6.228 -7.033) 10.293 13.030 ( -0.504 -15.941 -3.893) 16.417 13.536 ( 2.903 4.335 -5.127) 7.315 13.593 ( 2.057 -1.456 -4.991) 5.591 14.418 ( 5.850 6.061 6.530) 10.658 14.526 ( 4.484 -4.047 3.282) 6.875 14.751 ( 0.435 2.642 4.598) 5.321 14.835 ( 1.587 -5.190 6.382) 8.378 15.612 ( -5.332 8.045 10.118) 13.983 15.733 ( -8.386 -4.616 6.570) 11.610 15.919 ( -4.510 5.981 -5.330) 9.193 16.021 ( -4.845 -4.704 -3.452) 7.584 19.156 ( -0.484 3.253 2.536) 4.153 19.226 ( 1.003 -4.067 0.991) 4.304 24.775 ( 5.198 4.163 -6.760) 9.490 24.849 ( 6.205 -3.616 -8.365) 11.025 25.967 ( -3.379 2.836 7.256) 8.492 26.045 ( -5.469 -5.723 8.190) 11.391 26.837 ( -4.511 7.544 7.314) 11.435 26.933 ( -0.912 -3.114 4.185) 5.295 26.991 ( 1.636 0.940 -0.137) 1.892 27.015 ( 0.926 -1.332 3.122) 3.519 27.269 ( 4.585 7.637 0.936) 8.957 27.442 ( -0.246 -10.297 2.619) 10.628 29.596 ( -7.247 15.337 -19.835) 26.099 29.876 ( -7.599 -13.988 -20.615) 26.046 32.438 ( -0.116 5.343 -0.156) 5.346 32.540 ( 1.236 -5.370 -2.367) 5.997 ======================= Grid point 138 (80/150) ======================= q-point: (-0.45 0.40 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.085 ( -12.249 7.609 3.374) 14.809 2.312 ( -15.642 -16.466 6.709) 23.681 3.100 ( 6.383 2.006 -16.807) 18.090 3.176 ( 1.972 -2.239 -10.386) 10.806 3.379 ( -7.652 7.199 0.620) 10.524 3.537 ( -5.953 -4.377 1.528) 7.545 3.853 ( -15.494 6.961 -3.242) 17.292 4.017 ( -13.706 -7.331 0.971) 15.573 4.075 ( -4.797 8.037 1.294) 9.449 4.290 ( -4.857 -15.563 -3.006) 16.578 4.851 ( -6.501 9.882 -1.037) 11.874 4.961 ( -9.978 -1.930 -5.162) 11.399 5.268 ( 6.016 12.321 -18.997) 23.428 5.436 ( 6.389 -5.904 -12.245) 15.021 5.682 ( 0.218 15.928 -11.827) 19.840 5.941 ( 1.563 -8.991 -6.960) 11.477 6.093 ( -0.941 5.283 -3.454) 6.381 6.296 ( -4.201 -11.682 -0.230) 12.416 6.463 ( -7.696 -2.487 -11.241) 13.848 6.482 ( -11.168 -6.194 -8.851) 15.539 7.074 ( 2.430 4.698 1.538) 5.509 7.128 ( -1.724 -0.829 3.246) 3.768 7.983 ( 1.034 5.972 1.068) 6.154 8.067 ( 3.237 -0.925 2.537) 4.216 8.122 ( 3.792 3.340 -9.338) 10.618 8.260 ( -2.891 -6.514 -7.026) 10.007 8.936 ( 2.869 6.011 1.811) 6.902 9.080 ( 1.223 -9.082 0.089) 9.165 9.624 ( 2.947 5.121 7.945) 9.901 9.725 ( 2.791 -5.686 8.583) 10.667 10.591 ( 0.669 10.180 -4.275) 11.061 10.721 ( -1.331 -5.170 -8.358) 9.917 10.788 ( -3.677 5.055 -5.295) 8.193 10.893 ( -1.780 -4.930 -4.708) 7.045 12.076 ( -4.072 13.731 5.383) 15.300 12.308 ( 1.991 -1.260 1.518) 2.803 12.348 ( 6.058 3.511 3.623) 7.883 12.632 ( 11.215 -16.485 1.948) 20.033 12.903 ( 6.883 3.864 -5.827) 9.811 13.079 ( 5.409 -13.452 -4.383) 15.147 13.598 ( 4.819 2.812 -5.285) 7.685 13.623 ( 2.969 0.483 -6.376) 7.050 14.522 ( 2.584 6.564 8.645) 11.158 14.610 ( 3.005 -0.198 6.978) 7.600 14.732 ( -3.188 2.130 5.255) 6.505 14.854 ( -0.766 -7.960 9.221) 12.205 15.516 ( -6.210 3.924 6.746) 9.974 15.575 ( -7.938 -2.006 3.009) 8.723 15.881 ( 1.489 6.642 -3.723) 7.759 15.985 ( 1.577 -4.383 -3.450) 5.796 19.163 ( 0.867 5.382 2.118) 5.848 19.262 ( 2.582 -4.980 1.307) 5.760 24.883 ( 7.483 4.543 -7.285) 11.389 24.966 ( 7.792 -4.088 -10.186) 13.460 25.912 ( -4.161 0.100 9.118) 10.023 25.932 ( -8.081 -2.149 10.435) 13.372 26.732 ( -5.308 5.760 1.521) 7.980 26.827 ( -7.871 -4.372 -0.820) 9.042 27.077 ( 6.453 1.151 4.617) 8.017 27.101 ( 6.489 -1.322 5.269) 8.463 27.415 ( 8.273 5.746 5.321) 11.392 27.531 ( 6.686 -6.426 6.688) 11.434 29.336 ( -14.778 16.130 -23.756) 32.294 29.630 ( -12.899 -14.595 -24.166) 31.039 32.467 ( 3.056 7.092 -0.306) 7.728 32.605 ( 5.823 -7.402 -2.233) 9.679 ======================= Grid point 139 (81/150) ======================= q-point: (-0.36 0.40 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.871 ( -9.752 6.966 1.986) 12.148 2.110 ( -4.972 -16.652 1.131) 17.415 2.914 ( -23.173 8.081 -6.006) 25.265 3.015 ( -18.918 -4.139 -10.677) 22.114 3.260 ( 0.243 17.163 -4.437) 17.729 3.345 ( -30.469 7.931 0.304) 31.486 3.478 ( -3.199 -10.095 -12.753) 16.576 3.746 ( -13.529 -22.101 3.813) 26.192 4.076 ( 2.094 3.618 4.509) 6.149 4.176 ( -3.089 -7.247 2.980) 8.422 4.789 ( -0.500 4.009 -11.899) 12.567 4.806 ( -3.192 2.351 -13.170) 13.754 5.385 ( 6.681 15.151 -2.330) 16.721 5.571 ( 9.300 -4.552 -2.656) 10.690 5.717 ( 4.009 23.807 -5.383) 24.735 5.953 ( 3.626 2.284 -4.004) 5.865 6.140 ( 1.257 -0.863 1.674) 2.264 6.216 ( -3.611 -7.389 -6.518) 10.494 6.289 ( -6.304 -5.973 -9.208) 12.657 6.367 ( 0.899 -14.760 -9.741) 17.707 7.057 ( -3.097 0.604 4.918) 5.843 7.103 ( -3.330 -3.227 7.235) 8.593 7.982 ( -0.112 9.833 -4.883) 10.980 8.100 ( -0.194 6.480 -3.893) 7.562 8.156 ( -3.650 -7.049 -6.036) 9.972 8.232 ( 6.031 -7.730 -6.915) 11.997 9.028 ( 5.788 4.015 1.147) 7.137 9.130 ( 3.772 -6.723 0.216) 7.712 9.715 ( 4.501 5.025 8.707) 11.015 9.809 ( 3.824 -4.970 9.373) 11.277 10.565 ( -2.572 5.247 -7.935) 9.854 10.644 ( -4.231 -3.566 -12.060) 13.268 10.754 ( 1.988 9.815 -1.658) 10.151 10.907 ( 3.711 -6.056 -1.642) 7.289 12.016 ( -3.112 12.000 4.400) 13.155 12.260 ( -4.466 -11.967 4.517) 13.548 12.512 ( 7.570 13.066 0.485) 15.109 12.788 ( 4.033 -11.907 3.569) 13.068 13.034 ( 7.222 0.110 -5.606) 9.143 13.170 ( 3.839 -11.420 -2.884) 12.388 13.669 ( 4.538 5.962 -6.625) 10.001 13.745 ( 10.609 -2.095 -9.430) 14.348 14.526 ( -3.674 6.479 6.922) 10.168 14.640 ( -4.203 -5.574 5.358) 8.800 14.675 ( -1.330 9.749 8.743) 13.163 14.865 ( -0.304 -10.101 12.506) 16.079 15.420 ( -4.236 1.747 1.547) 4.836 15.469 ( -2.652 -2.820 -0.565) 3.912 15.956 ( 6.445 7.185 -1.192) 9.725 16.053 ( 6.082 -3.269 -3.621) 7.797 19.202 ( 2.798 7.835 1.960) 8.547 19.333 ( 4.326 -5.919 2.203) 7.655 25.028 ( 8.716 3.960 -6.446) 11.541 25.101 ( 7.861 -3.575 -10.233) 13.390 25.777 ( -9.110 3.289 9.775) 13.761 25.853 ( -4.020 -4.657 8.994) 10.897 26.678 ( -0.648 0.850 2.536) 2.752 26.699 ( -4.075 -1.251 -0.062) 4.263 27.237 ( 8.413 0.984 6.212) 10.505 27.260 ( 8.379 -1.358 5.259) 9.985 27.578 ( 6.900 5.511 6.721) 11.098 27.679 ( 6.299 -5.079 8.356) 11.632 28.945 ( -20.168 18.831 -25.027) 37.252 29.293 ( -16.312 -17.753 -25.598) 35.164 32.549 ( 5.517 10.358 -1.046) 11.782 32.746 ( 9.143 -10.316 -3.216) 14.154 ======================= Grid point 140 (82/150) ======================= q-point: (-0.27 0.40 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.797 ( 3.140 12.946 1.750) 13.436 2.040 ( -7.979 -8.906 6.189) 13.464 2.425 ( -21.472 9.942 0.287) 23.664 2.610 ( -15.648 -11.187 -10.780) 22.050 2.790 ( -26.276 5.092 11.761) 29.235 3.021 ( -22.721 -9.287 14.405) 28.460 3.447 ( 3.775 -0.071 -8.149) 8.981 3.639 ( 0.479 -13.729 -4.981) 14.612 4.156 ( 4.700 1.527 4.281) 6.538 4.185 ( 2.143 -1.399 4.368) 5.062 4.755 ( 1.337 4.822 -13.026) 13.954 4.795 ( 3.279 0.524 -16.034) 16.374 5.428 ( -3.785 23.868 6.190) 24.946 5.722 ( 2.893 -4.017 3.442) 6.029 5.785 ( 3.503 18.589 -0.160) 18.917 6.037 ( -1.880 -3.458 5.930) 7.118 6.108 ( 2.345 8.998 -12.423) 15.517 6.143 ( -1.794 -3.105 -5.324) 6.419 6.231 ( 3.169 -2.661 0.181) 4.142 6.482 ( 10.719 -20.277 -5.157) 23.508 7.001 ( -6.896 -4.027 7.566) 11.001 7.031 ( -1.129 -5.463 0.833) 5.640 7.949 ( -3.101 1.037 -7.475) 8.158 7.977 ( -8.267 -0.965 -11.567) 14.250 8.168 ( 3.588 5.997 0.084) 6.989 8.309 ( 3.481 -7.979 -7.050) 11.202 9.146 ( 6.080 3.081 -0.605) 6.843 9.216 ( 4.976 -4.097 -1.480) 6.613 9.831 ( 5.636 4.426 10.348) 12.588 9.913 ( 5.146 -4.351 11.584) 13.401 10.480 ( -3.711 2.864 -9.005) 10.152 10.532 ( -4.178 -2.501 -10.353) 11.442 10.850 ( 7.142 10.402 1.968) 12.770 11.018 ( 7.591 -7.445 0.542) 10.647 11.974 ( -1.856 9.215 0.899) 9.443 12.180 ( -4.301 -11.332 2.614) 12.400 12.622 ( 3.612 11.894 0.407) 12.437 12.816 ( -1.475 -5.943 4.693) 7.714 13.138 ( 4.433 -2.725 -3.505) 6.274 13.208 ( 0.930 -8.330 -1.214) 8.469 13.742 ( 3.296 12.828 -6.318) 14.674 13.937 ( 9.458 -7.287 -10.121) 15.652 14.440 ( -5.555 4.933 2.431) 7.817 14.530 ( -6.260 -4.273 1.428) 7.713 14.664 ( -2.676 11.321 8.785) 14.578 14.873 ( -2.016 -10.391 10.847) 15.156 15.376 ( 0.489 1.744 -3.224) 3.698 15.476 ( 3.688 -8.259 -4.025) 9.900 16.114 ( 9.808 7.203 0.257) 12.172 16.204 ( 10.098 -2.174 -2.981) 10.751 19.277 ( 4.362 10.019 1.787) 11.072 19.432 ( 5.012 -6.439 3.313) 8.806 25.177 ( 6.911 1.181 -3.392) 7.788 25.195 ( 2.201 -0.733 -5.145) 5.644 25.666 ( -2.086 6.505 4.087) 7.961 25.812 ( -0.839 -9.122 5.125) 10.497 26.673 ( 1.921 3.227 3.372) 5.047 26.730 ( 3.966 -2.851 5.465) 7.329 27.398 ( 6.213 0.667 4.203) 7.531 27.422 ( 6.619 -1.800 2.630) 7.346 27.697 ( 3.763 5.300 7.506) 9.929 27.786 ( 2.545 -4.116 7.903) 9.266 28.488 ( -20.983 22.947 -20.738) 37.376 28.919 ( -16.612 -22.544 -22.087) 35.666 32.668 ( 6.925 14.296 -2.329) 16.055 32.932 ( 10.570 -13.507 -5.132) 17.903 ======================= Grid point 141 (83/150) ======================= q-point: (-0.18 0.40 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.862 ( -6.234 6.725 29.108) 30.518 1.933 ( 3.396 0.374 19.055) 19.359 2.221 ( 3.916 16.314 -3.715) 17.184 2.315 ( -25.553 3.140 19.499) 32.296 2.408 ( -7.685 -5.530 9.769) 13.604 2.871 ( 8.296 -29.880 4.115) 31.282 3.524 ( 4.411 4.529 1.905) 6.603 3.663 ( 1.625 -6.789 1.648) 7.172 4.248 ( 3.604 0.620 4.008) 5.426 4.263 ( 4.623 -0.739 5.242) 7.029 4.787 ( 4.319 6.474 -12.450) 14.683 4.856 ( 5.658 -1.183 -13.784) 14.947 5.274 ( -12.180 29.695 11.364) 34.048 5.681 ( -6.575 -9.933 8.534) 14.653 5.822 ( -1.710 8.584 0.974) 8.807 5.939 ( -4.362 0.934 -1.671) 4.764 6.110 ( -0.397 -2.013 0.890) 2.236 6.140 ( 1.152 -5.360 -2.664) 6.095 6.430 ( 13.662 12.933 -1.265) 18.855 6.675 ( 6.821 -13.367 4.923) 15.794 6.857 ( -8.438 -0.422 6.356) 10.572 7.049 ( 3.126 -14.563 -8.481) 17.140 7.757 ( -12.187 -1.376 -11.452) 16.780 7.812 ( -8.083 -6.075 -9.070) 13.584 8.266 ( 5.888 9.013 0.628) 10.784 8.385 ( 6.038 -3.313 -2.681) 7.391 9.249 ( 4.704 2.892 -2.092) 5.904 9.309 ( 5.251 -3.047 -3.265) 6.893 9.969 ( 6.151 5.271 9.917) 12.805 10.073 ( 9.062 -6.177 13.299) 17.237 10.402 ( -2.046 3.287 -6.302) 7.397 10.474 ( 0.323 -4.186 -4.876) 6.435 11.010 ( 8.204 9.545 3.434) 13.046 11.184 ( 8.784 -8.703 1.807) 12.497 11.944 ( -1.173 6.749 -3.373) 7.636 12.108 ( -3.339 -10.108 -0.914) 10.684 12.653 ( -0.537 8.700 2.539) 9.079 12.764 ( -4.867 -2.729 6.778) 8.779 13.197 ( 2.285 -1.516 -1.836) 3.300 13.227 ( 2.417 -5.007 -2.027) 5.918 13.733 ( -3.597 16.263 -3.634) 17.048 13.995 ( -3.394 -11.125 -4.565) 12.495 14.329 ( -5.646 6.826 -3.624) 9.570 14.416 ( -6.148 -2.210 -3.660) 7.488 14.627 ( -1.563 10.610 2.862) 11.100 14.813 ( -5.815 -7.945 5.166) 11.118 15.443 ( 7.251 1.791 -6.361) 9.811 15.599 ( 10.734 -13.655 -11.837) 21.019 16.323 ( 11.350 7.027 0.344) 13.353 16.422 ( 12.789 -3.311 -2.524) 13.450 19.364 ( 3.800 10.843 1.321) 11.565 19.522 ( 2.889 -6.175 3.928) 7.868 25.142 ( -6.499 4.859 3.717) 8.925 25.244 ( -0.652 -5.994 2.578) 6.558 25.746 ( 9.682 5.591 -5.544) 12.480 25.873 ( 6.950 -8.507 -2.934) 11.370 26.771 ( 5.986 3.574 6.006) 9.202 26.823 ( 3.153 -2.305 4.564) 6.007 27.432 ( -5.095 4.056 -5.654) 8.624 27.483 ( 0.458 -1.830 -2.006) 2.754 27.750 ( -0.959 3.718 6.567) 7.608 27.785 ( -2.487 0.604 1.203) 2.828 28.171 ( -6.064 19.879 1.985) 20.878 28.620 ( -9.246 -25.872 -8.093) 28.642 32.797 ( 6.815 17.728 -4.338) 19.482 33.114 ( 9.034 -15.935 -7.858) 19.932 ======================= Grid point 142 (84/150) ======================= q-point: (-0.09 0.40 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.887 ( -13.092 7.219 25.248) 29.342 1.966 ( 2.415 0.655 19.238) 19.400 2.132 ( 11.509 4.964 37.410) 39.454 2.317 ( 10.231 -10.919 15.627) 21.636 2.650 ( 22.552 20.015 4.388) 30.471 3.136 ( 14.267 -28.381 2.718) 31.881 3.624 ( 4.938 5.772 11.433) 13.726 3.688 ( -0.300 2.714 9.897) 10.267 4.320 ( 2.160 1.869 7.401) 7.933 4.354 ( 3.269 -0.678 5.551) 6.478 4.842 ( -0.352 7.976 -5.260) 9.561 4.864 ( -3.883 4.181 -3.848) 6.883 5.167 ( 4.386 14.399 2.762) 15.303 5.568 ( -5.735 -16.459 11.557) 20.913 5.724 ( -6.666 2.427 1.349) 7.222 5.830 ( -7.165 -8.465 -5.267) 12.277 6.155 ( 3.730 2.013 3.337) 5.394 6.194 ( 4.838 -0.634 6.013) 7.744 6.652 ( 2.470 14.636 -6.145) 16.065 6.705 ( 1.969 -3.256 11.476) 12.090 6.754 ( -2.895 0.274 6.916) 7.502 7.088 ( 1.052 -22.460 -3.628) 22.775 7.517 ( -7.675 5.888 -8.380) 12.799 7.668 ( -3.689 -9.259 -10.315) 14.343 8.368 ( 3.492 10.938 -0.825) 11.511 8.486 ( 3.124 -1.771 0.179) 3.596 9.323 ( 3.525 4.257 -1.450) 5.714 9.419 ( 6.689 -4.891 -2.115) 8.552 10.094 ( 4.562 8.760 7.171) 12.205 10.268 ( 6.319 -9.354 3.710) 11.882 10.427 ( 6.840 3.912 3.530) 8.634 10.538 ( 6.894 -6.932 -0.014) 9.777 11.156 ( 5.614 9.112 4.137) 11.475 11.340 ( 6.313 -10.066 2.556) 12.154 11.911 ( -1.047 5.251 -7.200) 8.972 12.047 ( -2.367 -8.979 -5.134) 10.611 12.615 ( -4.343 4.395 6.340) 8.853 12.658 ( -7.827 -0.649 9.606) 12.408 13.242 ( 3.162 3.459 -1.319) 4.868 13.295 ( 4.409 -3.362 -2.089) 5.925 13.599 ( -8.628 13.471 -3.233) 16.320 13.804 ( -13.718 -7.771 -1.640) 15.851 14.195 ( -8.267 4.717 -7.297) 11.994 14.266 ( -6.382 -1.816 -8.846) 11.058 14.607 ( -2.202 4.978 -2.712) 6.081 14.693 ( -6.007 -2.314 0.483) 6.456 15.606 ( 10.855 5.412 -12.029) 17.083 15.810 ( 12.659 -13.991 -16.747) 25.228 16.534 ( 10.074 6.825 -2.146) 12.356 16.668 ( 12.577 -7.626 -5.177) 15.592 19.404 ( -0.419 9.059 1.408) 9.177 19.528 ( -3.767 -4.498 3.887) 7.038 25.001 ( -8.530 6.805 6.805) 12.860 25.162 ( -8.441 -10.711 6.312) 15.027 25.954 ( 11.779 4.173 -11.417) 16.927 26.028 ( 8.887 -4.247 -10.161) 14.152 26.777 ( -8.819 1.622 -3.952) 9.800 26.798 ( -6.051 -0.871 -2.232) 6.508 27.371 ( 5.901 10.499 0.407) 12.051 27.476 ( -0.066 -2.461 -3.096) 3.955 27.679 ( -3.354 6.325 2.961) 7.747 27.765 ( -1.847 -2.567 8.087) 8.683 28.230 ( 7.632 12.553 15.305) 21.215 28.587 ( 5.955 -24.332 9.560) 26.812 32.900 ( 4.588 18.891 -7.001) 20.662 33.222 ( 3.360 -15.705 -10.386) 19.126 ======================= Grid point 165 (85/150) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.974 ( 10.671 0.000 12.865) 16.715 2.170 ( 1.368 0.000 -6.342) 6.488 2.417 ( -22.853 0.000 33.712) 40.728 2.949 ( -4.333 0.000 10.108) 10.998 3.505 ( 23.206 0.000 19.813) 30.513 3.756 ( 5.490 0.000 -4.808) 7.297 3.779 ( 7.194 0.000 25.163) 26.172 4.143 ( 1.667 0.000 18.792) 18.866 4.279 ( 0.192 0.000 3.721) 3.726 4.556 ( -4.951 0.000 8.616) 9.938 4.780 ( 9.559 0.000 -1.739) 9.716 4.928 ( 9.447 0.000 -3.902) 10.221 5.378 ( -3.410 0.000 -4.115) 5.344 5.389 ( 7.788 0.000 -5.590) 9.586 5.719 ( 0.611 0.000 1.187) 1.335 5.750 ( 6.531 0.000 -5.306) 8.415 6.354 ( 0.370 0.000 3.394) 3.415 6.419 ( 14.475 0.000 5.261) 15.402 6.532 ( 2.599 0.000 1.932) 3.238 6.966 ( 7.844 0.000 2.631) 8.273 7.112 ( -1.543 0.000 5.278) 5.499 7.580 ( -2.025 0.000 9.517) 9.730 7.647 ( 1.445 0.000 -2.258) 2.680 7.760 ( 3.272 0.000 0.784) 3.364 7.962 ( -3.627 0.000 15.482) 15.901 8.544 ( -3.443 0.000 9.862) 10.446 9.394 ( 1.578 0.000 -4.295) 4.575 9.476 ( 6.107 0.000 -3.690) 7.135 10.103 ( -0.962 0.000 7.458) 7.520 10.367 ( 9.106 0.000 -0.781) 9.140 10.618 ( -0.886 0.000 -8.128) 8.176 10.685 ( -11.875 0.000 -9.861) 15.436 11.145 ( 0.065 0.000 6.449) 6.449 11.587 ( 3.525 0.000 -5.807) 6.793 12.016 ( 5.262 0.000 -0.407) 5.277 12.040 ( 4.986 0.000 -4.254) 6.554 12.463 ( -4.559 0.000 -2.703) 5.300 12.625 ( -9.231 0.000 -2.130) 9.473 12.778 ( -14.714 0.000 17.214) 22.646 13.342 ( 9.035 0.000 -1.358) 9.137 13.490 ( -13.486 0.000 -2.588) 13.732 13.553 ( 5.602 0.000 -1.900) 5.916 13.615 ( -15.867 0.000 -12.143) 19.980 14.127 ( -4.816 0.000 -16.540) 17.227 14.261 ( 2.675 0.000 -0.552) 2.732 14.320 ( 4.747 0.000 -6.518) 8.063 15.780 ( -3.263 0.000 0.942) 3.396 15.837 ( -4.253 0.000 -5.514) 6.963 16.541 ( 6.124 0.000 -0.916) 6.193 16.907 ( 5.010 0.000 -12.984) 13.917 19.182 ( 3.427 0.000 4.952) 6.022 19.465 ( -9.141 0.000 0.695) 9.167 24.893 ( -5.105 0.000 7.335) 8.937 25.229 ( -16.199 0.000 -0.862) 16.222 25.803 ( 9.416 0.000 -2.565) 9.759 25.914 ( 0.706 0.000 -9.475) 9.501 26.634 ( 5.407 0.000 1.302) 5.561 26.671 ( -3.897 0.000 0.263) 3.906 27.313 ( -4.182 0.000 -3.674) 5.566 27.322 ( -5.802 0.000 -4.297) 7.220 27.866 ( -11.264 0.000 7.192) 13.365 27.930 ( 31.901 0.000 6.832) 32.625 28.619 ( 0.821 0.000 17.657) 17.676 29.517 ( 18.251 0.000 -10.856) 21.236 32.496 ( 0.178 0.000 7.825) 7.827 33.146 ( -6.882 0.000 -13.462) 15.119 ======================= Grid point 166 (86/150) ======================= q-point: ( 0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.034 ( -18.466 0.000 38.366) 42.579 2.099 ( -0.550 0.000 28.323) 28.328 2.313 ( 12.636 0.000 -15.522) 20.015 3.102 ( 18.210 0.000 -12.921) 22.328 3.746 ( -5.477 0.000 -0.663) 5.517 3.849 ( -0.232 0.000 12.367) 12.370 3.916 ( 13.645 0.000 13.114) 18.925 4.307 ( 1.642 0.000 2.051) 2.628 4.322 ( 9.378 0.000 22.707) 24.567 4.418 ( -10.761 0.000 8.231) 13.548 4.920 ( 5.410 0.000 -5.272) 7.553 5.063 ( 5.669 0.000 -5.871) 8.161 5.250 ( -7.005 0.000 -5.862) 9.134 5.436 ( -1.411 0.000 -0.778) 1.611 5.770 ( 3.662 0.000 1.221) 3.860 5.871 ( 5.708 0.000 -9.558) 11.132 6.383 ( 1.711 0.000 4.317) 4.644 6.563 ( 3.260 0.000 -3.607) 4.862 6.717 ( 11.911 0.000 9.249) 15.080 6.937 ( -4.641 0.000 1.300) 4.819 7.381 ( 18.282 0.000 -2.330) 18.430 7.522 ( -5.104 0.000 5.211) 7.294 7.595 ( -2.633 0.000 -9.905) 10.249 7.854 ( 1.692 0.000 9.500) 9.649 7.949 ( -0.213 0.000 13.899) 13.901 8.457 ( -7.243 0.000 8.493) 11.162 9.388 ( -1.290 0.000 -4.686) 4.860 9.486 ( -4.555 0.000 -5.500) 7.141 10.066 ( -4.748 0.000 5.559) 7.311 10.330 ( -19.790 0.000 -8.486) 21.533 10.483 ( -1.488 0.000 -3.821) 4.100 10.640 ( 10.538 0.000 -3.005) 10.958 11.086 ( -6.955 0.000 6.019) 9.198 11.559 ( -5.368 0.000 -6.406) 8.358 12.062 ( -0.300 0.000 -3.765) 3.776 12.136 ( 4.674 0.000 -6.231) 7.790 12.400 ( -1.062 0.000 7.240) 7.317 12.436 ( -9.037 0.000 -5.475) 10.566 12.532 ( -14.076 0.000 18.431) 23.191 13.298 ( -4.023 0.000 -2.535) 4.755 13.301 ( -12.486 0.000 -6.177) 13.930 13.589 ( 12.750 0.000 -2.009) 12.907 13.738 ( 11.555 0.000 1.016) 11.600 13.991 ( -1.891 0.000 -9.430) 9.618 14.416 ( 10.057 0.000 1.071) 10.114 14.432 ( 7.402 0.000 -7.900) 10.826 15.687 ( -5.880 0.000 3.969) 7.094 15.729 ( -5.138 0.000 -8.191) 9.669 16.605 ( 0.702 0.000 -1.671) 1.813 16.872 ( -5.597 0.000 -9.105) 10.688 19.256 ( 2.794 0.000 6.157) 6.762 19.330 ( -4.653 0.000 1.297) 4.831 24.819 ( -4.074 0.000 7.723) 8.732 24.942 ( -12.689 0.000 3.551) 13.177 25.937 ( 2.393 0.000 -9.434) 9.732 26.002 ( 11.382 0.000 0.190) 11.384 26.623 ( -1.680 0.000 0.845) 1.881 26.735 ( 4.758 0.000 -0.015) 4.758 27.205 ( -5.807 0.000 -2.086) 6.170 27.206 ( -5.491 0.000 0.063) 5.491 27.628 ( -13.605 0.000 1.534) 13.692 28.484 ( 23.664 0.000 -0.318) 23.666 28.614 ( -4.833 0.000 12.991) 13.861 29.824 ( 15.502 0.000 -20.307) 25.548 32.504 ( -1.109 0.000 8.705) 8.776 32.952 ( -9.830 0.000 -9.438) 13.627 ======================= Grid point 167 (87/150) ======================= q-point: ( 0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.881 ( -2.439 0.000 24.039) 24.162 2.174 ( 4.927 0.000 20.210) 20.802 2.639 ( 23.550 0.000 -15.375) 28.125 3.411 ( 7.157 0.000 -10.829) 12.981 3.611 ( -2.718 0.000 3.778) 4.654 3.839 ( -1.723 0.000 8.091) 8.273 4.124 ( 4.759 0.000 9.612) 10.725 4.187 ( -12.075 0.000 3.317) 12.522 4.342 ( 0.241 0.000 1.929) 1.944 4.502 ( 4.122 0.000 16.335) 16.847 4.980 ( 2.687 0.000 -6.268) 6.820 5.084 ( -6.009 0.000 3.610) 7.010 5.167 ( 4.267 0.000 -17.217) 17.737 5.353 ( -7.550 0.000 5.931) 9.601 5.838 ( 3.317 0.000 -5.195) 6.164 5.903 ( 0.186 0.000 -15.601) 15.602 6.395 ( -3.512 0.000 4.113) 5.409 6.603 ( 1.227 0.000 -2.918) 3.166 6.834 ( -5.937 0.000 -2.883) 6.600 6.922 ( 7.042 0.000 4.504) 8.359 7.415 ( -5.753 0.000 1.873) 6.050 7.542 ( -1.005 0.000 -7.069) 7.140 7.617 ( 5.779 0.000 -7.636) 9.576 7.817 ( -6.537 0.000 5.193) 8.348 8.059 ( 10.162 0.000 -0.454) 10.172 8.302 ( -10.138 0.000 5.148) 11.370 9.298 ( -12.230 0.000 -5.680) 13.484 9.322 ( -4.455 0.000 -6.453) 7.841 9.914 ( -9.444 0.000 0.989) 9.496 10.039 ( -9.368 0.000 5.657) 10.943 10.454 ( 1.625 0.000 -3.417) 3.783 10.852 ( 1.696 0.000 -0.389) 1.740 10.960 ( 0.854 0.000 2.284) 2.439 11.375 ( -11.365 0.000 -4.194) 12.114 12.039 ( 0.055 0.000 -3.454) 3.454 12.120 ( -4.885 0.000 -13.871) 14.706 12.305 ( -3.155 0.000 1.076) 3.334 12.317 ( -11.781 0.000 16.923) 20.620 12.457 ( 4.219 0.000 11.982) 12.703 13.125 ( -4.610 0.000 -1.058) 4.730 13.299 ( 3.508 0.000 -1.624) 3.865 13.675 ( -2.187 0.000 -5.300) 5.734 13.978 ( 12.301 0.000 3.435) 12.772 14.138 ( 15.772 0.000 -1.539) 15.847 14.540 ( 4.609 0.000 -5.011) 6.808 14.622 ( 10.301 0.000 4.651) 11.303 15.602 ( -3.435 0.000 5.401) 6.400 15.622 ( -3.428 0.000 -11.062) 11.581 16.562 ( -4.597 0.000 -1.925) 4.984 16.686 ( -11.602 0.000 -4.253) 12.357 19.281 ( -1.113 0.000 -0.427) 1.192 19.305 ( 0.737 0.000 6.843) 6.882 24.753 ( -7.921 0.000 2.801) 8.402 24.769 ( -2.613 0.000 6.105) 6.641 25.959 ( 1.626 0.000 -5.531) 5.765 26.239 ( 12.453 0.000 4.627) 13.285 26.591 ( -1.886 0.000 -0.871) 2.078 26.821 ( 4.539 0.000 -0.668) 4.588 27.099 ( -4.731 0.000 0.885) 4.813 27.112 ( -4.795 0.000 2.292) 5.315 27.372 ( -12.325 0.000 -2.253) 12.529 28.486 ( -10.544 0.000 9.528) 14.212 28.835 ( 13.654 0.000 -7.221) 15.446 29.998 ( 7.130 0.000 -25.666) 26.638 32.488 ( -2.211 0.000 8.230) 8.522 32.756 ( -8.319 0.000 -6.820) 10.758 ======================= Grid point 168 (88/150) ======================= q-point: ( 0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.052 ( 16.908 0.000 0.068) 16.908 2.386 ( 13.872 0.000 5.035) 14.757 3.124 ( 28.493 0.000 -12.360) 31.059 3.206 ( -19.427 0.000 12.323) 23.006 3.649 ( -4.067 0.000 0.093) 4.068 3.809 ( -3.509 0.000 8.049) 8.780 4.034 ( -4.346 0.000 -2.096) 4.825 4.143 ( -3.808 0.000 2.682) 4.658 4.356 ( 2.978 0.000 -1.892) 3.529 4.535 ( -3.537 0.000 12.905) 13.381 4.959 ( -5.986 0.000 -5.375) 8.046 4.996 ( -3.225 0.000 -2.120) 3.859 5.189 ( -7.093 0.000 1.378) 7.225 5.247 ( 5.944 0.000 -10.207) 11.812 5.828 ( -3.113 0.000 -22.260) 22.477 5.882 ( 3.179 0.000 -8.539) 9.111 6.168 ( -20.338 0.000 -2.508) 20.492 6.589 ( -2.475 0.000 -0.700) 2.572 6.739 ( -2.510 0.000 -8.168) 8.545 6.946 ( -6.213 0.000 -5.257) 8.139 7.317 ( -3.970 0.000 -3.792) 5.490 7.497 ( -3.832 0.000 -2.160) 4.399 7.671 ( 3.203 0.000 -3.121) 4.472 7.709 ( -3.045 0.000 1.832) 3.554 8.110 ( -8.770 0.000 3.100) 9.302 8.248 ( 8.818 0.000 -9.571) 13.014 9.056 ( -10.849 0.000 -2.746) 11.191 9.211 ( -4.598 0.000 -7.209) 8.551 9.834 ( -1.371 0.000 7.177) 7.307 9.901 ( -5.746 0.000 8.031) 9.875 10.528 ( 5.217 0.000 -5.585) 7.643 10.691 ( -9.941 0.000 6.951) 12.130 11.081 ( 2.937 0.000 -12.406) 12.749 11.143 ( -11.416 0.000 -1.636) 11.533 12.032 ( 2.048 0.000 -10.259) 10.461 12.065 ( 2.652 0.000 -3.455) 4.355 12.155 ( -7.479 0.000 15.335) 17.062 12.243 ( -5.203 0.000 5.495) 7.568 12.591 ( 6.951 0.000 11.654) 13.570 13.114 ( 2.902 0.000 2.344) 3.731 13.391 ( 5.566 0.000 -0.639) 5.603 13.589 ( -4.641 0.000 -5.469) 7.173 14.209 ( 10.295 0.000 5.851) 11.842 14.445 ( 14.621 0.000 0.258) 14.623 14.587 ( 1.062 0.000 -0.208) 1.082 14.818 ( 8.610 0.000 6.875) 11.018 15.565 ( 0.017 0.000 -12.675) 12.675 15.576 ( -0.746 0.000 5.799) 5.847 16.427 ( -8.740 0.000 -2.003) 8.966 16.427 ( -14.272 0.000 -1.367) 14.338 19.269 ( -0.033 0.000 -1.859) 1.859 19.307 ( -1.910 0.000 6.542) 6.816 24.639 ( -4.322 0.000 0.991) 4.434 24.744 ( -0.922 0.000 2.960) 3.100 25.982 ( 1.516 0.000 -1.152) 1.904 26.485 ( 10.723 0.000 9.500) 14.326 26.549 ( -1.854 0.000 -1.834) 2.608 26.916 ( 5.255 0.000 0.083) 5.256 27.013 ( -5.578 0.000 -2.709) 6.201 27.033 ( -2.426 0.000 3.094) 3.931 27.172 ( -7.352 0.000 0.878) 7.404 28.264 ( -13.531 0.000 8.081) 15.760 28.991 ( 4.907 0.000 -14.620) 15.421 30.002 ( -0.835 0.000 -26.965) 26.978 32.454 ( -2.785 0.000 6.716) 7.271 32.613 ( -5.084 0.000 -5.431) 7.439 ======================= Grid point 169 (89/150) ======================= q-point: ( 0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.476 ( 26.748 0.000 -14.632) 30.489 2.655 ( 3.668 0.000 -0.941) 3.787 2.847 ( -10.308 0.000 10.919) 15.016 3.522 ( -6.249 0.000 3.855) 7.342 3.607 ( 12.893 0.000 -5.308) 13.943 3.754 ( 5.247 0.000 3.696) 6.418 3.865 ( -13.428 0.000 -3.238) 13.812 3.996 ( -11.134 0.000 -4.795) 12.122 4.440 ( -7.766 0.000 10.357) 12.945 4.469 ( 7.180 0.000 0.686) 7.213 4.723 ( -21.373 0.000 0.384) 21.376 4.833 ( -5.577 0.000 -8.776) 10.398 5.205 ( 5.585 0.000 -7.248) 9.151 5.297 ( -0.753 0.000 -12.676) 12.698 5.675 ( -24.925 0.000 -8.332) 26.281 5.764 ( 3.542 0.000 -21.973) 22.256 5.964 ( 6.108 0.000 -8.068) 10.119 6.460 ( -13.339 0.000 0.558) 13.351 6.661 ( -4.380 0.000 -10.406) 11.290 6.727 ( -8.933 0.000 -15.095) 17.541 7.257 ( -1.183 0.000 -4.651) 4.799 7.345 ( -12.554 0.000 3.484) 13.028 7.709 ( 1.959 0.000 3.414) 3.936 7.754 ( 5.506 0.000 0.227) 5.510 8.059 ( 2.916 0.000 1.803) 3.428 8.345 ( 2.977 0.000 -6.764) 7.390 8.885 ( -6.388 0.000 -0.557) 6.413 9.135 ( -1.590 0.000 -9.217) 9.353 9.752 ( -6.094 0.000 8.518) 10.474 9.936 ( 3.891 0.000 9.771) 10.517 10.450 ( -8.973 0.000 -0.362) 8.980 10.691 ( 4.825 0.000 -1.025) 4.932 10.948 ( -8.050 0.000 -1.278) 8.151 10.982 ( -8.018 0.000 -17.416) 19.173 12.023 ( -5.203 0.000 10.448) 11.672 12.124 ( -4.555 0.000 0.952) 4.653 12.193 ( 7.206 0.000 -2.213) 7.539 12.196 ( 12.044 0.000 -1.639) 12.155 12.763 ( 8.412 0.000 9.062) 12.365 13.222 ( 6.826 0.000 3.996) 7.910 13.487 ( 3.950 0.000 0.067) 3.951 13.488 ( -4.402 0.000 -5.086) 6.726 14.388 ( 6.605 0.000 8.083) 10.438 14.597 ( -0.003 0.000 4.386) 4.386 14.681 ( 9.510 0.000 0.566) 9.527 14.982 ( 7.042 0.000 7.965) 10.631 15.561 ( 1.533 0.000 -12.643) 12.735 15.587 ( 0.454 0.000 6.780) 6.796 16.139 ( -15.295 0.000 -0.057) 15.295 16.235 ( -10.083 0.000 -2.180) 10.316 19.262 ( -3.877 0.000 5.540) 6.762 19.271 ( 0.778 0.000 -2.242) 2.373 24.590 ( -0.681 0.000 -0.659) 0.947 24.745 ( 0.852 0.000 -1.155) 1.436 26.014 ( 1.628 0.000 3.014) 3.425 26.528 ( 0.196 0.000 -0.572) 0.605 26.609 ( -2.965 0.000 7.905) 8.443 26.924 ( 0.642 0.000 -1.209) 1.369 27.019 ( 0.383 0.000 3.217) 3.240 27.034 ( 4.889 0.000 -0.431) 4.908 27.101 ( -0.127 0.000 4.490) 4.491 28.034 ( -11.002 0.000 10.159) 14.975 28.968 ( -3.385 0.000 -21.089) 21.359 29.874 ( -6.399 0.000 -27.463) 28.198 32.412 ( -2.662 0.000 4.858) 5.540 32.544 ( -0.974 0.000 -4.533) 4.636 ======================= Grid point 170 (90/150) ======================= q-point: ( 0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.329 ( -21.278 0.000 13.808) 25.365 2.959 ( 24.860 0.000 -15.567) 29.331 3.056 ( 15.255 0.000 -13.600) 20.438 3.441 ( -16.772 0.000 0.523) 16.781 3.467 ( -3.874 0.000 5.143) 6.439 3.543 ( -14.327 0.000 -2.895) 14.617 3.675 ( -20.121 0.000 -2.344) 20.257 4.098 ( 10.412 0.000 1.965) 10.595 4.215 ( -25.329 0.000 -19.649) 32.057 4.386 ( 1.997 0.000 8.274) 8.512 4.578 ( 1.370 0.000 5.573) 5.739 4.729 ( -1.455 0.000 -6.945) 7.096 5.145 ( -13.992 0.000 -14.022) 19.809 5.163 ( -7.466 0.000 -19.688) 21.057 5.417 ( 4.600 0.000 5.210) 6.950 5.830 ( -0.570 0.000 -9.713) 9.729 6.118 ( 11.559 0.000 -8.143) 14.139 6.156 ( -8.827 0.000 -9.601) 13.043 6.529 ( -6.500 0.000 -11.664) 13.353 6.594 ( -4.465 0.000 -11.428) 12.269 7.093 ( -12.320 0.000 6.737) 14.042 7.242 ( -0.083 0.000 -1.668) 1.670 7.769 ( 2.643 0.000 5.368) 5.983 7.874 ( 6.729 0.000 -0.947) 6.795 8.152 ( 4.498 0.000 -0.141) 4.500 8.335 ( -3.170 0.000 -1.522) 3.516 8.818 ( -0.194 0.000 0.471) 0.510 9.109 ( 1.125 0.000 -11.554) 11.609 9.682 ( -2.718 0.000 9.517) 9.898 10.024 ( 2.670 0.000 10.380) 10.718 10.303 ( -5.711 0.000 0.753) 5.760 10.719 ( -2.293 0.000 -8.072) 8.392 10.777 ( -8.557 0.000 -11.773) 14.555 10.838 ( -2.752 0.000 -2.469) 3.697 11.958 ( -3.690 0.000 9.172) 9.887 12.053 ( -1.446 0.000 2.214) 2.644 12.355 ( 9.841 0.000 -5.215) 11.137 12.478 ( 15.786 0.000 -7.273) 17.381 12.945 ( 8.987 0.000 4.547) 10.071 13.355 ( 4.569 0.000 0.437) 4.590 13.421 ( -0.136 0.000 -1.268) 1.275 13.532 ( 0.594 0.000 0.257) 0.647 14.495 ( 2.632 0.000 9.929) 10.272 14.615 ( 0.580 0.000 8.514) 8.534 14.813 ( 4.204 0.000 0.845) 4.288 15.136 ( 7.429 0.000 9.288) 11.894 15.539 ( -1.890 0.000 -12.244) 12.389 15.622 ( 1.807 0.000 8.362) 8.555 15.843 ( -15.079 0.000 0.043) 15.079 16.060 ( -6.734 0.000 -2.863) 7.317 19.189 ( -4.471 0.000 4.458) 6.314 19.297 ( 2.470 0.000 -1.683) 2.989 24.613 ( 3.344 0.000 -1.936) 3.864 24.772 ( 2.683 0.000 -5.450) 6.075 26.055 ( 1.480 0.000 6.681) 6.843 26.437 ( -13.074 0.000 2.989) 13.412 26.563 ( 3.365 0.000 2.064) 3.947 26.975 ( 0.652 0.000 -1.363) 1.511 27.025 ( -1.876 0.000 2.231) 2.915 27.064 ( 3.834 0.000 2.080) 4.362 27.241 ( 10.135 0.000 7.193) 12.428 27.932 ( -1.635 0.000 16.404) 16.485 28.779 ( -11.177 0.000 -25.304) 27.663 29.656 ( -10.063 0.000 -28.073) 29.822 32.376 ( -1.860 0.000 3.271) 3.763 32.560 ( 3.644 0.000 -4.506) 5.795 ======================= Grid point 171 (91/150) ======================= q-point: (-0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.047 ( -9.124 0.000 7.757) 11.976 2.997 ( -25.160 0.000 -12.410) 28.054 3.095 ( -21.056 0.000 2.319) 21.184 3.240 ( -15.457 0.000 11.170) 19.070 3.280 ( 9.144 0.000 -11.486) 14.681 3.339 ( -3.032 0.000 -4.121) 5.116 3.619 ( 10.081 0.000 -0.096) 10.082 3.656 ( -16.412 0.000 -16.506) 23.276 4.138 ( -1.941 0.000 4.676) 5.063 4.510 ( -6.107 0.000 1.165) 6.217 4.578 ( 8.988 0.000 -5.910) 10.757 4.784 ( 4.550 0.000 2.327) 5.111 4.900 ( -8.365 0.000 -2.902) 8.854 5.002 ( -4.529 0.000 -14.808) 15.485 5.584 ( -15.520 0.000 -6.889) 16.980 5.592 ( 10.629 0.000 2.093) 10.833 6.195 ( 5.903 0.000 -4.915) 7.681 6.366 ( 2.844 0.000 -9.980) 10.378 6.391 ( 7.489 0.000 -6.474) 9.899 6.466 ( -5.734 0.000 -11.935) 13.241 6.960 ( -2.098 0.000 5.784) 6.153 7.239 ( -0.236 0.000 1.015) 1.042 7.827 ( 2.462 0.000 6.844) 7.273 7.988 ( 4.536 0.000 -5.480) 7.114 8.190 ( -0.371 0.000 -3.585) 3.604 8.229 ( -6.610 0.000 0.994) 6.685 8.878 ( 5.544 0.000 0.873) 5.612 9.128 ( 3.040 0.000 -11.780) 12.166 9.692 ( 1.668 0.000 10.507) 10.639 10.082 ( 1.406 0.000 10.522) 10.616 10.246 ( -0.147 0.000 0.091) 0.173 10.573 ( -7.142 0.000 -15.217) 16.810 10.636 ( -6.564 0.000 -0.823) 6.615 10.833 ( 2.688 0.000 -3.507) 4.419 11.911 ( -2.910 0.000 6.027) 6.693 12.071 ( 2.247 0.000 -1.749) 2.848 12.528 ( 8.505 0.000 -4.936) 9.833 12.734 ( 11.552 0.000 -7.321) 13.677 13.126 ( 9.152 0.000 -0.555) 9.169 13.382 ( 2.502 0.000 -9.134) 9.471 13.495 ( 4.093 0.000 4.638) 6.186 13.513 ( -2.488 0.000 -0.047) 2.488 14.535 ( -0.499 0.000 10.325) 10.337 14.647 ( 0.243 0.000 11.841) 11.843 14.849 ( -0.650 0.000 0.482) 0.810 15.308 ( 6.971 0.000 13.438) 15.139 15.438 ( -4.104 0.000 -14.298) 14.875 15.563 ( -12.249 0.000 -1.749) 12.374 15.709 ( 4.435 0.000 11.035) 11.893 15.973 ( -1.890 0.000 -4.220) 4.624 19.116 ( -3.797 0.000 3.710) 5.309 19.364 ( 4.764 0.000 -0.622) 4.804 24.710 ( 7.123 0.000 -2.939) 7.706 24.828 ( 4.610 0.000 -9.058) 10.164 26.100 ( 1.690 0.000 9.405) 9.556 26.168 ( -14.996 0.000 4.630) 15.694 26.663 ( 6.010 0.000 4.708) 7.634 26.838 ( -9.567 0.000 -4.895) 10.747 27.109 ( 6.785 0.000 1.210) 6.892 27.172 ( 6.760 0.000 0.808) 6.808 27.458 ( 9.820 0.000 11.756) 15.318 28.017 ( 5.287 0.000 21.451) 22.093 28.441 ( -18.178 0.000 -26.823) 32.402 29.386 ( -11.444 0.000 -28.170) 30.406 32.357 ( -0.617 0.000 2.310) 2.391 32.662 ( 7.823 0.000 -5.672) 9.663 ======================= Grid point 172 (92/150) ======================= q-point: (-0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.985 ( -1.881 0.000 5.714) 6.016 2.487 ( -21.793 0.000 -11.927) 24.843 2.749 ( -11.704 0.000 6.096) 13.196 2.874 ( -22.883 0.000 17.495) 28.804 2.933 ( -22.945 0.000 11.151) 25.512 3.430 ( 7.500 0.000 -1.113) 7.582 3.778 ( 14.186 0.000 -9.055) 16.830 3.838 ( 12.536 0.000 -6.551) 14.144 4.123 ( -0.020 0.000 1.782) 1.782 4.410 ( -3.916 0.000 1.964) 4.381 4.605 ( -4.311 0.000 -4.229) 6.039 4.791 ( -4.130 0.000 3.980) 5.736 4.843 ( -1.197 0.000 8.481) 8.565 4.928 ( -1.398 0.000 -5.425) 5.603 5.363 ( -3.263 0.000 -8.015) 8.653 5.799 ( 9.813 0.000 -0.765) 9.843 6.178 ( -6.585 0.000 -3.128) 7.291 6.236 ( -6.026 0.000 -2.978) 6.722 6.407 ( 1.647 0.000 -6.906) 7.100 6.727 ( 18.650 0.000 -6.821) 19.858 7.023 ( 6.816 0.000 2.083) 7.127 7.235 ( -0.731 0.000 3.712) 3.784 7.914 ( 5.572 0.000 6.392) 8.480 7.952 ( -7.038 0.000 -3.297) 7.772 8.133 ( -3.897 0.000 -6.223) 7.343 8.169 ( 0.938 0.000 -6.756) 6.821 8.996 ( 5.851 0.000 -0.062) 5.851 9.168 ( 3.200 0.000 -9.855) 10.361 9.782 ( 5.050 0.000 10.680) 11.814 10.140 ( 3.101 0.000 11.283) 11.701 10.288 ( 3.864 0.000 -2.619) 4.668 10.418 ( -5.717 0.000 -12.688) 13.916 10.546 ( -1.496 0.000 3.181) 3.515 10.922 ( 7.186 0.000 -3.794) 8.126 11.872 ( -1.870 0.000 2.604) 3.206 12.097 ( 0.412 0.000 -3.184) 3.211 12.643 ( 4.106 0.000 -3.659) 5.499 12.886 ( 5.556 0.000 -3.778) 6.719 13.283 ( 6.906 0.000 -2.515) 7.350 13.419 ( 2.480 0.000 -10.869) 11.148 13.443 ( -4.501 0.000 -0.879) 4.586 13.584 ( 5.259 0.000 -1.708) 5.529 14.513 ( -3.913 0.000 8.099) 8.995 14.655 ( -2.756 0.000 13.414) 13.694 14.788 ( -5.649 0.000 -0.424) 5.665 15.242 ( -9.076 0.000 -6.810) 11.347 15.385 ( -3.895 0.000 -5.287) 6.567 15.563 ( 12.454 0.000 5.783) 13.731 15.861 ( 8.665 0.000 13.712) 16.220 15.950 ( 0.122 0.000 -5.210) 5.212 19.063 ( -2.279 0.000 3.382) 4.078 19.475 ( 6.513 0.000 0.319) 6.521 24.870 ( 10.005 0.000 -3.947) 10.756 24.912 ( 6.072 0.000 -11.223) 12.760 25.896 ( -13.914 0.000 7.148) 15.643 26.171 ( 3.947 0.000 11.508) 12.166 26.649 ( -8.342 0.000 -4.063) 9.279 26.798 ( 6.308 0.000 5.658) 8.474 27.261 ( 8.631 0.000 -2.625) 9.021 27.310 ( 6.813 0.000 -0.554) 6.836 27.658 ( 8.035 0.000 15.412) 17.380 27.977 ( -24.194 0.000 -25.832) 35.393 28.180 ( 6.015 0.000 23.846) 24.593 29.125 ( -9.100 0.000 -25.975) 27.523 32.362 ( 0.654 0.000 2.112) 2.211 32.829 ( 10.589 0.000 -7.913) 13.219 ======================= Grid point 173 (93/150) ======================= q-point: (-0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.853 ( -12.967 0.000 11.107) 17.074 2.224 ( -2.576 0.000 5.283) 5.877 2.537 ( -14.028 0.000 29.556) 32.716 2.634 ( -12.081 0.000 17.659) 21.396 2.794 ( 13.892 0.000 5.464) 14.928 3.543 ( 2.056 0.000 8.885) 9.120 3.959 ( 2.370 0.000 0.054) 2.371 4.060 ( 11.903 0.000 -9.474) 15.213 4.150 ( 2.314 0.000 0.774) 2.440 4.382 ( 0.535 0.000 5.749) 5.774 4.466 ( -6.819 0.000 3.392) 7.617 4.716 ( -11.181 0.000 14.679) 18.452 4.753 ( 0.566 0.000 3.031) 3.083 4.972 ( 6.060 0.000 -4.589) 7.602 5.454 ( 12.001 0.000 -2.508) 12.261 5.921 ( 2.136 0.000 -9.437) 9.676 6.024 ( -7.291 0.000 -6.728) 9.921 6.163 ( -0.754 0.000 9.862) 9.891 6.435 ( 1.744 0.000 -1.415) 2.246 6.970 ( 4.583 0.000 -7.731) 8.988 7.188 ( 9.053 0.000 0.767) 9.085 7.269 ( 5.449 0.000 9.266) 10.749 7.783 ( -9.229 0.000 -5.056) 10.524 7.979 ( -3.638 0.000 -7.438) 8.280 8.131 ( 9.071 0.000 4.526) 10.137 8.158 ( -1.143 0.000 -8.044) 8.125 9.090 ( 4.095 0.000 -1.268) 4.287 9.212 ( 3.287 0.000 -7.423) 8.118 9.912 ( 5.625 0.000 9.826) 11.322 10.275 ( -4.099 0.000 -7.480) 8.530 10.276 ( 9.096 0.000 12.319) 15.313 10.386 ( 4.702 0.000 -8.197) 9.450 10.626 ( 8.177 0.000 7.308) 10.967 11.086 ( 10.241 0.000 -4.139) 11.046 11.853 ( -0.322 0.000 -0.455) 0.557 12.071 ( -2.235 0.000 -2.469) 3.331 12.673 ( -0.118 0.000 -3.707) 3.709 12.939 ( 0.411 0.000 -0.156) 0.440 13.330 ( -5.966 0.000 0.633) 5.999 13.377 ( 2.137 0.000 -1.706) 2.734 13.417 ( -1.088 0.000 -5.982) 6.080 13.687 ( 6.891 0.000 -14.369) 15.936 14.408 ( -8.513 0.000 3.605) 9.244 14.572 ( -8.275 0.000 11.309) 14.013 14.637 ( -9.742 0.000 -0.515) 9.756 15.019 ( -12.076 0.000 -11.556) 16.715 15.425 ( 8.829 0.000 -7.948) 11.879 15.836 ( 13.400 0.000 8.405) 15.818 15.951 ( 1.512 0.000 -7.299) 7.454 16.098 ( 12.955 0.000 13.034) 18.377 19.044 ( -0.368 0.000 3.368) 3.389 19.602 ( 6.022 0.000 0.357) 6.032 25.003 ( 5.122 0.000 -10.619) 11.790 25.073 ( 11.772 0.000 -5.561) 13.019 25.680 ( -9.452 0.000 8.012) 12.391 26.318 ( 9.018 0.000 13.535) 16.264 26.519 ( -4.220 0.000 -1.998) 4.669 26.900 ( 2.505 0.000 3.321) 4.159 27.367 ( -14.378 0.000 -12.346) 18.951 27.406 ( 6.675 0.000 -7.000) 9.673 27.457 ( -10.583 0.000 -12.357) 16.269 27.834 ( 6.767 0.000 17.865) 19.103 28.326 ( 3.837 0.000 24.982) 25.275 28.967 ( -1.699 0.000 -19.037) 19.113 32.389 ( 1.519 0.000 2.709) 3.105 33.023 ( 10.963 0.000 -10.981) 15.517 ======================= Grid point 174 (94/150) ======================= q-point: (-0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.664 ( -5.653 0.000 8.643) 10.327 2.338 ( -6.331 0.000 20.883) 21.821 2.443 ( 13.160 0.000 24.554) 27.858 2.624 ( 5.622 0.000 26.724) 27.309 3.149 ( 17.123 0.000 7.816) 18.822 3.493 ( -8.954 0.000 14.149) 16.744 3.808 ( -16.449 0.000 17.072) 23.707 4.177 ( -0.243 0.000 4.583) 4.590 4.231 ( 5.643 0.000 -2.779) 6.290 4.459 ( 3.606 0.000 6.709) 7.616 4.477 ( 8.900 0.000 0.195) 8.902 4.587 ( -3.784 0.000 17.562) 17.965 4.875 ( 12.389 0.000 -3.921) 12.995 5.121 ( 10.042 0.000 -4.777) 11.120 5.738 ( 14.150 0.000 5.553) 15.200 5.858 ( -4.602 0.000 -8.757) 9.893 5.887 ( -3.717 0.000 -8.749) 9.505 6.232 ( 3.833 0.000 11.696) 12.308 6.467 ( 1.622 0.000 0.223) 1.637 6.919 ( -5.333 0.000 -1.391) 5.512 7.357 ( 8.147 0.000 1.544) 8.292 7.438 ( 7.282 0.000 9.916) 12.302 7.558 ( -12.793 0.000 -7.556) 14.857 7.872 ( -4.172 0.000 -9.578) 10.447 8.098 ( -4.003 0.000 0.641) 4.054 8.363 ( 11.449 0.000 5.657) 12.771 9.170 ( 5.409 0.000 -2.106) 5.804 9.272 ( 4.356 0.000 -5.760) 7.221 10.021 ( 3.523 0.000 8.951) 9.619 10.208 ( -0.813 0.000 -6.003) 6.058 10.484 ( 6.592 0.000 -5.728) 8.733 10.533 ( 13.880 0.000 9.196) 16.649 10.841 ( 11.361 0.000 6.710) 13.194 11.285 ( 10.898 0.000 -4.902) 11.950 11.860 ( 1.434 0.000 -2.148) 2.582 12.017 ( -2.285 0.000 -2.106) 3.107 12.633 ( -2.862 0.000 -4.896) 5.671 12.902 ( -4.237 0.000 1.542) 4.509 13.187 ( -8.757 0.000 3.615) 9.474 13.351 ( -4.314 0.000 -4.144) 5.982 13.408 ( 1.270 0.000 1.008) 1.622 13.795 ( 7.795 0.000 -19.507) 21.007 14.190 ( -14.338 0.000 -1.464) 14.412 14.413 ( -13.059 0.000 -1.835) 13.187 14.416 ( -8.547 0.000 6.057) 10.476 14.735 ( -14.299 0.000 -13.697) 19.801 15.625 ( 11.285 0.000 -6.534) 13.040 15.935 ( -0.216 0.000 -2.170) 2.181 16.132 ( 13.814 0.000 1.290) 13.874 16.408 ( 16.867 0.000 4.563) 17.474 19.062 ( 1.442 0.000 3.541) 3.823 19.681 ( 1.450 0.000 -0.955) 1.736 25.038 ( -0.442 0.000 -4.109) 4.133 25.288 ( 11.342 0.000 -8.554) 14.206 25.590 ( -0.698 0.000 3.513) 3.581 26.482 ( 0.585 0.000 0.243) 0.633 26.505 ( -3.526 0.000 4.106) 5.413 26.851 ( -6.955 0.000 -2.437) 7.369 26.922 ( -5.625 0.000 -2.391) 6.112 27.453 ( 0.510 0.000 -3.847) 3.880 27.470 ( 1.371 0.000 -8.842) 8.948 27.979 ( 3.779 0.000 16.216) 16.650 28.432 ( 2.263 0.000 25.091) 25.193 28.999 ( 7.800 0.000 -9.687) 12.437 32.428 ( 1.717 0.000 4.078) 4.424 33.185 ( 7.748 0.000 -14.218) 16.192 ======================= Grid point 175 (95/150) ======================= q-point: (-0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.723 ( 9.966 0.000 3.473) 10.554 2.215 ( -5.517 0.000 4.128) 6.891 2.688 ( -6.950 0.000 35.005) 35.688 2.971 ( 26.158 0.000 18.799) 32.212 3.155 ( -16.493 0.000 24.353) 29.413 3.567 ( 13.583 0.000 -2.608) 13.831 3.616 ( -3.385 0.000 35.008) 35.171 4.154 ( -3.327 0.000 10.182) 10.712 4.274 ( 0.244 0.000 2.153) 2.166 4.578 ( 0.837 0.000 4.770) 4.843 4.591 ( 8.758 0.000 3.325) 9.368 4.720 ( 11.356 0.000 6.491) 13.080 5.159 ( 15.944 0.000 -6.272) 17.133 5.316 ( 9.736 0.000 -4.495) 10.723 5.738 ( -4.000 0.000 -4.060) 5.700 5.756 ( -3.853 0.000 -3.883) 5.470 6.103 ( 16.474 0.000 5.414) 17.341 6.321 ( 2.809 0.000 6.365) 6.957 6.497 ( 1.438 0.000 0.133) 1.444 6.848 ( -0.421 0.000 5.457) 5.473 7.288 ( -12.787 0.000 -2.546) 13.038 7.517 ( 7.969 0.000 5.425) 9.640 7.555 ( 2.575 0.000 10.367) 10.682 7.790 ( -2.442 0.000 -10.340) 10.624 8.020 ( -4.857 0.000 10.044) 11.157 8.531 ( 3.621 0.000 8.022) 8.801 9.313 ( 9.662 0.000 -3.107) 10.149 9.347 ( 4.052 0.000 -4.830) 6.305 10.084 ( 1.248 0.000 8.350) 8.443 10.234 ( 4.579 0.000 -3.016) 5.483 10.592 ( 4.933 0.000 -6.418) 8.094 10.758 ( 5.691 0.000 -0.599) 5.723 11.050 ( 8.019 0.000 6.434) 10.281 11.470 ( 8.953 0.000 -5.226) 10.367 11.911 ( 4.526 0.000 -1.125) 4.664 11.992 ( 0.611 0.000 -2.947) 3.010 12.554 ( -3.917 0.000 -5.552) 6.794 12.790 ( -7.490 0.000 0.841) 7.537 13.006 ( -11.609 0.000 10.766) 15.833 13.275 ( -1.198 0.000 -3.551) 3.748 13.447 ( 2.980 0.000 0.985) 3.139 13.857 ( -18.845 0.000 -4.934) 19.480 13.859 ( -1.282 0.000 -17.140) 17.188 14.170 ( -7.215 0.000 -6.800) 9.914 14.305 ( -2.715 0.000 -0.958) 2.879 14.437 ( -13.237 0.000 -11.361) 17.444 15.775 ( 4.437 0.000 -2.516) 5.100 15.908 ( -2.084 0.000 -3.830) 4.360 16.376 ( 10.823 0.000 0.407) 10.830 16.727 ( 15.114 0.000 -7.994) 17.098 19.111 ( 2.803 0.000 3.994) 4.879 19.631 ( -6.353 0.000 -1.592) 6.550 24.981 ( -4.760 0.000 3.868) 6.134 25.421 ( 1.451 0.000 -10.500) 10.600 25.653 ( 6.300 0.000 -2.019) 6.616 26.093 ( -20.761 0.000 -5.905) 21.585 26.534 ( 4.206 0.000 1.545) 4.481 26.776 ( -6.219 0.000 -2.035) 6.543 27.218 ( 23.897 0.000 9.854) 25.849 27.429 ( -3.495 0.000 -7.584) 8.351 27.455 ( 3.555 0.000 -0.642) 3.612 28.006 ( -4.487 0.000 12.050) 12.859 28.533 ( 3.134 0.000 22.524) 22.741 29.207 ( 14.735 0.000 -5.740) 15.814 32.467 ( 1.224 0.000 5.998) 6.122 33.240 ( 0.659 0.000 -15.704) 15.718 ======================= Grid point 176 (96/150) ======================= q-point: ( 0.00 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( -3.751 9.354 24.928) 26.888 2.137 ( -1.706 -2.260 0.713) 2.920 2.448 ( 4.699 7.613 6.150) 10.856 3.122 ( -0.426 9.574 19.865) 22.056 3.477 ( 12.271 3.209 9.154) 15.642 3.686 ( 8.554 -4.945 15.567) 18.438 3.760 ( 3.139 -8.217 7.125) 11.320 4.127 ( 7.227 1.959 19.556) 20.940 4.326 ( -0.672 3.900 1.406) 4.200 4.573 ( -7.597 1.328 10.338) 12.898 4.778 ( 8.588 -3.892 -3.103) 9.926 4.858 ( 10.396 -4.401 -6.266) 12.912 5.316 ( 8.976 1.739 3.735) 9.876 5.477 ( -4.685 4.094 -6.225) 8.802 5.580 ( -2.502 -3.651 -0.856) 4.509 5.991 ( 6.740 11.569 1.710) 13.498 6.370 ( 1.465 1.728 1.354) 2.639 6.461 ( 0.778 -7.558 5.693) 9.495 6.489 ( 12.466 6.749 4.925) 15.007 6.946 ( 8.182 -0.755 4.851) 9.542 7.081 ( -3.522 -5.585 6.505) 9.269 7.362 ( -3.581 -13.294 10.013) 17.024 7.610 ( -1.171 -6.082 -6.583) 9.039 7.642 ( 7.572 -11.425 9.695) 16.789 8.105 ( -1.745 12.413 3.735) 13.079 8.599 ( -1.543 1.937 5.880) 6.380 9.321 ( 1.492 -1.591 -0.484) 2.235 9.528 ( 5.581 1.290 -4.552) 7.317 10.149 ( -0.419 4.528 6.289) 7.761 10.372 ( 7.553 0.184 -0.666) 7.584 10.566 ( -2.260 -3.334 -7.077) 8.143 10.693 ( -4.070 -1.202 -8.746) 9.721 11.186 ( -1.155 4.305 5.641) 7.189 11.552 ( 2.635 -3.609 -3.852) 5.899 11.797 ( 6.005 -10.225 -3.027) 12.238 12.014 ( -4.242 -10.766 -8.056) 14.100 12.527 ( -1.652 9.605 3.534) 10.367 12.719 ( -7.742 2.727 8.763) 12.006 12.950 ( -13.782 16.908 4.324) 22.238 13.342 ( 6.848 -0.035 -1.089) 6.934 13.451 ( -3.845 -2.709 -1.221) 4.859 13.525 ( -2.629 -1.355 -5.351) 6.114 13.689 ( -11.790 4.652 -10.052) 16.177 14.049 ( -1.360 -7.146 -14.850) 16.536 14.265 ( -5.810 5.653 -1.429) 8.231 14.497 ( 5.631 11.589 -4.902) 13.785 15.613 ( -3.821 -10.694 -1.983) 11.528 15.866 ( 3.537 -3.210 -7.851) 9.189 16.548 ( 4.289 1.115 -1.018) 4.547 16.823 ( 4.487 -7.531 -10.176) 13.431 19.263 ( 1.509 7.395 3.401) 8.278 19.472 ( -8.202 0.482 0.888) 8.264 24.916 ( -5.620 2.461 6.932) 9.257 25.180 ( -13.685 -4.697 0.916) 14.498 25.833 ( 7.509 2.770 -4.176) 9.028 25.916 ( 1.630 0.103 -9.159) 9.304 26.636 ( 4.047 0.222 1.001) 4.175 26.667 ( -3.293 -0.502 0.178) 3.336 27.312 ( -4.287 -0.091 -3.720) 5.677 27.321 ( -5.458 -0.125 -4.276) 6.935 27.893 ( -7.437 2.964 8.094) 11.385 27.977 ( 23.273 3.900 7.390) 24.727 28.628 ( 3.574 1.773 15.385) 15.893 29.354 ( 17.352 -15.887 -5.966) 24.271 32.599 ( 0.332 9.907 3.477) 10.505 33.107 ( -5.668 -4.240 -12.212) 14.115 ======================= Grid point 177 (97/150) ======================= q-point: ( 0.09 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.993 ( -7.065 3.688 29.293) 30.358 2.260 ( 13.350 -1.583 -11.029) 17.388 2.509 ( -4.706 28.273 21.841) 36.036 3.240 ( 14.567 12.291 -7.284) 20.404 3.607 ( 0.032 -7.718 1.199) 7.811 3.807 ( 1.655 -5.073 8.102) 9.702 3.910 ( 7.008 -6.409 13.995) 16.913 4.264 ( 0.449 -3.137 9.364) 9.885 4.333 ( 0.641 3.161 3.466) 4.734 4.457 ( -3.606 3.625 15.201) 16.037 4.908 ( 5.118 -4.393 -3.256) 7.490 5.007 ( 6.892 -5.308 -9.845) 13.137 5.280 ( -7.578 3.307 -2.017) 8.511 5.427 ( -3.918 -1.093 -0.069) 4.069 5.641 ( 7.455 -1.984 -0.188) 7.717 6.090 ( 2.879 11.784 -1.952) 12.287 6.396 ( 0.800 1.134 3.998) 4.232 6.475 ( 1.735 -9.650 1.364) 9.900 6.748 ( 10.676 2.939 8.965) 14.247 6.973 ( -2.042 3.536 -0.969) 4.197 7.217 ( 4.856 -16.722 6.246) 18.499 7.344 ( 5.320 -7.532 0.809) 9.257 7.585 ( 0.646 -2.858 -5.259) 6.020 7.772 ( 3.281 -7.992 9.241) 12.650 8.088 ( -0.772 10.542 2.059) 10.769 8.517 ( -7.914 2.164 5.368) 9.804 9.320 ( -1.600 -1.081 -1.562) 2.484 9.542 ( -3.410 1.492 -5.426) 6.580 10.119 ( -4.298 4.925 4.799) 8.109 10.311 ( -14.987 -1.214 -7.299) 16.714 10.548 ( -1.277 5.232 -5.455) 7.666 10.646 ( 8.784 0.608 -3.726) 9.561 11.100 ( -7.951 1.655 5.034) 9.555 11.496 ( -7.849 -6.911 -4.423) 11.355 11.883 ( 1.277 -10.496 -5.730) 12.026 12.008 ( 7.119 -9.880 -4.493) 12.980 12.477 ( -4.609 5.222 9.093) 11.454 12.544 ( -13.439 1.193 17.391) 22.011 12.708 ( -9.845 20.137 -5.095) 22.986 13.277 ( -3.512 -1.498 -2.803) 4.736 13.381 ( -8.917 6.392 -5.390) 12.224 13.600 ( 9.512 2.188 -3.586) 10.399 13.717 ( 10.848 -2.500 0.097) 11.133 13.962 ( -0.558 -3.718 -10.273) 10.939 14.299 ( 7.304 -2.186 -1.107) 7.705 14.590 ( 3.796 5.125 -0.845) 6.433 15.550 ( -1.038 -3.440 -6.467) 7.398 15.871 ( -1.538 5.203 -3.870) 6.664 16.582 ( -0.422 -1.930 -2.182) 2.943 16.799 ( -4.711 -7.079 -8.225) 11.830 19.280 ( -1.005 2.663 5.395) 6.099 19.356 ( -3.284 2.020 2.232) 4.455 24.830 ( -4.674 1.143 7.399) 8.826 24.929 ( -11.616 -1.315 4.035) 12.367 25.938 ( 3.131 0.391 -8.050) 8.646 26.002 ( 8.932 -0.244 -1.696) 9.095 26.638 ( -0.149 1.479 0.764) 1.671 26.727 ( 4.688 -0.857 0.010) 4.766 27.201 ( -5.822 -0.178 -1.016) 5.913 27.207 ( -5.569 -0.063 -0.746) 5.620 27.691 ( -12.375 6.644 2.503) 14.268 28.326 ( 6.775 -11.693 6.220) 14.877 28.767 ( 10.287 11.421 5.086) 16.190 29.663 ( 15.623 -15.610 -14.636) 26.495 32.593 ( -1.791 8.327 4.235) 9.512 32.937 ( -8.895 -1.790 -8.792) 12.635 ======================= Grid point 178 (98/150) ======================= q-point: ( 0.18 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.985 ( 1.743 10.643 16.645) 19.834 2.424 ( -0.048 22.434 16.380) 27.778 2.641 ( 22.446 0.814 -11.751) 25.349 3.478 ( -0.930 6.328 -6.707) 9.268 3.570 ( 4.337 -1.846 4.599) 6.585 3.806 ( -4.860 -5.907 8.863) 11.708 4.002 ( 3.458 -8.816 4.561) 10.511 4.157 ( -8.724 -7.386 3.289) 11.895 4.387 ( 3.485 6.478 2.551) 7.785 4.500 ( 1.016 1.543 14.419) 14.536 4.958 ( 0.847 -3.636 -2.105) 4.286 5.103 ( 2.615 -6.497 -17.994) 19.309 5.139 ( -2.441 3.764 0.019) 4.486 5.319 ( -7.225 -3.213 5.428) 9.591 5.760 ( 4.694 0.966 -5.028) 6.946 6.076 ( -3.269 10.232 -7.758) 13.250 6.367 ( -6.475 -3.705 5.438) 9.231 6.546 ( 4.953 -5.248 -1.868) 7.454 6.841 ( -3.653 -0.547 -0.960) 3.816 6.992 ( 5.195 4.507 2.351) 7.268 7.187 ( -3.636 -13.689 -1.034) 14.201 7.498 ( 4.616 -4.471 -7.410) 9.808 7.623 ( 4.397 1.588 -3.940) 6.114 7.833 ( 1.264 -3.132 4.835) 5.897 8.077 ( 0.945 2.703 -4.054) 4.963 8.327 ( -12.173 0.210 2.244) 12.380 9.243 ( -6.088 0.194 -2.972) 6.777 9.401 ( -8.471 2.571 -5.965) 10.675 9.968 ( -10.996 4.925 -0.855) 12.079 10.042 ( -9.349 0.606 4.981) 10.611 10.525 ( 1.655 6.885 -3.617) 7.952 10.840 ( 2.841 -1.437 -1.345) 3.457 10.961 ( -1.036 0.363 2.189) 2.449 11.283 ( -11.548 -8.715 -3.449) 14.873 11.910 ( 3.592 -4.370 -5.826) 8.121 12.146 ( 4.767 -6.466 -0.509) 8.049 12.300 ( -12.535 0.856 13.746) 18.622 12.408 ( -4.996 -0.782 12.974) 13.924 12.540 ( -6.724 18.393 -5.082) 20.232 13.236 ( -3.366 9.726 -2.751) 10.654 13.288 ( 3.484 -1.694 -1.739) 4.247 13.627 ( -4.597 -4.712 -5.738) 8.733 13.941 ( 12.165 -2.930 2.479) 12.756 14.129 ( 15.272 -1.697 -1.478) 15.437 14.463 ( 8.332 -3.549 -1.608) 9.198 14.653 ( 3.739 -1.874 4.125) 5.874 15.554 ( 2.579 4.866 -8.068) 9.768 15.810 ( -3.688 10.031 -1.135) 10.748 16.524 ( -4.969 -3.811 -2.548) 6.761 16.631 ( -10.735 -5.621 -4.342) 12.872 19.260 ( -1.210 -0.255 3.095) 3.333 19.334 ( -1.044 1.078 4.370) 4.620 24.755 ( -7.360 0.249 3.136) 8.005 24.769 ( -3.095 -0.029 5.731) 6.513 25.972 ( 2.017 1.412 -4.998) 5.572 26.181 ( 8.706 -4.957 2.018) 10.220 26.653 ( 1.773 5.159 0.574) 5.485 26.815 ( 4.693 -0.732 -0.491) 4.775 27.097 ( -4.763 -0.029 1.773) 5.082 27.114 ( -4.367 -0.015 2.631) 5.098 27.448 ( -12.506 8.315 -1.887) 15.136 28.301 ( -7.934 -15.516 6.349) 18.548 28.992 ( 10.660 12.854 -5.668) 17.634 29.862 ( 8.320 -13.466 -21.196) 26.454 32.551 ( -3.357 5.782 4.736) 8.193 32.754 ( -8.064 -0.449 -6.272) 10.226 ======================= Grid point 179 (99/150) ======================= q-point: ( 0.27 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.143 ( 12.843 10.551 2.923) 16.876 2.531 ( 9.233 14.431 0.948) 17.158 3.053 ( 11.671 -7.448 -4.365) 14.516 3.306 ( -3.449 8.095 4.321) 9.803 3.570 ( -9.712 -7.479 3.814) 12.838 3.753 ( 0.523 -4.748 7.745) 9.100 3.966 ( -11.488 -9.150 -1.953) 14.816 4.129 ( 6.587 -1.320 1.673) 6.923 4.414 ( -2.531 6.759 4.461) 8.484 4.540 ( 2.366 2.957 4.608) 5.964 4.930 ( -4.288 -4.125 2.071) 6.300 4.981 ( -6.563 -1.177 -11.656) 13.429 5.160 ( -3.633 -2.289 -4.214) 6.017 5.271 ( 5.388 -0.888 -7.352) 9.158 5.805 ( 1.741 2.084 -6.924) 7.437 5.963 ( -4.430 7.052 -14.730) 16.921 6.119 ( -19.374 -4.176 -2.929) 20.034 6.609 ( 0.573 -0.871 -1.293) 1.661 6.740 ( -4.173 -0.092 -7.481) 8.567 7.038 ( -6.296 10.098 -3.295) 12.348 7.106 ( -0.166 -16.529 -6.424) 17.734 7.506 ( -1.890 0.001 -2.661) 3.264 7.711 ( 5.054 4.217 -2.502) 7.042 7.783 ( -5.829 4.189 -0.483) 7.194 8.088 ( -6.789 -3.169 0.632) 7.519 8.168 ( 5.083 -7.134 -8.229) 12.018 9.088 ( -8.528 3.606 -1.223) 9.340 9.243 ( -5.988 2.108 -5.989) 8.727 9.841 ( -3.606 0.925 6.298) 7.316 9.900 ( -5.922 -0.160 7.712) 9.724 10.578 ( 2.447 4.687 -5.772) 7.828 10.710 ( -7.339 2.057 6.137) 9.785 11.008 ( -5.444 -5.697 -8.860) 11.857 11.129 ( -0.615 -2.354 -3.332) 4.126 12.004 ( 6.297 0.327 -0.849) 6.363 12.075 ( -5.153 0.352 3.798) 6.411 12.206 ( -4.549 -1.834 3.795) 6.201 12.340 ( -4.684 9.702 4.609) 11.718 12.497 ( 3.959 -3.151 7.098) 8.717 13.233 ( 2.758 9.786 1.532) 10.282 13.372 ( 4.088 -3.817 -2.862) 6.282 13.507 ( -5.087 -6.916 -4.300) 9.602 14.174 ( 10.795 -2.487 5.446) 12.344 14.406 ( 11.909 -4.643 0.434) 12.789 14.582 ( 5.126 0.449 0.692) 5.192 14.784 ( 7.950 -3.779 6.180) 10.755 15.595 ( 2.788 8.247 -7.001) 11.172 15.740 ( -3.121 10.811 0.244) 11.255 16.386 ( -9.043 -4.470 -3.325) 10.622 16.388 ( -13.022 -4.038 -0.924) 13.665 19.250 ( -0.465 -1.027 1.078) 1.560 19.312 ( -2.237 -0.340 4.612) 5.137 24.650 ( -3.982 1.167 1.078) 4.287 24.735 ( -1.261 -0.908 2.646) 3.069 26.000 ( 1.636 2.018 -0.957) 2.769 26.310 ( 3.619 -9.557 2.137) 10.440 26.734 ( 6.349 9.594 4.983) 12.538 26.912 ( 5.324 -0.413 0.268) 5.346 27.027 ( -3.594 0.884 3.457) 5.065 27.044 ( -2.890 1.201 1.404) 3.431 27.218 ( -10.162 6.382 -2.220) 12.204 28.109 ( -12.171 -14.699 5.798) 19.945 29.115 ( 3.899 11.607 -13.898) 18.523 29.898 ( 0.465 -10.531 -24.467) 26.641 32.490 ( -3.718 3.351 4.581) 6.785 32.612 ( -5.282 -0.248 -4.783) 7.130 ======================= Grid point 180 (100/150) ======================= q-point: ( 0.36 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.473 ( 20.362 0.576 -8.240) 21.973 2.710 ( 0.932 5.898 -5.360) 8.024 2.843 ( -10.998 -0.112 8.399) 13.838 3.379 ( -8.541 -16.293 2.334) 18.544 3.579 ( 9.080 -4.007 -0.816) 9.959 3.677 ( -11.995 -5.161 0.973) 13.095 3.826 ( 6.214 4.825 -1.661) 8.041 4.177 ( -3.441 1.949 4.457) 5.959 4.334 ( -4.863 4.467 -0.726) 6.643 4.586 ( -2.274 3.385 5.161) 6.578 4.747 ( -12.133 2.059 -7.580) 14.454 4.845 ( -4.212 2.043 -6.018) 7.624 5.148 ( 3.641 -5.060 -9.355) 11.241 5.294 ( -2.707 -1.828 -15.476) 15.817 5.672 ( -21.952 0.088 -11.459) 24.763 5.828 ( 1.949 -2.687 -4.693) 5.748 5.933 ( 5.713 8.296 -14.710) 17.829 6.525 ( -9.495 2.325 -1.246) 9.854 6.664 ( -2.929 0.647 -9.559) 10.019 6.757 ( -15.185 4.737 -12.564) 20.271 7.155 ( 3.566 -9.180 -2.655) 10.200 7.330 ( -15.422 -3.109 1.434) 15.798 7.739 ( 2.739 4.017 -0.593) 4.899 7.810 ( 5.184 5.314 0.948) 7.484 8.061 ( 3.100 -0.288 1.238) 3.351 8.255 ( 3.933 -8.605 -7.116) 11.839 8.940 ( -6.410 5.201 0.990) 8.314 9.146 ( -2.889 0.460 -7.190) 7.762 9.755 ( -5.407 0.535 8.701) 10.258 9.907 ( 2.348 -2.955 9.777) 10.480 10.483 ( -7.293 3.391 -1.758) 8.233 10.725 ( 3.619 2.506 -0.370) 4.417 10.843 ( -7.641 -4.903 -7.757) 11.942 11.050 ( -7.162 1.884 -8.907) 11.584 12.032 ( 0.245 0.783 5.621) 5.681 12.104 ( -3.901 -1.993 0.636) 4.426 12.189 ( 7.580 0.548 -0.553) 7.620 12.306 ( 4.083 10.476 0.923) 11.281 12.646 ( 8.281 -9.485 7.447) 14.629 13.321 ( 4.349 7.091 0.570) 8.338 13.334 ( -4.158 -13.011 -3.212) 14.032 13.509 ( 3.488 0.553 0.248) 3.540 14.371 ( 8.167 -0.928 7.976) 11.453 14.564 ( 4.840 -3.402 3.961) 7.120 14.703 ( 6.542 2.291 1.928) 7.194 14.946 ( 7.102 -3.633 6.930) 10.567 15.619 ( 0.722 7.437 -5.868) 9.501 15.699 ( -1.229 9.112 1.111) 9.262 16.115 ( -14.401 -2.692 -0.416) 14.656 16.198 ( -9.675 -3.874 -2.565) 10.733 19.240 ( -1.469 -1.231 2.594) 3.225 19.274 ( -1.547 -0.548 1.368) 2.136 24.606 ( -0.545 1.635 -0.858) 1.925 24.731 ( 0.684 -1.471 -1.271) 2.061 26.033 ( 1.462 1.972 3.040) 3.908 26.342 ( -0.122 -9.959 2.316) 10.225 26.849 ( -2.775 14.691 5.357) 15.882 26.928 ( 0.324 0.442 -1.042) 1.177 27.002 ( 0.493 -0.689 3.920) 4.011 27.067 ( 5.130 3.440 -0.126) 6.177 27.097 ( -0.746 -0.365 3.754) 3.845 27.900 ( -9.562 -13.064 8.470) 18.271 29.082 ( -3.725 10.967 -20.446) 23.499 29.793 ( -5.626 -8.312 -26.358) 28.204 32.432 ( -2.953 1.979 3.667) 5.108 32.537 ( -1.484 -0.774 -3.804) 4.156 ======================= Grid point 181 (101/150) ======================= q-point: ( 0.45 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.368 ( -20.407 4.270 12.494) 24.306 2.854 ( 17.951 -11.340 -11.486) 24.140 2.932 ( 6.397 -9.024 -12.962) 17.040 3.134 ( -18.071 -22.628 -10.276) 30.728 3.510 ( -3.475 5.165 6.956) 9.335 3.548 ( -6.920 5.085 4.746) 9.812 3.969 ( -11.085 13.418 -4.664) 18.018 4.083 ( 3.567 -1.556 5.159) 6.462 4.235 ( -13.117 2.569 -20.141) 24.172 4.365 ( -2.310 -0.030 8.811) 9.109 4.613 ( -5.167 1.800 -3.728) 6.621 4.810 ( 1.383 8.002 -6.125) 10.172 5.079 ( -9.854 -4.254 -16.410) 19.608 5.238 ( -1.191 2.875 -12.892) 13.263 5.366 ( -2.250 -2.422 -3.293) 4.666 5.895 ( 6.404 -8.115 -6.890) 12.423 5.994 ( -6.097 9.067 -5.572) 12.265 6.321 ( -1.473 7.767 -6.120) 9.997 6.510 ( -7.652 -1.419 -9.333) 12.152 6.579 ( -4.985 -0.957 -11.856) 12.897 7.063 ( -10.539 -4.123 5.529) 12.595 7.203 ( 1.352 -3.262 -0.400) 3.553 7.810 ( 3.371 4.636 -0.011) 5.732 7.913 ( 5.239 3.640 1.332) 6.517 8.140 ( 3.365 -1.467 1.304) 3.896 8.276 ( -0.731 -6.118 -4.928) 7.890 8.860 ( -1.691 4.480 1.895) 5.150 9.103 ( 0.093 -1.197 -8.358) 8.444 9.701 ( -1.906 2.170 9.860) 10.274 9.972 ( 1.910 -4.922 10.589) 11.832 10.369 ( -3.749 6.286 -1.682) 7.510 10.692 ( -6.175 -3.699 -11.627) 13.675 10.747 ( -2.018 0.518 -2.402) 3.180 10.888 ( -5.769 2.294 -6.530) 9.010 12.034 ( -1.588 7.399 5.770) 9.516 12.058 ( -0.226 0.595 0.274) 0.693 12.322 ( 8.692 -2.861 -3.942) 9.964 12.513 ( 13.791 3.812 -5.225) 15.232 12.819 ( 8.023 -11.472 5.253) 14.952 13.238 ( -2.831 -14.989 -5.985) 16.386 13.429 ( 4.716 4.743 4.194) 7.895 13.558 ( 1.051 1.186 0.437) 1.644 14.517 ( 4.950 2.241 9.432) 10.886 14.649 ( 3.004 2.633 8.634) 9.514 14.803 ( 3.096 -0.416 1.781) 3.595 15.089 ( 6.425 -4.788 8.456) 11.649 15.583 ( -3.567 4.850 -7.830) 9.877 15.701 ( 0.882 7.054 4.251) 8.283 15.836 ( -14.038 -1.019 -0.406) 14.081 16.034 ( -5.973 -2.735 -2.657) 7.087 19.192 ( -3.413 0.468 3.983) 5.266 19.282 ( 1.985 -1.529 -0.947) 2.678 24.629 ( 3.290 1.644 -2.403) 4.393 24.757 ( 2.770 -1.548 -5.254) 6.138 26.067 ( 1.017 1.365 6.708) 6.921 26.311 ( -4.864 -7.904 4.576) 10.347 26.710 ( -5.848 9.639 -0.900) 11.310 26.965 ( -2.689 -1.505 -2.973) 4.282 27.019 ( 2.159 0.607 4.696) 5.203 27.080 ( 2.055 0.873 1.185) 2.528 27.272 ( 10.909 3.644 8.829) 14.500 27.828 ( 0.143 -10.015 14.995) 18.033 28.893 ( -10.983 11.036 -24.374) 28.923 29.586 ( -9.948 -7.383 -27.587) 30.241 32.395 ( -1.540 1.928 2.510) 3.519 32.543 ( 2.934 -1.814 -3.737) 5.085 ======================= Grid point 182 (102/150) ======================= q-point: (-0.45 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.090 ( -9.684 4.830 8.994) 14.072 2.680 ( -22.379 -18.797 -9.846) 30.840 2.982 ( 0.538 -18.055 -10.408) 20.847 3.100 ( 4.602 -18.144 -7.935) 20.330 3.290 ( -16.134 9.902 6.964) 20.170 3.457 ( -7.995 11.081 1.059) 13.705 3.656 ( -23.818 7.106 -5.503) 25.458 3.919 ( 2.609 13.074 -4.534) 14.081 4.129 ( -0.360 -0.753 0.635) 1.049 4.481 ( -1.322 -5.671 1.507) 6.015 4.557 ( 4.435 0.759 -5.046) 6.761 4.825 ( -4.690 -1.916 -9.398) 10.677 4.905 ( 1.047 8.234 2.133) 8.570 5.144 ( -1.550 13.068 -12.622) 18.234 5.446 ( 3.034 -7.765 -2.706) 8.765 5.760 ( -7.767 10.206 -1.753) 12.945 6.047 ( 10.480 -11.463 -8.061) 17.499 6.300 ( -6.754 -3.684 -7.851) 10.992 6.392 ( -5.206 -1.792 -5.962) 8.115 6.547 ( 6.506 0.977 -4.488) 7.964 6.984 ( 1.654 2.822 3.299) 4.646 7.205 ( -1.010 -0.927 2.400) 2.764 7.855 ( 1.383 2.940 0.836) 3.355 8.006 ( 3.514 0.863 -2.927) 4.654 8.157 ( -2.032 -2.802 1.291) 3.694 8.214 ( -3.577 -2.410 -4.832) 6.477 8.890 ( 4.142 2.216 1.110) 4.828 9.114 ( 2.567 -1.785 -7.618) 8.234 9.725 ( 2.231 3.492 10.613) 11.393 10.027 ( 1.927 -4.810 10.751) 11.934 10.334 ( 0.383 7.609 -3.067) 8.213 10.549 ( -5.937 -2.098 -13.711) 15.088 10.647 ( -5.832 1.658 -1.355) 6.212 10.845 ( 1.689 0.481 -3.729) 4.122 11.983 ( -3.875 7.312 5.337) 9.847 12.110 ( 4.415 4.728 -3.387) 7.301 12.488 ( 8.073 -4.402 -4.653) 10.306 12.742 ( 10.073 1.180 -5.928) 11.747 12.981 ( 8.513 -14.346 0.867) 16.704 13.215 ( 2.049 -14.540 -8.122) 16.780 13.518 ( 3.890 2.547 2.850) 5.454 13.550 ( -1.691 2.036 0.330) 2.668 14.588 ( 0.158 4.651 8.595) 9.774 14.712 ( 0.963 6.611 12.080) 13.805 14.829 ( -0.709 -2.178 1.357) 2.662 15.237 ( 6.292 -7.485 11.363) 14.991 15.453 ( -7.411 2.604 -9.337) 12.202 15.575 ( -10.293 0.701 -1.705) 10.456 15.772 ( 4.277 5.488 6.911) 9.807 15.965 ( -0.873 -0.887 -3.480) 3.696 19.141 ( -2.501 2.606 3.215) 4.836 19.342 ( 4.354 -2.328 -0.326) 4.948 24.723 ( 6.930 1.264 -3.618) 7.920 24.818 ( 4.913 -1.076 -8.586) 9.951 26.096 ( 0.044 -0.237 9.257) 9.260 26.151 ( -11.616 -1.590 5.929) 13.139 26.686 ( 2.571 2.214 2.859) 4.437 26.820 ( -8.813 -1.782 -4.458) 10.036 27.118 ( 6.638 0.905 1.054) 6.782 27.172 ( 6.463 -0.182 0.589) 6.492 27.500 ( 9.992 4.423 12.867) 16.881 27.932 ( 5.496 -7.622 18.188) 20.472 28.571 ( -16.749 12.142 -24.309) 31.920 29.313 ( -12.004 -7.770 -27.720) 31.190 32.385 ( 0.170 2.945 1.586) 3.349 32.632 ( 6.995 -3.191 -4.835) 9.082 ======================= Grid point 183 (103/150) ======================= q-point: (-0.36 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.975 ( -8.549 -1.082 8.241) 11.924 2.346 ( -5.662 -7.135 -5.270) 10.524 2.797 ( -18.072 -3.507 5.335) 19.167 2.881 ( -17.519 -2.313 -2.284) 17.818 3.064 ( -13.185 14.423 18.134) 26.659 3.325 ( -4.381 -7.912 3.125) 9.569 3.477 ( 8.157 -9.858 -9.043) 15.668 4.044 ( 5.233 1.429 2.075) 5.808 4.144 ( 2.991 3.164 -2.253) 4.903 4.438 ( -1.349 -1.628 0.214) 2.125 4.564 ( -14.810 -9.094 6.966) 18.723 4.603 ( -1.545 -0.226 -4.229) 4.508 5.075 ( 9.752 17.837 -3.158) 20.573 5.140 ( 1.676 16.956 -3.418) 17.378 5.417 ( 0.792 5.592 -6.408) 8.542 5.804 ( 7.594 0.703 -1.518) 7.776 6.145 ( -6.124 -4.476 -7.676) 10.792 6.218 ( 3.130 -3.829 -1.791) 5.260 6.291 ( 0.207 -6.496 -5.333) 8.407 6.657 ( 5.807 -10.631 1.744) 12.239 7.077 ( 2.825 4.143 0.273) 5.022 7.220 ( 4.293 1.031 3.912) 5.899 7.883 ( 1.681 -1.934 -1.301) 2.874 7.954 ( -7.462 -1.435 -1.351) 7.718 8.118 ( -2.975 -1.047 -5.217) 6.096 8.172 ( 2.066 -0.231 -5.212) 5.611 8.993 ( 5.678 0.716 -0.291) 5.730 9.158 ( 3.076 -1.345 -5.831) 6.729 9.821 ( 5.144 4.001 10.679) 12.511 10.102 ( 3.795 -3.638 11.290) 12.454 10.348 ( 0.558 4.049 -5.354) 6.736 10.417 ( -4.271 -0.246 -12.826) 13.520 10.590 ( 1.221 5.646 3.073) 6.543 10.919 ( 6.476 -0.703 -3.026) 7.182 11.917 ( -3.684 5.276 2.658) 6.962 12.177 ( 2.783 8.251 -3.886) 9.536 12.580 ( 2.099 -6.948 -2.158) 7.572 12.874 ( 5.010 -0.195 -3.152) 5.922 13.138 ( 6.722 -13.925 -1.767) 15.564 13.277 ( 5.816 -12.442 -11.328) 17.803 13.499 ( -3.124 4.189 -0.710) 5.274 13.608 ( 5.689 1.556 -2.940) 6.590 14.556 ( -4.886 3.880 6.311) 8.874 14.709 ( -4.066 3.835 8.197) 9.921 14.788 ( -4.155 1.667 5.402) 7.016 15.243 ( -8.693 -2.084 2.034) 9.168 15.304 ( -3.941 -3.920 -10.699) 12.057 15.558 ( 8.351 -2.905 7.449) 11.562 15.886 ( 5.027 3.783 4.315) 7.629 15.990 ( 5.084 2.735 -0.528) 5.797 19.114 ( -0.757 5.194 2.672) 5.890 19.446 ( 6.155 -3.163 0.268) 6.925 24.876 ( 9.656 0.577 -4.755) 10.779 24.910 ( 6.516 -0.224 -10.614) 12.457 25.912 ( -12.844 1.711 7.374) 14.909 26.129 ( 0.429 -4.104 10.266) 11.065 26.665 ( -5.223 1.619 -2.006) 5.824 26.782 ( 5.449 -1.565 5.244) 7.723 27.263 ( 8.027 0.306 -2.480) 8.407 27.306 ( 6.778 -0.474 -0.878) 6.851 27.701 ( 7.735 4.343 15.383) 17.758 27.985 ( -10.345 -0.938 -6.524) 12.266 28.247 ( -5.843 8.587 3.705) 11.027 29.036 ( -10.297 -9.391 -25.069) 28.683 32.407 ( 1.764 4.685 1.121) 5.130 32.784 ( 9.731 -4.723 -6.914) 12.838 ======================= Grid point 184 (104/150) ======================= q-point: (-0.27 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( -7.369 -0.014 11.500) 13.658 2.328 ( -1.778 8.152 9.520) 12.659 2.545 ( -9.822 0.820 24.457) 26.368 2.675 ( -4.534 1.665 14.014) 14.823 2.918 ( 1.731 9.960 8.955) 13.505 3.331 ( -1.821 -17.287 12.182) 21.226 3.630 ( 7.790 -16.373 -2.203) 18.265 4.047 ( -6.661 -12.726 6.205) 15.647 4.243 ( 6.073 3.978 -2.020) 7.536 4.285 ( -6.602 -6.896 8.104) 12.523 4.459 ( 1.965 4.354 -0.961) 4.872 4.614 ( 1.859 -2.506 -1.424) 3.430 5.115 ( -5.021 22.563 8.065) 24.482 5.244 ( 9.620 25.299 -6.878) 27.926 5.542 ( 11.373 9.072 -2.858) 14.826 5.885 ( -0.581 -2.700 -8.128) 8.584 6.052 ( -2.141 1.030 -7.218) 7.599 6.179 ( -0.586 1.310 8.040) 8.167 6.360 ( 2.577 -6.601 0.466) 7.101 6.853 ( 14.233 -18.625 -2.285) 23.552 7.048 ( -4.163 -1.145 1.747) 4.658 7.333 ( 3.005 -1.223 7.542) 8.210 7.762 ( -9.342 -1.985 -8.707) 12.923 7.917 ( -1.576 -7.347 -4.565) 8.792 8.067 ( 1.179 0.825 -2.799) 3.147 8.229 ( 4.911 1.896 -3.156) 6.138 9.094 ( 4.831 1.001 -1.007) 5.035 9.204 ( 2.897 -0.813 -4.710) 5.589 9.950 ( 5.484 3.875 9.790) 11.872 10.223 ( 4.992 -3.976 6.771) 9.305 10.296 ( -0.756 0.843 -2.520) 2.763 10.392 ( 2.628 -0.438 -7.103) 7.587 10.712 ( 9.299 8.661 4.983) 13.650 11.072 ( 9.693 -1.576 -3.119) 10.303 11.855 ( -2.969 2.283 -0.666) 3.804 12.196 ( -0.024 10.232 -2.035) 10.432 12.577 ( -1.364 -8.527 -2.533) 9.000 12.924 ( 0.389 -0.091 0.652) 0.765 13.233 ( 4.001 -11.868 -2.082) 12.696 13.335 ( 0.554 -8.396 -5.310) 9.950 13.434 ( -2.798 8.581 -3.235) 9.588 13.731 ( 8.272 2.196 -13.200) 15.731 14.426 ( -9.683 1.736 2.353) 10.115 14.596 ( -8.050 -2.257 0.110) 8.361 14.672 ( -9.369 8.031 9.723) 15.710 15.034 ( -11.663 1.528 -7.859) 14.146 15.300 ( 5.950 -9.201 -8.091) 13.621 15.739 ( 5.403 -12.033 9.160) 16.059 16.000 ( 8.955 7.582 -1.969) 11.897 16.166 ( 11.237 3.713 5.737) 13.152 19.123 ( 1.151 7.864 2.243) 8.258 19.567 ( 5.900 -3.779 0.113) 7.007 25.012 ( 5.728 0.858 -10.187) 11.719 25.069 ( 11.054 -0.511 -6.175) 12.672 25.710 ( -8.935 3.245 7.877) 12.345 26.151 ( -0.289 -11.854 7.907) 14.253 26.648 ( 4.010 8.026 4.297) 9.948 26.883 ( 3.017 -1.751 3.817) 5.171 27.367 ( -4.054 0.089 -8.850) 9.735 27.393 ( 4.137 -0.729 -4.358) 6.053 27.587 ( -15.718 12.306 -17.212) 26.358 27.860 ( 5.569 2.533 16.261) 17.374 28.317 ( 3.544 -0.609 23.121) 23.399 28.854 ( -3.091 -11.604 -16.981) 20.798 32.454 ( 2.791 6.767 1.167) 7.412 32.964 ( 10.234 -6.127 -9.690) 15.367 ======================= Grid point 185 (105/150) ======================= q-point: (-0.18 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( 2.296 12.328 5.242) 13.592 2.424 ( -9.322 3.804 22.462) 24.616 2.476 ( 11.908 6.944 26.343) 29.731 2.646 ( 1.184 2.520 27.964) 28.103 3.190 ( -10.404 -8.890 25.295) 28.759 3.213 ( 16.561 -12.740 4.664) 21.409 3.731 ( 0.718 -9.444 5.087) 10.751 3.945 ( -1.682 -14.698 9.904) 17.803 4.283 ( 3.190 1.176 1.472) 3.705 4.420 ( 10.667 -2.019 2.197) 11.076 4.511 ( 3.664 4.050 0.818) 5.523 4.665 ( 3.130 -1.784 -2.662) 4.479 5.014 ( -5.235 22.794 13.860) 27.185 5.429 ( 10.208 23.598 -6.981) 26.642 5.761 ( 7.008 1.713 -0.497) 7.231 5.800 ( -3.389 -0.987 -2.723) 4.458 6.011 ( 2.307 8.340 -8.223) 11.938 6.252 ( 4.025 1.566 11.167) 11.973 6.404 ( 2.128 -5.906 2.171) 6.643 6.940 ( -5.696 1.532 -0.638) 5.933 7.153 ( 14.929 -18.091 0.488) 23.460 7.341 ( -4.076 -11.529 13.892) 18.507 7.555 ( -9.433 -1.460 -10.994) 14.560 7.811 ( -6.218 -7.184 -6.878) 11.730 8.116 ( 2.006 4.679 0.213) 5.096 8.376 ( 9.757 0.244 1.488) 9.873 9.183 ( 4.865 1.504 -1.023) 5.194 9.265 ( 4.769 -0.655 -4.360) 6.495 10.057 ( 3.555 3.695 8.628) 10.036 10.215 ( -0.073 0.643 -5.929) 5.964 10.460 ( 5.799 -2.601 -4.697) 7.903 10.467 ( 11.044 -5.772 10.081) 16.029 10.921 ( 10.408 7.520 5.055) 13.799 11.264 ( 10.447 -2.272 -3.670) 11.304 11.799 ( -2.434 -1.052 -3.555) 4.435 12.174 ( -1.889 6.612 -1.470) 7.032 12.540 ( -1.236 -3.508 -3.165) 4.884 12.900 ( -3.018 0.512 3.258) 4.471 13.256 ( -4.300 -2.668 1.929) 5.416 13.309 ( 1.803 -7.118 -2.295) 7.693 13.381 ( -2.766 9.101 -4.996) 10.744 13.855 ( 7.442 3.397 -17.327) 19.161 14.186 ( -15.143 -0.021 -2.262) 15.311 14.392 ( -12.868 -2.227 -3.115) 13.425 14.507 ( -8.214 8.902 5.097) 13.141 14.772 ( -13.259 4.100 -9.833) 17.009 15.472 ( 12.006 -12.963 -8.093) 19.434 15.788 ( -0.225 -14.065 2.419) 14.273 16.218 ( 11.919 6.895 0.763) 13.791 16.419 ( 13.633 0.375 2.130) 13.803 19.164 ( 2.438 9.809 1.860) 10.277 19.649 ( 1.908 -3.597 -1.068) 4.209 25.060 ( 0.259 2.305 -4.368) 4.946 25.259 ( 9.347 -2.864 -7.737) 12.467 25.628 ( -0.140 3.934 3.182) 5.062 26.138 ( -2.999 -16.342 3.144) 16.910 26.820 ( 6.784 6.474 5.505) 10.874 26.858 ( -9.146 0.856 -3.827) 9.951 27.018 ( -8.440 15.654 -5.281) 18.552 27.432 ( 0.870 -1.445 -5.522) 5.774 27.518 ( 0.883 5.015 -7.035) 8.685 27.979 ( 3.003 -0.426 14.829) 15.136 28.422 ( 2.555 -0.783 23.814) 23.963 28.866 ( 6.527 -13.241 -6.429) 16.102 32.514 ( 2.936 8.728 1.700) 9.364 33.119 ( 7.457 -6.918 -12.553) 16.157 ======================= Grid point 186 (106/150) ======================= q-point: (-0.09 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.931 ( 12.536 20.754 1.505) 24.293 2.243 ( -9.110 2.281 9.053) 13.044 2.570 ( -15.490 -11.210 26.669) 32.815 2.889 ( 18.601 -3.235 27.739) 33.554 3.196 ( 9.544 0.998 33.079) 34.443 3.566 ( 12.795 -3.779 -0.959) 13.376 3.675 ( -4.172 1.961 12.325) 13.159 3.993 ( 2.515 -8.282 16.576) 18.700 4.331 ( 0.545 3.389 2.178) 4.065 4.615 ( 7.897 2.065 -1.027) 8.227 4.643 ( 8.724 -7.537 5.511) 12.779 4.671 ( -0.678 5.705 -1.424) 5.919 5.083 ( 9.881 6.343 8.893) 14.730 5.548 ( 1.709 12.270 -7.734) 14.605 5.670 ( -5.561 -2.311 -4.781) 7.689 5.864 ( 4.270 7.352 3.598) 9.232 6.188 ( 13.616 8.368 2.056) 16.114 6.341 ( 2.861 1.068 6.891) 7.537 6.450 ( 1.861 -4.153 1.468) 4.781 6.856 ( -1.618 1.002 4.729) 5.098 7.218 ( -9.731 -10.139 7.345) 15.856 7.409 ( 0.352 -8.855 4.492) 9.935 7.427 ( 7.861 -11.527 2.487) 14.173 7.690 ( -4.767 -8.566 -4.716) 10.879 8.129 ( -0.893 10.310 2.592) 10.669 8.546 ( 5.931 -0.046 3.962) 7.132 9.270 ( 3.831 -0.614 -0.564) 3.921 9.385 ( 8.558 0.909 -4.573) 9.746 10.123 ( 1.577 3.964 7.552) 8.674 10.249 ( 4.640 1.505 -2.903) 5.676 10.552 ( 4.184 -3.892 -4.694) 7.394 10.677 ( 7.060 -7.652 0.917) 10.452 11.108 ( 7.226 5.791 5.718) 10.884 11.444 ( 8.510 -2.790 -3.794) 9.727 11.755 ( -0.519 -5.204 -4.879) 7.152 12.112 ( -3.967 -3.479 -4.198) 6.743 12.530 ( 0.375 6.301 -0.647) 6.345 12.828 ( -5.220 1.918 5.229) 7.633 13.151 ( -7.174 9.726 4.382) 12.855 13.300 ( -2.783 4.937 -4.063) 6.973 13.369 ( 4.308 -6.558 -0.888) 7.896 13.839 ( -17.695 -2.411 -4.512) 18.420 13.908 ( -3.422 3.813 -15.216) 16.056 14.132 ( -9.425 -3.064 -8.220) 12.876 14.410 ( -2.509 9.475 -1.210) 9.876 14.507 ( -10.590 7.846 -8.507) 15.686 15.645 ( 3.758 -11.915 -1.100) 12.542 15.791 ( 3.258 -12.394 -7.766) 14.984 16.422 ( 8.672 4.244 0.727) 9.682 16.673 ( 12.065 -4.673 -5.759) 14.162 19.217 ( 2.525 9.873 1.979) 10.381 19.615 ( -5.145 -1.914 -1.459) 5.680 25.010 ( -4.710 3.101 3.382) 6.576 25.347 ( -0.639 -6.587 -6.268) 9.115 25.703 ( 6.726 4.291 -3.998) 8.924 26.004 ( -9.309 -7.035 -3.795) 12.270 26.616 ( -4.526 6.014 -1.696) 7.716 26.768 ( -6.408 -0.808 -2.118) 6.797 27.278 ( 14.892 5.045 4.567) 16.373 27.411 ( -2.153 -1.038 -5.813) 6.285 27.541 ( 8.032 9.190 1.521) 12.300 28.008 ( -3.354 -0.124 12.126) 12.582 28.524 ( 3.365 -0.506 21.094) 21.367 29.057 ( 13.465 -14.769 -1.982) 20.084 32.568 ( 2.082 9.975 2.568) 10.508 33.179 ( 1.210 -6.370 -13.923) 15.359 ======================= Grid point 187 (107/150) ======================= q-point: ( 0.00 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.126 ( -5.024 2.165 12.260) 13.426 2.178 ( -8.337 -1.475 16.488) 18.535 2.744 ( 19.914 21.392 -1.915) 29.289 3.089 ( 11.862 -12.027 12.082) 20.769 3.537 ( 5.768 -4.465 16.170) 17.739 3.557 ( 11.112 -5.189 24.444) 27.348 3.792 ( 0.456 16.856 1.518) 16.930 4.077 ( 5.537 -10.504 7.055) 13.812 4.424 ( 0.298 5.838 2.538) 6.373 4.538 ( 3.003 -6.488 2.093) 7.450 4.726 ( -1.056 4.792 -1.765) 5.215 4.820 ( 6.178 -3.176 -4.621) 8.343 5.458 ( -0.938 8.880 5.052) 10.259 5.530 ( -6.502 -0.755 -3.930) 7.635 5.599 ( 1.166 11.543 10.090) 15.376 5.967 ( 3.022 -18.449 14.651) 23.752 6.351 ( 0.287 1.839 5.431) 5.741 6.398 ( 0.695 -0.943 3.828) 4.003 6.655 ( 7.861 10.348 4.564) 13.773 6.850 ( 1.989 -11.384 9.240) 14.796 7.038 ( 5.819 8.629 4.147) 11.203 7.251 ( -0.646 -7.202 7.359) 10.317 7.406 ( 7.023 -6.122 1.928) 9.514 7.475 ( 1.268 -7.822 -5.398) 9.588 8.344 ( -1.488 12.326 0.039) 12.416 8.537 ( -1.127 -7.897 1.363) 8.092 9.384 ( 2.739 6.620 0.070) 7.165 9.497 ( 4.754 -4.449 -2.762) 7.072 10.251 ( 0.468 5.908 3.167) 6.720 10.345 ( 2.396 -3.641 0.088) 4.359 10.549 ( 3.249 2.239 -5.257) 6.574 10.627 ( 2.918 -5.053 -5.947) 8.332 11.300 ( -2.769 7.777 3.785) 9.081 11.450 ( -0.601 -7.506 0.933) 7.587 11.708 ( 2.107 0.824 -7.923) 8.240 11.808 ( -2.110 -9.325 -9.698) 13.618 12.683 ( -5.526 5.870 8.133) 11.452 12.739 ( -7.928 -0.584 10.968) 13.546 13.233 ( -9.940 10.885 0.083) 14.741 13.332 ( 0.550 -1.636 -0.484) 1.792 13.434 ( 3.868 1.433 -2.307) 4.726 13.488 ( -2.688 -2.964 -4.620) 6.112 13.774 ( -7.836 5.351 -11.741) 15.096 13.903 ( -3.746 -8.152 -13.892) 16.537 14.446 ( -8.750 12.239 1.552) 15.124 14.613 ( -3.328 -2.189 0.870) 4.077 15.518 ( 6.372 3.390 -10.013) 12.343 15.703 ( 10.941 -12.672 -12.329) 20.791 16.594 ( 1.968 3.845 -2.407) 4.945 16.688 ( 2.609 -6.346 -5.560) 8.831 19.397 ( -2.121 5.942 1.727) 6.541 19.466 ( -5.640 -1.664 1.209) 6.003 24.982 ( -7.165 4.546 5.747) 10.249 25.079 ( -9.855 -5.691 3.728) 11.975 25.884 ( 5.047 2.283 -6.597) 8.614 25.912 ( 3.383 -0.737 -8.225) 8.924 26.643 ( 1.165 0.528 0.436) 1.351 26.655 ( -1.545 -0.720 0.132) 1.709 27.313 ( -4.590 0.202 -3.922) 6.041 27.317 ( -5.018 -0.281 -4.160) 6.524 27.966 ( -2.553 4.289 9.634) 10.850 28.019 ( 7.933 -0.453 9.466) 12.359 28.734 ( 11.446 10.719 8.981) 18.072 29.016 ( 15.864 -18.499 1.934) 24.446 32.806 ( -0.553 11.274 -3.571) 11.839 32.990 ( -2.967 -8.291 -8.825) 12.468 ======================= Grid point 188 (108/150) ======================= q-point: ( 0.09 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( 1.020 6.981 12.700) 14.528 2.209 ( 9.964 -3.648 -4.163) 11.398 3.033 ( 4.968 24.047 13.455) 28.000 3.318 ( 10.323 -6.889 8.957) 15.306 3.634 ( 5.535 4.300 0.537) 7.029 3.707 ( 1.837 -6.192 10.207) 12.078 3.797 ( -2.381 6.959 5.509) 9.190 4.088 ( -5.861 -15.478 2.557) 16.747 4.450 ( 3.224 8.792 -0.553) 9.381 4.582 ( 0.936 3.222 7.656) 8.359 4.752 ( 3.998 -3.542 0.072) 5.342 4.893 ( 2.314 -8.956 -1.855) 9.435 5.345 ( -7.840 3.179 -1.444) 8.582 5.395 ( -7.304 -2.257 -0.144) 7.646 5.758 ( 9.043 13.830 8.900) 18.769 6.087 ( 6.249 -17.323 11.119) 21.512 6.343 ( -1.999 2.834 3.370) 4.836 6.402 ( -0.418 -1.595 2.241) 2.782 6.809 ( 5.100 3.935 5.068) 8.196 6.913 ( 1.040 -8.056 2.202) 8.416 7.148 ( 4.925 8.576 2.332) 10.161 7.270 ( 4.180 -2.956 5.456) 7.482 7.516 ( 6.252 -2.367 -1.999) 6.977 7.589 ( 7.888 -9.695 -3.510) 12.982 8.284 ( -4.830 10.366 -0.362) 11.441 8.457 ( -7.292 -7.591 1.466) 10.627 9.392 ( -2.013 7.002 -0.864) 7.337 9.510 ( -2.854 -4.637 -3.298) 6.366 10.217 ( -5.266 5.014 1.346) 7.395 10.285 ( -8.910 -2.147 -3.959) 9.984 10.627 ( 3.759 2.874 -5.410) 7.187 10.654 ( 5.291 -0.177 -5.160) 7.393 11.165 ( -9.971 5.976 2.060) 11.806 11.323 ( -10.774 -10.342 -1.220) 14.984 11.784 ( 5.795 -0.280 -5.791) 8.197 11.848 ( 6.871 -6.576 -5.104) 10.794 12.546 ( -10.368 2.205 12.666) 16.516 12.562 ( -12.810 0.338 15.748) 20.304 13.039 ( -7.175 14.053 -3.785) 16.226 13.216 ( -4.079 -5.747 -2.316) 7.419 13.502 ( -1.667 6.869 -4.168) 8.206 13.631 ( 2.884 -5.992 -3.491) 7.510 13.704 ( 7.911 7.571 -6.131) 12.549 13.852 ( 4.194 -7.566 -9.082) 12.542 14.360 ( 0.602 8.094 1.173) 8.201 14.542 ( -3.081 -9.081 2.511) 9.912 15.640 ( 7.871 11.599 -11.720) 18.272 15.851 ( 6.321 -7.851 -8.712) 13.323 16.572 ( -3.470 1.924 -3.252) 5.130 16.659 ( -4.369 -6.916 -5.463) 9.836 19.340 ( -4.070 3.158 4.466) 6.818 19.376 ( -3.651 -0.366 3.474) 5.053 24.860 ( -6.455 1.922 6.481) 9.347 24.897 ( -9.089 -2.030 5.203) 10.667 25.956 ( 3.872 1.508 -6.220) 7.481 25.986 ( 5.567 -1.434 -4.265) 7.158 26.671 ( 2.542 1.914 0.465) 3.216 26.704 ( 4.173 -1.544 0.149) 4.452 27.200 ( -5.846 0.089 -0.713) 5.890 27.204 ( -5.719 -0.238 -0.669) 5.763 27.863 ( -8.592 11.438 4.844) 15.103 28.094 ( -2.361 -13.008 6.827) 14.879 29.012 ( 14.887 15.191 0.157) 21.269 29.329 ( 15.779 -18.668 -5.828) 25.128 32.756 ( -3.784 8.263 -2.478) 9.420 32.878 ( -6.520 -4.794 -6.682) 10.495 ======================= Grid point 189 (109/150) ======================= q-point: ( 0.18 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( 9.260 14.788 3.236) 17.746 2.480 ( 17.653 -10.413 -8.051) 22.020 3.010 ( -6.965 29.334 16.938) 34.581 3.458 ( -2.015 -15.455 12.311) 19.861 3.662 ( -5.184 9.357 -2.131) 10.907 3.689 ( -4.234 3.205 7.931) 9.545 3.851 ( 9.846 -8.130 1.978) 12.921 3.934 ( -7.468 -14.490 -2.092) 16.435 4.539 ( 5.356 9.730 -1.947) 11.276 4.617 ( 0.866 7.800 8.034) 11.231 4.826 ( 2.372 -7.253 -1.069) 7.706 4.930 ( 3.307 -11.598 -7.416) 14.158 5.200 ( -6.100 2.692 -3.063) 7.337 5.252 ( -7.180 -3.278 1.549) 8.044 5.920 ( 5.550 14.646 5.174) 16.495 6.191 ( -0.192 -7.414 4.629) 8.742 6.271 ( -6.364 1.972 0.041) 6.663 6.401 ( 1.545 -9.195 -1.598) 9.460 6.825 ( -2.877 0.468 -2.642) 3.934 6.886 ( -2.217 -6.299 -5.127) 8.419 7.262 ( 6.000 11.238 1.346) 12.810 7.417 ( 7.652 -4.979 -0.559) 9.146 7.654 ( 8.088 1.576 -5.172) 9.729 7.722 ( 6.864 -6.433 -2.034) 9.625 8.149 ( -8.572 5.223 -4.278) 10.912 8.264 ( -12.405 -6.185 -1.720) 13.968 9.308 ( -5.987 5.417 -1.746) 8.261 9.394 ( -7.403 -3.024 -3.430) 8.701 10.049 ( -12.087 2.776 -1.147) 12.455 10.062 ( -10.364 0.968 2.620) 10.734 10.670 ( 2.773 7.762 -4.299) 9.297 10.787 ( 4.253 -4.588 -3.495) 7.166 10.995 ( -5.319 3.894 1.635) 6.792 11.112 ( -9.177 -8.519 -0.801) 12.547 11.897 ( 7.016 2.547 -3.224) 8.131 11.995 ( 8.141 -7.682 -1.067) 11.244 12.330 ( -13.234 2.180 16.113) 20.965 12.373 ( -10.439 -2.242 15.593) 18.899 12.915 ( -6.022 19.254 -7.605) 21.560 13.194 ( 0.666 -9.870 -3.915) 10.639 13.404 ( -3.624 7.450 -4.182) 9.281 13.524 ( -7.416 -6.012 -6.014) 11.283 13.936 ( 12.733 3.818 0.687) 13.311 14.052 ( 13.252 -6.556 -1.564) 14.868 14.456 ( 7.692 2.832 1.071) 8.267 14.552 ( 4.187 -6.861 3.369) 8.715 15.751 ( 5.414 13.158 -9.172) 16.928 15.911 ( 1.367 -1.370 -4.156) 4.585 16.458 ( -7.325 -1.443 -3.452) 8.225 16.510 ( -9.575 -6.122 -3.316) 11.839 19.283 ( -2.637 2.366 4.470) 5.703 19.327 ( -2.629 -1.767 4.640) 5.618 24.761 ( -5.974 0.352 3.924) 7.156 24.767 ( -4.356 -0.220 4.874) 6.541 26.014 ( 3.076 3.182 -3.517) 5.653 26.088 ( 5.009 -4.728 -1.212) 6.994 26.740 ( 4.511 3.793 0.790) 5.946 26.791 ( 4.933 -1.881 0.048) 5.280 27.100 ( -4.528 0.364 2.710) 5.290 27.109 ( -4.282 -0.489 3.038) 5.273 27.672 ( -11.354 15.328 0.593) 19.084 27.986 ( -9.135 -17.785 3.767) 20.346 29.256 ( 10.465 15.577 -8.121) 20.448 29.564 ( 10.007 -17.285 -13.566) 24.144 32.660 ( -5.458 5.256 -0.856) 7.625 32.731 ( -7.149 -2.324 -4.478) 8.749 ======================= Grid point 190 (110/150) ======================= q-point: ( 0.27 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( 9.356 19.366 1.352) 21.550 2.765 ( 10.137 -8.661 -4.306) 14.011 2.930 ( -2.699 12.645 3.311) 13.347 3.282 ( -13.768 -16.381 6.221) 22.284 3.517 ( -6.214 6.122 5.195) 10.153 3.654 ( -4.305 -7.425 5.378) 10.128 3.867 ( 1.825 3.535 -1.149) 4.141 4.020 ( 5.605 -9.421 4.818) 11.975 4.577 ( -1.997 9.005 3.456) 9.850 4.666 ( 1.729 5.683 1.705) 6.180 4.829 ( 0.000 -1.967 -7.103) 7.370 4.943 ( -2.081 -5.268 -12.442) 13.671 5.125 ( -2.177 -0.855 -7.282) 7.649 5.171 ( 1.672 -6.341 -1.256) 6.677 5.931 ( -7.497 7.798 0.553) 10.832 6.038 ( -15.739 -4.566 -3.181) 16.694 6.154 ( 0.776 14.705 -10.748) 18.231 6.464 ( 2.831 -15.311 -0.705) 15.587 6.753 ( -2.329 2.572 -7.905) 8.633 6.852 ( 0.827 -8.886 -8.988) 12.666 7.279 ( -7.274 13.676 -3.318) 15.841 7.470 ( -4.201 -5.580 -2.466) 7.408 7.790 ( 6.447 3.606 -4.274) 8.534 7.834 ( 3.596 1.252 -2.992) 4.843 7.996 ( -2.676 -3.349 -3.642) 5.625 8.047 ( -5.257 -5.804 -4.691) 9.129 9.176 ( -7.087 5.055 -0.344) 8.712 9.247 ( -6.798 -2.072 -2.526) 7.542 9.868 ( -6.795 1.708 5.570) 8.951 9.892 ( -7.101 -0.793 6.574) 9.709 10.669 ( -3.406 4.725 -4.917) 7.622 10.736 ( -4.078 -1.227 -0.259) 4.266 10.955 ( -2.896 2.122 -3.239) 4.835 11.050 ( 2.193 -5.815 -2.012) 6.532 12.042 ( 7.762 3.170 -1.512) 8.520 12.087 ( -3.592 -0.117 5.528) 6.594 12.168 ( -3.870 -0.006 6.985) 7.985 12.256 ( -0.462 -8.079 14.300) 16.430 12.763 ( -7.156 21.009 -7.154) 23.319 13.142 ( -5.689 -18.478 -6.603) 20.430 13.393 ( 2.305 5.588 -1.530) 6.235 13.446 ( 1.314 -1.159 -0.751) 1.907 14.173 ( 11.297 3.313 4.014) 12.438 14.285 ( 10.650 -7.529 1.568) 13.136 14.618 ( 8.311 3.381 2.332) 9.270 14.698 ( 8.627 -4.919 4.186) 10.778 15.805 ( 1.681 11.559 -5.692) 12.994 15.898 ( -1.834 3.633 -0.524) 4.103 16.283 ( -10.261 -4.483 -4.360) 12.016 16.298 ( -11.001 -4.794 -1.204) 12.060 19.252 ( -1.568 1.292 3.194) 3.786 19.287 ( -2.432 -2.080 4.156) 5.245 24.679 ( -3.132 1.775 1.385) 3.857 24.711 ( -2.111 -1.620 1.969) 3.310 26.058 ( 1.924 4.272 -0.464) 4.708 26.160 ( 2.417 -6.751 0.353) 7.179 26.853 ( 6.429 3.753 2.876) 7.980 26.897 ( 5.530 -1.407 1.000) 5.793 27.041 ( -2.195 0.780 5.119) 5.624 27.053 ( -1.907 -0.335 4.595) 4.987 27.443 ( -11.805 16.879 -1.342) 20.642 27.786 ( -11.389 -19.046 2.647) 22.348 29.368 ( 3.420 14.956 -15.542) 21.838 29.651 ( 2.520 -15.130 -19.578) 24.871 32.555 ( -5.103 3.200 0.516) 6.045 32.598 ( -5.538 -1.415 -2.811) 6.370 ======================= Grid point 191 (111/150) ======================= q-point: ( 0.36 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.561 ( 4.638 9.955 -1.875) 11.142 2.767 ( -11.663 -6.426 5.809) 14.528 2.876 ( -1.792 6.302 -7.879) 10.247 3.042 ( -11.249 -14.519 -0.915) 18.389 3.538 ( 3.625 0.364 2.934) 4.677 3.592 ( 1.317 -4.653 1.307) 5.009 3.947 ( 5.348 7.425 1.775) 9.321 4.082 ( -0.046 -6.960 7.503) 10.234 4.508 ( -5.405 7.905 -3.339) 10.141 4.601 ( -9.195 -2.041 5.632) 10.974 4.787 ( -3.048 4.366 -20.424) 21.106 4.883 ( 0.949 -2.127 -12.150) 12.371 5.090 ( -0.236 2.390 -5.777) 6.257 5.207 ( -0.080 -7.091 -7.504) 10.324 5.687 ( -16.143 1.648 -12.236) 20.323 5.737 ( -7.434 -3.981 -8.483) 11.961 6.210 ( 4.600 16.714 -5.738) 18.261 6.461 ( -2.516 -9.060 -1.779) 9.570 6.706 ( -1.479 4.918 -11.502) 12.596 6.827 ( -8.402 -4.131 -13.601) 16.512 7.048 ( -6.335 4.145 1.976) 7.824 7.211 ( -17.709 -9.213 0.422) 19.967 7.863 ( 4.504 8.823 -4.809) 11.012 7.924 ( 5.219 5.957 -0.292) 7.926 8.028 ( 3.062 -3.649 0.754) 4.823 8.072 ( 5.349 -9.864 -5.577) 12.531 9.046 ( -6.064 5.576 1.082) 8.309 9.126 ( -5.022 -2.796 -2.417) 6.235 9.781 ( -3.649 2.389 8.967) 9.971 9.841 ( -0.877 -3.774 9.509) 10.269 10.567 ( -4.450 5.379 -4.161) 8.127 10.674 ( -2.536 -5.960 -4.795) 8.059 10.892 ( -3.610 7.597 -2.912) 8.901 11.021 ( -5.011 -4.959 -4.899) 8.585 12.040 ( 1.321 0.397 -0.109) 1.383 12.063 ( -1.725 -2.040 -0.378) 2.698 12.246 ( 7.524 5.860 5.554) 11.037 12.384 ( 7.198 -7.242 9.356) 13.849 12.653 ( -2.100 15.624 -4.678) 16.444 13.005 ( -5.852 -19.952 -5.920) 21.619 13.454 ( 3.440 5.244 1.235) 6.392 13.509 ( 3.610 -0.992 0.506) 3.778 14.388 ( 9.843 3.168 6.963) 12.466 14.477 ( 8.830 -5.551 4.909) 11.527 14.767 ( 5.888 4.488 3.696) 8.275 14.860 ( 6.718 -5.266 5.257) 10.025 15.792 ( -2.193 9.383 -2.928) 10.071 15.855 ( -2.141 5.296 0.572) 5.742 16.048 ( -12.407 -2.911 -2.256) 12.942 16.100 ( -9.263 -6.147 -2.969) 11.507 19.231 ( -1.262 0.428 2.638) 2.955 19.252 ( -1.652 -1.515 2.423) 3.301 24.646 ( -0.187 2.533 -1.238) 2.825 24.694 ( 0.276 -2.435 -1.403) 2.824 26.089 ( 1.025 4.161 2.959) 5.208 26.189 ( 0.467 -6.748 2.644) 7.262 26.941 ( 0.564 0.971 -0.129) 1.130 26.960 ( 0.437 -0.737 -0.328) 0.917 27.044 ( 0.253 2.910 6.281) 6.927 27.080 ( 1.686 -1.289 4.594) 5.061 27.263 ( -3.007 17.306 3.108) 17.838 27.602 ( -6.792 -18.112 6.283) 20.339 29.325 ( -3.869 14.360 -21.352) 26.021 29.587 ( -4.368 -13.331 -23.829) 27.652 32.475 ( -3.148 2.398 0.973) 4.075 32.514 ( -2.528 -1.680 -1.807) 3.532 ======================= Grid point 192 (112/150) ======================= q-point: ( 0.45 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.486 ( -15.456 8.249 6.412) 18.656 2.649 ( 3.076 -9.050 -7.214) 11.975 2.776 ( -5.321 -6.705 -6.625) 10.824 2.795 ( -12.013 -11.230 -12.763) 20.816 3.613 ( 0.366 4.298 5.116) 6.692 3.629 ( 0.282 2.581 3.422) 4.296 4.057 ( -1.505 -0.516 4.901) 5.153 4.067 ( 1.889 -0.332 -0.676) 2.033 4.318 ( -13.578 4.762 -10.383) 17.743 4.374 ( -11.168 -0.846 -0.428) 11.208 4.694 ( -1.590 8.388 -16.203) 18.315 4.868 ( -0.448 -6.805 -22.717) 23.718 5.058 ( -1.890 5.711 -0.613) 6.047 5.180 ( 1.891 -6.110 -0.272) 6.401 5.456 ( -4.434 9.835 -13.835) 17.544 5.673 ( 1.989 -12.804 -10.118) 16.440 6.242 ( -3.305 12.386 -0.234) 12.822 6.382 ( -5.424 -2.131 -0.173) 5.830 6.495 ( -14.082 2.004 -7.442) 16.053 6.573 ( -11.024 -2.286 -11.833) 16.333 7.006 ( -0.701 1.466 3.599) 3.949 7.112 ( 6.035 -6.933 0.057) 9.192 7.931 ( 2.709 7.625 -5.841) 9.980 7.993 ( 1.670 3.985 0.818) 4.398 8.090 ( 2.220 -3.610 3.000) 5.192 8.139 ( 2.279 -7.418 -5.081) 9.275 8.963 ( -2.418 5.831 1.453) 6.477 9.055 ( -1.547 -3.910 -2.560) 4.923 9.764 ( -0.207 4.607 10.268) 11.256 9.866 ( 1.044 -6.069 10.646) 12.299 10.498 ( -1.713 6.797 -6.371) 9.472 10.608 ( -3.199 -5.180 -8.863) 10.752 10.801 ( -4.795 4.821 -2.841) 7.369 10.884 ( -6.244 -2.887 -4.754) 8.362 12.083 ( 4.231 2.457 -4.294) 6.510 12.133 ( 7.388 -0.677 -6.571) 9.911 12.339 ( 1.072 8.315 6.940) 10.883 12.542 ( 6.918 -9.225 7.449) 13.728 12.678 ( 4.906 6.386 -4.421) 9.187 12.923 ( -0.862 -17.014 -5.113) 17.786 13.516 ( 2.485 3.897 2.064) 5.062 13.561 ( 1.530 -0.994 0.931) 2.048 14.575 ( 7.464 3.917 8.454) 11.938 14.648 ( 7.414 -3.102 7.573) 11.042 14.849 ( 1.748 5.662 5.284) 7.939 14.975 ( 4.138 -7.089 7.179) 10.905 15.696 ( -7.282 6.437 -4.260) 10.612 15.794 ( -10.868 -3.769 -1.678) 11.625 15.841 ( -1.669 7.384 0.665) 7.600 15.960 ( -3.936 -5.276 -1.591) 6.772 19.210 ( -1.217 1.517 2.661) 3.295 19.246 ( 0.719 -2.170 0.798) 2.421 24.670 ( 3.152 2.587 -3.499) 5.373 24.718 ( 2.962 -2.530 -4.594) 6.023 26.108 ( -0.188 3.146 6.555) 7.273 26.187 ( -1.930 -5.446 5.867) 8.234 26.852 ( -7.590 5.349 -3.832) 10.045 26.923 ( -5.302 -2.870 -3.525) 6.984 27.051 ( 1.913 2.231 3.729) 4.748 27.082 ( 1.206 -0.805 1.617) 2.172 27.393 ( 9.959 9.617 12.280) 18.506 27.608 ( 4.765 -12.704 13.853) 19.391 29.138 ( -10.431 14.408 -24.724) 30.458 29.395 ( -9.958 -12.700 -26.263) 30.825 32.442 ( -0.474 2.976 0.572) 3.067 32.498 ( 1.248 -2.907 -1.786) 3.633 ======================= Grid point 193 (113/150) ======================= q-point: (-0.45 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.222 ( -12.928 8.964 9.835) 18.553 2.404 ( -17.390 -11.160 -2.453) 20.808 2.716 ( 0.236 -7.031 -15.315) 16.853 2.789 ( 6.506 -13.131 -16.739) 22.247 3.470 ( -13.105 8.630 3.222) 16.019 3.571 ( -10.952 -0.807 1.684) 11.110 3.824 ( -18.262 12.212 -1.328) 22.009 4.023 ( -7.700 -5.359 -2.096) 9.612 4.141 ( 1.288 5.583 2.705) 6.336 4.298 ( -0.897 -10.847 3.923) 11.569 4.651 ( -1.334 7.157 -10.739) 12.974 4.765 ( -6.756 -4.580 -12.274) 14.740 5.102 ( 8.794 11.153 -1.457) 14.278 5.291 ( 8.034 -9.064 -2.904) 12.455 5.441 ( 5.328 17.328 -11.853) 21.660 5.740 ( 6.801 -13.902 -12.423) 19.846 6.058 ( -10.273 14.156 0.935) 17.516 6.275 ( -4.668 1.077 -2.124) 5.240 6.311 ( -9.045 -7.306 -2.380) 11.868 6.395 ( -3.193 -12.787 -0.477) 13.188 7.103 ( 7.083 8.164 0.966) 10.851 7.202 ( 2.352 -1.728 2.603) 3.911 7.927 ( -1.748 4.363 -6.138) 7.731 7.993 ( -1.538 -2.347 -4.042) 4.921 8.114 ( 0.048 -0.932 2.140) 2.335 8.146 ( -0.256 -3.906 -2.596) 4.697 8.966 ( 2.392 5.295 0.860) 5.874 9.058 ( 2.125 -4.186 -2.079) 5.134 9.813 ( 2.953 5.643 10.803) 12.540 9.924 ( 2.799 -6.084 10.985) 12.866 10.457 ( -1.554 4.490 -8.943) 10.127 10.511 ( -4.549 -2.082 -11.415) 12.463 10.717 ( -2.196 5.900 -1.449) 6.460 10.819 ( 0.440 -3.763 -2.851) 4.741 12.141 ( -0.270 8.934 -1.059) 9.000 12.248 ( 5.990 4.918 -6.368) 10.031 12.399 ( 4.563 0.636 1.108) 4.738 12.655 ( 5.485 -18.963 2.363) 19.881 12.796 ( 7.359 5.247 -4.762) 10.216 12.953 ( 4.431 -11.939 -6.110) 14.124 13.563 ( 2.271 1.816 1.083) 3.103 13.575 ( 0.063 0.496 0.406) 0.644 14.679 ( 0.944 4.909 6.444) 8.156 14.764 ( 1.416 -3.988 4.968) 6.526 14.875 ( 0.746 9.764 10.328) 14.233 15.066 ( 3.423 -10.297 10.516) 15.111 15.518 ( -9.201 3.695 -5.236) 11.213 15.570 ( -9.714 -1.550 -3.115) 10.319 15.872 ( 3.407 4.682 2.288) 6.226 15.937 ( 1.445 -2.355 -1.206) 3.015 19.205 ( 0.358 4.125 1.964) 4.583 19.282 ( 2.932 -3.945 0.590) 4.950 24.753 ( 6.391 1.957 -5.314) 8.539 24.790 ( 5.630 -1.842 -7.223) 9.341 26.098 ( -3.005 0.579 8.878) 9.391 26.119 ( -6.538 -1.611 7.867) 10.355 26.733 ( -2.963 2.636 -0.501) 3.998 26.780 ( -6.700 -2.425 -3.071) 7.759 27.139 ( 6.229 1.295 0.752) 6.406 27.161 ( 6.088 -0.951 0.514) 6.184 27.616 ( 9.608 7.802 14.859) 19.338 27.774 ( 7.739 -8.929 16.382) 20.198 28.836 ( -15.206 15.462 -24.716) 32.881 29.111 ( -13.461 -13.550 -26.422) 32.602 32.459 ( 2.248 4.832 -0.320) 5.339 32.553 ( 4.853 -4.981 -2.749) 7.478 ======================= Grid point 194 (114/150) ======================= q-point: (-0.36 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.008 ( -10.293 7.078 10.953) 16.613 2.217 ( -0.646 -11.247 9.212) 14.553 2.671 ( -4.105 -0.733 -10.453) 11.254 2.782 ( -8.092 -8.415 -6.071) 13.158 3.255 ( -4.770 3.838 0.383) 6.134 3.312 ( -9.979 -0.976 -1.154) 10.092 3.512 ( -14.860 18.351 13.143) 27.025 3.897 ( -8.928 -17.792 7.426) 21.247 4.186 ( 2.022 2.628 4.868) 5.890 4.270 ( -2.712 -7.250 6.338) 10.005 4.580 ( -4.545 2.860 -6.055) 8.093 4.606 ( -4.043 -0.166 -6.827) 7.936 5.356 ( 13.828 11.602 -1.736) 18.134 5.454 ( 11.896 5.259 -9.811) 16.292 5.584 ( 9.730 16.887 -8.418) 21.230 5.856 ( 5.100 0.567 -3.341) 6.123 5.949 ( 0.361 -5.247 -14.559) 15.480 6.181 ( -3.508 -8.731 1.867) 9.593 6.221 ( -0.421 1.664 3.861) 4.225 6.358 ( -1.046 -15.792 3.329) 16.173 7.168 ( -2.659 5.641 5.132) 8.076 7.243 ( 1.665 -1.089 5.240) 5.605 7.862 ( -2.917 0.406 -6.573) 7.202 7.904 ( -6.196 -3.327 -8.508) 11.038 8.113 ( -0.222 1.045 -1.800) 2.093 8.149 ( 2.126 -2.129 -2.619) 3.988 9.041 ( 4.706 3.978 0.023) 6.162 9.114 ( 3.624 -3.403 -1.564) 5.211 9.915 ( 5.075 5.664 10.891) 13.284 10.018 ( 4.548 -5.267 11.227) 13.209 10.389 ( -3.580 1.020 -8.688) 9.452 10.406 ( -3.110 -0.893 -11.089) 11.552 10.745 ( 5.017 9.219 0.706) 10.519 10.876 ( 5.617 -4.484 -1.324) 7.308 12.077 ( -5.098 11.745 1.492) 12.891 12.292 ( -1.888 -5.990 -2.120) 6.628 12.496 ( 6.210 8.823 -1.437) 10.884 12.812 ( 8.737 -19.848 -2.004) 21.778 12.911 ( 5.893 4.563 -4.851) 8.893 13.049 ( 6.794 -10.389 -8.579) 15.089 13.577 ( 0.663 3.634 -2.257) 4.329 13.619 ( 4.113 -0.710 -3.319) 5.333 14.633 ( -6.291 4.112 3.473) 8.280 14.701 ( -7.125 -2.946 1.047) 7.781 14.918 ( -0.826 9.864 12.142) 15.666 15.103 ( -2.706 -9.704 7.219) 12.394 15.345 ( -6.892 5.211 -5.824) 10.420 15.460 ( -0.991 -6.594 2.064) 6.980 15.971 ( 6.357 4.154 1.028) 7.664 16.015 ( 7.032 -0.434 0.569) 7.069 19.235 ( 2.346 7.195 1.299) 7.678 19.360 ( 4.865 -5.953 0.427) 7.700 24.889 ( 8.747 0.792 -6.735) 11.068 24.903 ( 7.574 -0.576 -8.957) 11.744 25.961 ( -9.910 3.575 7.890) 13.162 26.041 ( -5.387 -4.900 8.701) 11.346 26.702 ( -0.373 2.269 1.380) 2.682 26.745 ( 3.166 -2.285 3.866) 5.495 27.274 ( 7.185 0.831 -2.034) 7.514 27.292 ( 6.763 -0.989 -1.452) 6.988 27.805 ( 6.424 6.471 14.736) 17.329 27.920 ( 2.591 -5.458 11.067) 12.609 28.490 ( -14.181 16.258 -16.039) 26.883 28.797 ( -12.935 -15.712 -22.307) 30.196 32.524 ( 4.445 7.492 -1.377) 8.819 32.667 ( 7.446 -7.515 -4.400) 11.458 ======================= Grid point 195 (115/150) ======================= q-point: (-0.27 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.968 ( 3.807 17.899 13.023) 22.460 2.378 ( 12.810 -17.239 21.788) 30.594 2.513 ( -9.061 -0.307 5.956) 10.848 2.566 ( -8.651 -2.892 11.505) 14.682 3.081 ( -16.331 11.343 15.114) 24.976 3.314 ( -10.640 -2.277 15.580) 19.003 3.377 ( 10.929 3.186 2.407) 11.636 3.713 ( -6.791 -20.548 11.709) 24.606 4.239 ( 2.379 0.897 3.548) 4.365 4.267 ( 2.209 -1.183 2.873) 3.813 4.531 ( 1.426 3.079 -7.022) 7.798 4.576 ( 1.333 -1.965 -6.086) 6.532 5.511 ( 3.111 18.883 1.655) 19.209 5.713 ( 11.368 4.698 -4.316) 13.036 5.734 ( 7.696 19.531 -11.115) 23.754 5.859 ( -2.162 6.110 -3.421) 7.328 5.993 ( 4.687 -7.147 -8.338) 11.940 6.165 ( 1.397 -6.776 6.924) 9.788 6.282 ( 3.249 0.425 3.353) 4.688 6.441 ( 11.781 -20.102 0.409) 23.303 7.083 ( -6.412 4.431 6.123) 9.912 7.219 ( -5.875 -9.038 10.757) 15.228 7.737 ( -8.489 0.198 -10.451) 13.466 7.787 ( -4.383 -5.276 -7.402) 10.091 8.136 ( 4.044 5.025 -3.208) 7.204 8.216 ( 5.401 -3.024 -3.390) 7.057 9.133 ( 4.736 2.856 -0.642) 5.568 9.180 ( 3.483 -1.895 -1.831) 4.368 10.039 ( 5.212 5.345 9.641) 12.193 10.137 ( 5.155 -5.088 8.916) 11.487 10.318 ( -1.007 1.783 -5.318) 5.698 10.361 ( 0.391 -2.487 -6.190) 6.682 10.889 ( 8.924 9.029 1.969) 12.847 11.017 ( 8.821 -4.703 -0.654) 10.017 11.973 ( -5.555 10.386 -0.645) 11.796 12.201 ( -6.236 -11.712 -0.622) 13.284 12.609 ( 5.192 14.640 -1.332) 15.590 12.895 ( 0.540 -10.149 3.157) 10.643 13.041 ( 7.485 -1.547 -6.192) 9.837 13.151 ( 4.259 -9.706 -5.617) 11.995 13.601 ( 2.629 8.494 -6.537) 11.036 13.720 ( 7.591 -3.722 -10.569) 13.535 14.468 ( -10.904 2.841 -0.199) 11.270 14.532 ( -9.644 -3.881 -1.599) 10.518 14.850 ( -7.566 9.548 5.463) 13.352 15.006 ( -7.527 -6.570 -0.001) 9.991 15.258 ( -0.632 7.446 -3.620) 8.304 15.483 ( 0.666 -14.434 6.403) 15.804 16.131 ( 9.942 5.556 0.373) 11.395 16.192 ( 10.376 -1.001 1.969) 10.608 19.297 ( 3.723 9.900 0.467) 10.588 19.462 ( 5.305 -7.516 -0.171) 9.202 25.032 ( 7.301 1.244 -9.069) 11.709 25.054 ( 9.302 -1.036 -7.584) 12.047 25.800 ( -7.547 6.460 7.462) 12.425 25.949 ( -5.145 -9.634 7.028) 12.987 26.765 ( 5.399 4.851 5.564) 9.145 26.838 ( 4.239 -3.163 4.859) 7.183 27.371 ( 1.504 0.366 -5.980) 6.177 27.381 ( 2.921 -0.619 -4.455) 5.364 27.830 ( -10.078 10.545 -9.308) 17.303 27.904 ( 1.197 1.061 9.595) 9.728 28.349 ( 0.066 6.273 11.614) 13.200 28.579 ( -4.768 -16.326 -9.111) 19.295 32.618 ( 5.555 10.298 -2.426) 11.949 32.811 ( 8.283 -9.929 -6.446) 14.448 ======================= Grid point 196 (116/150) ======================= q-point: (-0.18 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.116 ( 8.267 23.446 0.487) 24.865 2.447 ( -3.096 -3.640 13.571) 14.388 2.578 ( 5.518 1.362 31.664) 32.170 2.720 ( -1.674 -17.227 25.089) 30.480 2.797 ( 1.440 9.711 31.180) 32.689 3.094 ( -8.015 -16.014 19.203) 26.258 3.632 ( 12.135 4.170 7.790) 15.011 3.765 ( 6.129 -7.786 6.742) 11.985 4.298 ( 3.505 1.505 1.375) 4.055 4.354 ( 5.699 -4.218 2.552) 7.535 4.585 ( 4.949 3.070 -5.495) 8.007 4.626 ( 5.225 -1.809 -7.742) 9.513 5.497 ( -4.914 24.707 9.774) 27.020 5.745 ( -3.089 -0.656 -9.567) 10.075 5.792 ( -3.260 5.545 -3.408) 7.279 5.853 ( 2.778 4.436 3.697) 6.408 6.124 ( 8.748 3.719 2.575) 9.849 6.245 ( 4.063 -4.146 8.982) 10.694 6.382 ( 7.644 10.177 -2.032) 12.889 6.740 ( 16.566 -24.329 -3.543) 29.646 6.964 ( -6.581 2.253 5.852) 9.090 7.095 ( -8.178 -12.254 14.569) 20.719 7.552 ( -8.252 2.840 -8.110) 11.913 7.658 ( -6.873 -7.915 -5.982) 12.069 8.244 ( 6.508 7.189 -2.580) 10.034 8.347 ( 8.408 -3.625 -2.293) 9.439 9.220 ( 4.510 2.127 -0.764) 5.045 9.250 ( 4.723 -1.061 -2.354) 5.383 10.143 ( 3.772 5.061 6.702) 9.207 10.215 ( 2.462 -1.692 -1.491) 3.339 10.377 ( 6.387 -2.232 6.168) 9.155 10.400 ( 4.285 -3.347 -2.014) 5.798 11.074 ( 9.231 8.062 2.583) 12.526 11.197 ( 9.547 -5.096 -0.657) 10.842 11.864 ( -5.249 7.966 -3.890) 10.303 12.067 ( -7.016 -12.494 -2.931) 14.626 12.688 ( 3.023 13.901 1.261) 14.282 12.885 ( -2.141 -4.832 4.858) 7.179 13.146 ( 4.632 -3.248 -3.024) 6.415 13.189 ( 1.577 -5.874 -2.354) 6.522 13.619 ( -0.710 13.483 -7.211) 15.307 13.825 ( 3.803 -7.393 -12.135) 14.710 14.226 ( -12.947 4.608 -5.810) 14.920 14.324 ( -11.680 -5.004 -6.057) 14.076 14.702 ( -6.822 10.812 0.499) 12.794 14.837 ( -9.009 -0.871 -2.060) 9.282 15.303 ( 6.148 -0.168 -5.690) 8.379 15.490 ( -0.578 -16.150 3.007) 16.437 16.334 ( 10.317 5.167 0.492) 11.549 16.403 ( 10.686 -2.246 0.482) 10.930 19.369 ( 3.305 11.068 -0.394) 11.557 19.545 ( 2.848 -7.665 -1.149) 8.258 25.119 ( 2.359 3.793 -5.156) 6.822 25.193 ( 5.661 -4.041 -6.374) 9.434 25.729 ( -0.363 6.922 3.222) 7.644 25.890 ( -1.879 -10.758 3.573) 11.490 26.853 ( -1.035 0.631 1.119) 1.650 26.863 ( -3.736 -0.372 -0.613) 3.805 27.300 ( -1.832 9.515 -4.912) 10.863 27.397 ( 0.572 -2.732 -5.468) 6.139 27.702 ( -0.592 14.747 -4.111) 15.320 27.927 ( 0.712 -6.841 7.482) 10.163 28.429 ( 3.568 2.868 18.522) 19.079 28.585 ( 4.775 -14.171 4.357) 15.575 32.718 ( 5.091 12.412 -3.327) 13.822 32.944 ( 6.621 -11.402 -8.466) 15.669 ======================= Grid point 197 (117/150) ======================= q-point: (-0.09 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.262 ( -5.385 4.024 10.705) 12.641 2.352 ( -3.122 -2.789 8.904) 9.839 2.449 ( -5.369 21.056 18.433) 28.495 2.825 ( 11.086 -9.106 19.869) 24.507 3.184 ( 18.367 -0.999 36.526) 40.896 3.287 ( 15.968 -16.405 17.714) 28.946 3.781 ( 1.723 8.653 4.544) 9.924 3.918 ( 8.012 -4.615 8.505) 12.563 4.378 ( 3.914 2.533 2.410) 5.248 4.466 ( 4.361 -7.597 2.889) 9.223 4.690 ( 7.180 3.177 -6.517) 10.204 4.719 ( 4.466 0.075 -7.980) 9.145 5.427 ( -2.972 24.790 16.881) 30.138 5.647 ( -4.994 -1.219 -5.167) 7.288 5.684 ( -6.335 4.542 -1.992) 8.046 5.905 ( 1.174 -10.671 11.379) 15.644 6.284 ( 5.649 1.978 9.899) 11.568 6.337 ( 3.814 -0.759 6.084) 7.221 6.527 ( 6.729 15.799 -4.708) 17.806 6.853 ( -3.065 -9.576 3.144) 10.535 6.952 ( 0.583 -5.636 10.465) 11.900 7.109 ( 10.469 -16.856 7.097) 21.074 7.403 ( -5.434 4.464 -2.415) 7.436 7.529 ( -4.912 -8.302 -3.577) 10.288 8.336 ( 2.841 10.605 -1.556) 11.089 8.491 ( 5.681 -5.916 -0.758) 8.237 9.307 ( 4.612 3.625 -0.174) 5.869 9.369 ( 7.779 -2.462 -2.684) 8.589 10.213 ( 2.332 5.179 4.721) 7.386 10.272 ( 3.977 -0.166 -0.980) 4.100 10.483 ( 4.525 -1.875 -0.920) 4.984 10.531 ( 7.150 -6.563 0.802) 9.738 11.240 ( 6.704 7.665 3.656) 10.819 11.366 ( 7.533 -5.619 -0.169) 9.400 11.757 ( -4.314 5.126 -7.263) 9.882 11.924 ( -6.671 -11.885 -6.462) 15.083 12.724 ( -0.279 9.932 4.603) 10.950 12.835 ( -4.324 -2.025 7.296) 8.719 13.214 ( 4.062 0.639 -1.330) 4.321 13.256 ( 5.676 -4.457 -1.746) 7.425 13.519 ( -8.106 14.105 -4.628) 16.914 13.738 ( -11.693 -8.828 -5.132) 15.525 13.982 ( -9.789 4.245 -12.912) 16.750 14.063 ( -11.514 -4.275 -11.153) 16.590 14.613 ( -5.403 10.484 1.995) 11.962 14.670 ( -5.748 5.984 -2.998) 8.822 15.437 ( 5.663 -6.585 -4.867) 9.956 15.519 ( 7.411 -13.661 -9.874) 18.413 16.507 ( 7.123 4.540 -0.602) 8.469 16.588 ( 8.195 -4.353 -2.850) 9.707 19.410 ( 0.794 9.621 -0.304) 9.659 19.550 ( -2.241 -5.435 -1.126) 5.985 25.092 ( -4.362 5.681 1.834) 7.394 25.214 ( -3.184 -7.263 -1.237) 8.026 25.789 ( 5.560 4.813 -4.542) 8.643 25.884 ( 0.956 -5.703 -3.753) 6.894 26.702 ( -7.628 3.240 -2.747) 8.732 26.746 ( -7.013 -1.692 -2.396) 7.601 27.352 ( 2.454 2.793 -2.929) 4.733 27.389 ( -1.095 -1.425 -5.130) 5.436 27.781 ( 9.318 14.243 6.748) 18.309 27.970 ( 1.064 -5.278 10.835) 12.099 28.550 ( 5.621 4.850 15.948) 17.591 28.747 ( 10.606 -15.968 6.358) 20.196 32.790 ( 2.869 12.892 -3.817) 13.748 33.016 ( 2.329 -10.952 -9.561) 14.723 ======================= Grid point 220 (118/150) ======================= q-point: ( 0.00 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.063 ( 19.130 0.000 -0.174) 19.131 2.070 ( -9.153 0.000 -2.193) 9.412 3.055 ( -16.279 0.000 27.739) 32.163 3.287 ( -20.144 0.000 17.376) 26.603 3.547 ( 9.695 0.000 -14.194) 17.189 3.632 ( 21.572 0.000 -7.048) 22.694 4.079 ( -0.672 0.000 11.370) 11.390 4.261 ( -0.241 0.000 -5.865) 5.870 4.539 ( 4.025 0.000 13.217) 13.816 4.634 ( 0.270 0.000 0.796) 0.841 4.770 ( 3.593 0.000 1.646) 3.952 4.856 ( -1.733 0.000 -5.100) 5.386 5.368 ( 5.966 0.000 3.390) 6.862 5.401 ( -4.867 0.000 3.205) 5.827 5.647 ( 3.341 0.000 -3.200) 4.626 5.686 ( 3.434 0.000 -4.123) 5.366 6.384 ( -0.131 0.000 0.935) 0.944 6.414 ( 3.488 0.000 -1.967) 4.004 6.699 ( 8.239 0.000 10.887) 13.653 6.899 ( -1.447 0.000 -7.898) 8.030 7.243 ( 0.909 0.000 7.866) 7.918 7.442 ( -2.326 0.000 -11.560) 11.791 7.786 ( -4.785 0.000 8.374) 9.645 7.852 ( 8.476 0.000 1.969) 8.701 8.358 ( -1.293 0.000 20.534) 20.575 8.628 ( -1.268 0.000 -4.001) 4.197 9.347 ( 0.742 0.000 -0.275) 0.792 9.389 ( 2.911 0.000 -4.196) 5.107 10.244 ( -1.316 0.000 7.151) 7.271 10.369 ( 9.442 0.000 0.446) 9.452 10.430 ( 1.715 0.000 -7.738) 7.926 10.496 ( -13.567 0.000 -8.117) 15.810 11.296 ( -0.797 0.000 8.056) 8.095 11.453 ( 2.184 0.000 -7.418) 7.733 11.986 ( 2.514 0.000 -1.036) 2.719 11.993 ( 1.678 0.000 -1.364) 2.162 12.456 ( 3.962 0.000 2.277) 4.570 12.541 ( -10.190 0.000 -5.356) 11.512 13.116 ( -6.129 0.000 15.490) 16.659 13.337 ( 9.427 0.000 0.611) 9.447 13.386 ( -6.886 0.000 -10.582) 12.625 13.403 ( -12.490 0.000 -4.407) 13.245 13.611 ( 4.425 0.000 6.819) 8.129 13.820 ( -1.217 0.000 -13.552) 13.607 14.232 ( 2.946 0.000 -1.455) 3.286 14.233 ( 0.276 0.000 -2.040) 2.059 15.782 ( -5.207 0.000 -0.519) 5.233 15.786 ( 1.433 0.000 -0.279) 1.460 16.563 ( 3.041 0.000 3.429) 4.583 16.686 ( 2.185 0.000 -8.768) 9.036 19.302 ( 4.555 0.000 6.548) 7.977 19.421 ( -6.376 0.000 -4.664) 7.899 25.042 ( -1.776 0.000 7.237) 7.452 25.170 ( -5.868 0.000 -5.017) 7.721 25.767 ( 9.263 0.000 -0.788) 9.297 25.786 ( -5.111 0.000 -3.245) 6.054 26.660 ( 3.967 0.000 1.129) 4.124 26.674 ( -2.927 0.000 -0.189) 2.933 27.257 ( -2.529 0.000 -1.596) 2.990 27.258 ( -1.357 0.000 -1.766) 2.227 27.982 ( -17.531 0.000 3.932) 17.967 28.011 ( 24.679 0.000 1.219) 24.709 28.963 ( -4.641 0.000 16.351) 16.997 29.268 ( 10.742 0.000 -13.898) 17.565 32.671 ( 1.812 0.000 9.734) 9.902 32.889 ( -3.895 0.000 -11.939) 12.559 ======================= Grid point 221 (119/150) ======================= q-point: ( 0.09 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.028 ( 6.231 0.000 -12.415) 13.891 2.476 ( 18.956 0.000 3.607) 19.296 2.761 ( -18.822 0.000 32.903) 37.906 2.965 ( -11.642 0.000 3.971) 12.300 3.646 ( 2.778 0.000 -10.090) 10.465 3.905 ( 6.183 0.000 -5.944) 8.577 4.145 ( 6.249 0.000 9.867) 11.680 4.253 ( 0.147 0.000 -6.240) 6.241 4.540 ( -9.474 0.000 2.788) 9.876 4.642 ( 4.720 0.000 3.505) 5.879 4.804 ( -0.016 0.000 -0.143) 0.144 4.826 ( 0.177 0.000 -13.025) 13.026 5.299 ( -5.768 0.000 3.579) 6.788 5.452 ( 2.352 0.000 2.985) 3.800 5.669 ( -0.114 0.000 -9.314) 9.314 5.715 ( 0.182 0.000 -8.086) 8.088 6.393 ( 0.571 0.000 -1.598) 1.697 6.468 ( 2.944 0.000 -4.759) 5.596 6.810 ( -5.902 0.000 -14.831) 15.962 6.860 ( 6.399 0.000 5.180) 8.233 7.342 ( 6.989 0.000 4.992) 8.589 7.406 ( 0.846 0.000 -8.088) 8.132 7.646 ( -10.491 0.000 3.068) 10.931 7.934 ( -0.666 0.000 -2.126) 2.228 8.324 ( -6.035 0.000 19.031) 19.965 8.525 ( -8.064 0.000 -3.820) 8.923 9.313 ( -3.831 0.000 -2.877) 4.791 9.351 ( -5.375 0.000 -6.276) 8.263 10.153 ( -11.066 0.000 2.184) 11.279 10.267 ( -5.778 0.000 3.434) 6.722 10.372 ( -1.100 0.000 -6.654) 6.744 10.627 ( 11.637 0.000 2.195) 11.842 11.220 ( -7.973 0.000 6.954) 10.580 11.399 ( -5.749 0.000 -9.100) 10.764 11.989 ( -0.374 0.000 -2.863) 2.888 11.994 ( -2.655 0.000 -6.838) 7.336 12.379 ( -4.256 0.000 0.322) 4.268 12.572 ( 5.817 0.000 9.278) 10.951 12.964 ( -12.667 0.000 23.678) 26.853 13.208 ( -6.427 0.000 -2.981) 7.085 13.252 ( -2.155 0.000 -1.839) 2.832 13.579 ( 8.121 0.000 -0.050) 8.122 13.802 ( 12.961 0.000 5.596) 14.117 13.825 ( 8.130 0.000 -6.708) 10.540 14.316 ( 7.717 0.000 -3.314) 8.398 14.399 ( 12.912 0.000 -2.749) 13.201 15.642 ( -8.837 0.000 -0.338) 8.844 15.767 ( -3.008 0.000 3.964) 4.976 16.588 ( -0.937 0.000 0.174) 0.953 16.658 ( -3.064 0.000 -11.193) 11.605 19.306 ( -4.354 0.000 -3.469) 5.567 19.399 ( 3.587 0.000 7.760) 8.548 24.995 ( -4.500 0.000 9.684) 10.679 25.000 ( -9.918 0.000 2.164) 10.151 25.770 ( 2.989 0.000 -7.003) 7.614 26.007 ( 15.195 0.000 0.359) 15.199 26.617 ( -2.996 0.000 -1.399) 3.306 26.734 ( 3.812 0.000 0.119) 3.813 27.204 ( -2.735 0.000 2.178) 3.496 27.228 ( -2.274 0.000 2.056) 3.065 27.621 ( -18.707 0.000 -2.491) 18.872 28.416 ( 16.837 0.000 -6.355) 17.996 28.859 ( -9.095 0.000 11.253) 14.469 29.413 ( 7.781 0.000 -20.869) 22.272 32.701 ( -0.989 0.000 11.003) 11.047 32.764 ( -6.350 0.000 -8.972) 10.992 ======================= Grid point 222 (120/150) ======================= q-point: ( 0.18 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.151 ( 2.234 0.000 -8.090) 8.393 2.533 ( -9.200 0.000 13.757) 16.550 2.597 ( 2.811 0.000 20.070) 20.266 3.103 ( 20.750 0.000 -17.952) 27.438 3.629 ( -1.970 0.000 -5.174) 5.536 3.941 ( 0.202 0.000 0.477) 0.518 4.194 ( -7.949 0.000 -2.912) 8.465 4.230 ( -1.561 0.000 2.716) 3.133 4.340 ( -8.605 0.000 -1.417) 8.721 4.735 ( 4.898 0.000 -4.446) 6.615 4.784 ( -1.589 0.000 -0.596) 1.697 4.794 ( -0.446 0.000 -16.641) 16.647 5.204 ( -4.300 0.000 0.784) 4.371 5.430 ( -6.765 0.000 0.167) 6.767 5.611 ( -3.415 0.000 -9.447) 10.045 5.698 ( 1.703 0.000 -8.168) 8.344 6.336 ( -9.211 0.000 -10.756) 14.161 6.507 ( 2.023 0.000 -5.378) 5.745 6.628 ( -6.610 0.000 -14.038) 15.516 6.945 ( 0.747 0.000 -1.007) 1.254 7.424 ( -11.559 0.000 -1.679) 11.681 7.436 ( 2.893 0.000 -3.483) 4.528 7.501 ( 8.129 0.000 2.970) 8.654 7.828 ( -7.842 0.000 -3.827) 8.726 8.240 ( -4.642 0.000 11.734) 12.619 8.328 ( -10.907 0.000 -3.391) 11.422 9.196 ( -8.562 0.000 -3.102) 9.106 9.207 ( -5.639 0.000 -4.477) 7.200 9.990 ( -4.644 0.000 5.277) 7.029 10.177 ( -6.094 0.000 7.911) 9.986 10.359 ( 1.023 0.000 -6.440) 6.521 10.802 ( 5.606 0.000 -4.401) 7.128 11.040 ( -11.414 0.000 5.621) 12.723 11.227 ( -9.186 0.000 -9.789) 13.424 11.887 ( -3.946 0.000 -7.576) 8.542 11.989 ( 0.874 0.000 -1.331) 1.592 12.371 ( 0.947 0.000 5.201) 5.286 12.665 ( -2.697 0.000 13.530) 13.796 12.794 ( -5.253 0.000 23.437) 24.018 13.142 ( -0.437 0.000 2.266) 2.308 13.289 ( 5.042 0.000 0.539) 5.071 13.584 ( -3.124 0.000 -4.501) 5.479 14.090 ( 14.512 0.000 8.082) 16.611 14.127 ( 18.481 0.000 0.579) 18.490 14.475 ( 8.327 0.000 -1.101) 8.400 14.665 ( 14.308 0.000 -1.299) 14.367 15.464 ( -8.488 0.000 -3.601) 9.221 15.713 ( -3.037 0.000 5.770) 6.520 16.526 ( -5.357 0.000 -1.835) 5.662 16.526 ( -8.062 0.000 -10.776) 13.459 19.240 ( -1.911 0.000 -3.551) 4.032 19.456 ( 0.375 0.000 7.883) 7.892 24.826 ( -8.579 0.000 4.474) 9.675 24.917 ( -5.310 0.000 8.480) 10.005 25.838 ( 5.091 0.000 -6.507) 8.261 26.337 ( 17.910 0.000 5.157) 18.637 26.554 ( -2.862 0.000 -2.499) 3.799 26.819 ( 4.991 0.000 0.681) 5.037 27.123 ( -10.541 0.000 -2.622) 10.862 27.161 ( -2.581 0.000 5.189) 5.796 27.331 ( -8.517 0.000 -0.437) 8.528 28.623 ( 6.806 0.000 -13.478) 15.099 28.665 ( -12.568 0.000 8.383) 15.107 29.476 ( 3.485 0.000 -26.244) 26.474 32.626 ( -5.992 0.000 -6.059) 8.522 32.677 ( -3.647 0.000 10.573) 11.185 ======================= Grid point 223 (121/150) ======================= q-point: ( 0.27 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.101 ( -0.642 0.000 1.936) 2.040 2.433 ( -0.981 0.000 -1.320) 1.644 2.935 ( 24.639 0.000 -5.353) 25.214 3.338 ( 0.892 0.000 -1.886) 2.087 3.614 ( 2.531 0.000 -7.146) 7.581 3.925 ( -2.671 0.000 2.177) 3.446 3.932 ( -15.088 0.000 -5.130) 15.937 4.086 ( -12.071 0.000 -7.430) 14.175 4.249 ( -0.038 0.000 -6.863) 6.863 4.724 ( -5.413 0.000 6.624) 8.555 4.741 ( -1.731 0.000 -14.167) 14.273 4.796 ( 1.260 0.000 -14.352) 14.408 5.137 ( -2.541 0.000 -8.138) 8.525 5.223 ( -11.089 0.000 -2.086) 11.283 5.533 ( -2.189 0.000 -0.943) 2.384 5.730 ( -0.784 0.000 -7.082) 7.125 5.978 ( -17.545 0.000 -12.718) 21.669 6.518 ( 0.169 0.000 -6.416) 6.418 6.555 ( -1.905 0.000 -7.790) 8.020 6.818 ( -14.234 0.000 -3.832) 14.741 7.233 ( -6.696 0.000 -3.517) 7.563 7.458 ( -0.947 0.000 -2.212) 2.406 7.660 ( 7.487 0.000 3.849) 8.419 7.734 ( 0.024 0.000 0.049) 0.055 8.128 ( -7.775 0.000 -0.985) 7.837 8.214 ( 0.402 0.000 1.705) 1.751 9.035 ( -7.650 0.000 0.994) 7.715 9.095 ( -4.899 0.000 -3.648) 6.108 9.980 ( 0.191 0.000 7.037) 7.040 10.075 ( -4.596 0.000 8.647) 9.793 10.366 ( 0.621 0.000 -10.541) 10.559 10.796 ( -5.859 0.000 -14.006) 15.183 10.845 ( -7.081 0.000 7.154) 10.066 11.029 ( -8.920 0.000 -9.199) 12.814 11.880 ( 4.518 0.000 -4.470) 6.355 12.010 ( 1.350 0.000 -1.063) 1.718 12.380 ( -2.091 0.000 7.833) 8.107 12.526 ( -10.279 0.000 19.618) 22.147 12.869 ( 4.388 0.000 15.042) 15.669 13.192 ( 4.486 0.000 4.831) 6.592 13.410 ( 6.354 0.000 2.117) 6.697 13.496 ( -4.661 0.000 -4.349) 6.375 14.370 ( 12.070 0.000 10.510) 16.004 14.453 ( 14.561 0.000 0.502) 14.569 14.613 ( 5.737 0.000 2.855) 6.408 14.925 ( 12.212 0.000 2.155) 12.401 15.326 ( -4.004 0.000 -9.322) 10.145 15.685 ( -0.945 0.000 5.402) 5.484 16.316 ( -11.262 0.000 -9.202) 14.544 16.379 ( -9.103 0.000 -3.063) 9.605 19.212 ( -0.310 0.000 -3.786) 3.798 19.442 ( -3.216 0.000 6.628) 7.367 24.693 ( -6.010 0.000 4.386) 7.440 24.830 ( -5.010 0.000 5.381) 7.352 25.935 ( 5.929 0.000 -3.733) 7.007 26.512 ( -0.736 0.000 -1.591) 1.753 26.673 ( 11.070 0.000 6.955) 13.074 26.900 ( -3.201 0.000 -4.390) 5.433 26.926 ( 3.192 0.000 0.328) 3.209 27.122 ( -2.600 0.000 5.693) 6.259 27.236 ( -3.850 0.000 4.487) 5.912 28.436 ( -12.001 0.000 9.276) 15.168 28.639 ( -1.210 0.000 -19.713) 19.750 29.436 ( -1.874 0.000 -28.816) 28.877 32.519 ( -3.826 0.000 -4.080) 5.594 32.610 ( -5.088 0.000 8.785) 10.152 ======================= Grid point 224 (122/150) ======================= q-point: ( 0.36 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.237 ( 15.611 0.000 -8.806) 17.923 2.501 ( 8.942 0.000 -10.273) 13.619 3.153 ( -19.361 0.000 15.020) 24.504 3.378 ( 19.087 0.000 -15.794) 24.774 3.594 ( -2.706 0.000 1.519) 3.103 3.661 ( -11.053 0.000 -16.921) 20.212 3.748 ( -17.370 0.000 -11.512) 20.838 3.859 ( -5.078 0.000 -2.497) 5.658 4.352 ( 11.055 0.000 -9.995) 14.904 4.531 ( -16.394 0.000 0.727) 16.410 4.686 ( -0.983 0.000 -8.269) 8.327 4.708 ( -5.555 0.000 -3.733) 6.693 5.017 ( -8.499 0.000 -11.340) 14.171 5.087 ( -5.865 0.000 -2.426) 6.347 5.509 ( -7.722 0.000 -8.395) 11.406 5.582 ( 7.570 0.000 2.505) 7.974 5.912 ( 3.954 0.000 3.575) 5.331 6.410 ( -19.471 0.000 -9.529) 21.678 6.455 ( -6.584 0.000 -8.707) 10.915 6.504 ( -5.952 0.000 -0.419) 5.966 7.165 ( 0.072 0.000 -4.396) 4.397 7.371 ( -7.739 0.000 -1.093) 7.816 7.781 ( 3.501 0.000 3.207) 4.748 7.799 ( 5.692 0.000 4.438) 7.218 8.084 ( 2.847 0.000 1.384) 3.166 8.245 ( 2.640 0.000 -4.865) 5.535 8.909 ( -5.639 0.000 2.887) 6.335 9.004 ( -3.812 0.000 -3.338) 5.067 9.932 ( -4.603 0.000 9.405) 10.471 10.115 ( 4.391 0.000 7.589) 8.768 10.314 ( -3.496 0.000 -12.466) 12.947 10.614 ( -7.965 0.000 -11.546) 14.027 10.774 ( -2.510 0.000 1.455) 2.901 10.862 ( -6.251 0.000 -7.229) 9.557 12.002 ( 7.449 0.000 -5.682) 9.369 12.035 ( 1.646 0.000 -2.492) 2.987 12.329 ( -3.522 0.000 8.277) 8.995 12.394 ( -6.980 0.000 16.364) 17.790 12.982 ( 4.363 0.000 11.258) 12.074 13.300 ( 3.775 0.000 2.529) 4.544 13.412 ( -1.564 0.000 -2.159) 2.666 13.516 ( 3.767 0.000 2.283) 4.404 14.581 ( 7.172 0.000 10.631) 12.824 14.682 ( 9.131 0.000 -0.762) 9.163 14.720 ( 4.737 0.000 8.067) 9.354 15.134 ( 7.916 0.000 7.251) 10.735 15.279 ( 1.919 0.000 -15.242) 15.362 15.696 ( 0.922 0.000 4.256) 4.355 16.064 ( -12.869 0.000 -6.996) 14.647 16.178 ( -10.349 0.000 -3.724) 10.998 19.214 ( 1.316 0.000 -3.444) 3.686 19.369 ( -5.259 0.000 4.921) 7.202 24.616 ( -2.585 0.000 3.316) 4.204 24.751 ( -3.809 0.000 1.482) 4.087 26.050 ( 6.284 0.000 0.093) 6.285 26.530 ( 2.792 0.000 1.031) 2.976 26.601 ( -8.731 0.000 -7.283) 11.370 26.953 ( -0.272 0.000 -0.792) 0.837 27.090 ( -1.513 0.000 3.923) 4.205 27.120 ( 9.225 0.000 11.907) 15.063 27.196 ( 3.378 0.000 5.890) 6.790 28.288 ( -4.779 0.000 15.252) 15.983 28.509 ( -7.447 0.000 -23.843) 24.979 29.293 ( -6.611 0.000 -29.652) 30.380 32.466 ( -0.766 0.000 -3.291) 3.379 32.526 ( -4.984 0.000 6.461) 8.160 ======================= Grid point 225 (123/150) ======================= q-point: ( 0.45 0.00 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.625 ( 25.435 0.000 -16.038) 30.069 2.653 ( -8.043 0.000 12.581) 14.932 2.806 ( -1.422 0.000 -3.228) 3.528 3.220 ( -23.638 0.000 -14.347) 27.651 3.414 ( -11.025 0.000 -6.319) 12.707 3.566 ( -5.809 0.000 -19.896) 20.727 3.605 ( 2.807 0.000 4.818) 5.576 3.801 ( -5.355 0.000 -5.017) 7.338 4.282 ( -3.913 0.000 11.592) 12.235 4.533 ( 7.966 0.000 -11.697) 14.152 4.608 ( -4.643 0.000 7.126) 8.505 4.694 ( 1.270 0.000 2.276) 2.607 4.798 ( -8.432 0.000 -11.814) 14.515 4.911 ( -8.278 0.000 -7.747) 11.338 5.549 ( 7.426 0.000 6.287) 9.730 5.806 ( 13.957 0.000 0.638) 13.971 5.971 ( -21.517 0.000 -3.602) 21.817 6.015 ( 6.090 0.000 -1.100) 6.189 6.311 ( -4.648 0.000 -8.720) 9.882 6.400 ( -5.928 0.000 -7.036) 9.200 7.191 ( 2.850 0.000 -3.731) 4.695 7.203 ( -8.528 0.000 3.913) 9.383 7.864 ( 3.914 0.000 2.854) 4.844 7.886 ( 2.493 0.000 2.141) 3.286 8.160 ( 2.527 0.000 2.328) 3.436 8.273 ( 0.578 0.000 -5.302) 5.334 8.847 ( -0.712 0.000 2.464) 2.565 8.939 ( -1.739 0.000 -4.905) 5.204 9.896 ( -1.056 0.000 11.685) 11.733 10.210 ( 3.441 0.000 7.774) 8.502 10.210 ( -3.986 0.000 -11.217) 11.904 10.458 ( -5.784 0.000 -9.967) 11.524 10.731 ( -2.687 0.000 0.685) 2.773 10.770 ( -1.925 0.000 -4.312) 4.722 12.057 ( 0.248 0.000 -0.921) 0.954 12.062 ( -0.889 0.000 -0.834) 1.219 12.334 ( -1.067 0.000 6.790) 6.874 12.367 ( 7.493 0.000 -2.921) 8.042 13.083 ( 4.230 0.000 7.609) 8.706 13.280 ( -2.641 0.000 -4.875) 5.545 13.478 ( 4.997 0.000 3.153) 5.909 13.554 ( -0.275 0.000 1.195) 1.226 14.688 ( 2.306 0.000 8.546) 8.851 14.802 ( 3.636 0.000 -2.395) 4.354 14.833 ( 4.254 0.000 13.152) 13.822 15.204 ( -0.039 0.000 -9.994) 9.995 15.375 ( 8.372 0.000 3.462) 9.059 15.715 ( -3.276 0.000 -1.858) 3.767 15.823 ( -7.029 0.000 0.975) 7.097 15.991 ( -7.502 0.000 -4.123) 8.561 19.252 ( 3.432 0.000 -2.736) 4.389 19.273 ( -5.295 0.000 3.763) 6.496 24.610 ( 1.415 0.000 1.708) 2.218 24.695 ( -1.680 0.000 -2.354) 2.892 26.171 ( 5.626 0.000 4.319) 7.093 26.414 ( -9.500 0.000 -4.420) 10.478 26.622 ( 6.074 0.000 4.089) 7.322 26.885 ( -5.791 0.000 -6.009) 8.345 27.093 ( 1.607 0.000 0.898) 1.841 27.103 ( -2.452 0.000 3.691) 4.431 27.490 ( 14.901 0.000 17.714) 23.148 28.263 ( -12.742 0.000 -25.340) 28.363 28.329 ( 4.407 0.000 22.686) 23.110 29.073 ( -9.542 0.000 -29.213) 30.732 32.452 ( -3.603 0.000 4.365) 5.660 32.477 ( 2.641 0.000 -3.750) 4.586 ======================= Grid point 226 (124/150) ======================= q-point: (-0.45 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.306 ( -18.231 0.000 16.155) 24.358 2.711 ( -22.821 0.000 -8.326) 24.292 3.063 ( 14.383 0.000 -2.436) 14.588 3.107 ( 24.446 0.000 -15.459) 28.924 3.235 ( -5.506 0.000 10.890) 12.203 3.351 ( -11.387 0.000 -4.727) 12.329 3.603 ( -10.820 0.000 7.634) 13.242 3.704 ( 5.397 0.000 5.811) 7.931 4.272 ( -5.144 0.000 10.334) 11.544 4.538 ( -6.633 0.000 -7.683) 10.150 4.598 ( 0.407 0.000 5.855) 5.869 4.634 ( 3.945 0.000 -3.531) 5.294 4.816 ( 1.171 0.000 -5.213) 5.343 4.874 ( 9.295 0.000 -1.814) 9.471 5.581 ( -17.473 0.000 2.720) 17.684 5.680 ( 2.997 0.000 6.999) 7.614 6.095 ( 14.105 0.000 -6.437) 15.504 6.133 ( 7.503 0.000 -12.537) 14.611 6.251 ( -7.268 0.000 -4.953) 8.795 6.325 ( 8.321 0.000 0.251) 8.325 7.089 ( -4.002 0.000 6.213) 7.390 7.247 ( 3.354 0.000 -0.599) 3.407 7.903 ( -0.550 0.000 -2.539) 2.598 7.928 ( 2.028 0.000 0.425) 2.072 8.158 ( -2.809 0.000 3.308) 4.340 8.222 ( -5.023 0.000 -2.251) 5.504 8.893 ( 4.383 0.000 0.777) 4.452 8.935 ( 2.720 0.000 -6.908) 7.424 9.937 ( 2.411 0.000 13.700) 13.911 10.137 ( -0.911 0.000 -11.058) 11.096 10.283 ( 2.826 0.000 9.163) 9.589 10.346 ( -4.485 0.000 -7.043) 8.349 10.677 ( -2.642 0.000 4.282) 5.031 10.768 ( 2.333 0.000 -2.721) 3.585 12.016 ( -4.543 0.000 4.010) 6.060 12.036 ( -0.566 0.000 -0.619) 0.839 12.393 ( 6.295 0.000 -5.630) 8.445 12.539 ( 10.555 0.000 -11.267) 15.439 13.181 ( 4.815 0.000 4.700) 6.728 13.227 ( -1.537 0.000 -6.902) 7.071 13.514 ( -3.732 0.000 -0.481) 3.763 13.557 ( 2.271 0.000 1.352) 2.643 14.710 ( -1.882 0.000 6.815) 7.070 14.815 ( -1.457 0.000 -4.011) 4.267 14.923 ( 2.065 0.000 14.907) 15.049 15.130 ( -4.736 0.000 -15.753) 16.449 15.492 ( -12.964 0.000 -5.275) 13.996 15.561 ( 8.830 0.000 11.119) 14.198 15.885 ( 7.007 0.000 6.733) 9.717 15.891 ( -1.860 0.000 -4.025) 4.434 19.189 ( -3.966 0.000 3.506) 5.294 19.335 ( 5.541 0.000 -2.323) 6.008 24.676 ( 5.104 0.000 -0.408) 5.120 24.682 ( 1.281 0.000 -5.452) 5.600 26.214 ( -10.705 0.000 0.099) 10.705 26.283 ( 4.805 0.000 8.280) 9.573 26.726 ( -8.374 0.000 -5.874) 10.229 26.765 ( 7.144 0.000 5.607) 9.081 27.108 ( 2.469 0.000 -0.682) 2.562 27.160 ( 5.253 0.000 -1.874) 5.577 27.793 ( 12.226 0.000 20.816) 24.141 27.921 ( -17.379 0.000 -24.384) 29.944 28.507 ( 7.826 0.000 26.771) 27.891 28.828 ( -9.168 0.000 -26.817) 28.341 32.410 ( -1.491 0.000 2.979) 3.331 32.550 ( 5.738 0.000 -5.334) 7.835 ======================= Grid point 227 (125/150) ======================= q-point: (-0.36 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.105 ( -5.073 0.000 5.585) 7.546 2.356 ( -10.993 0.000 1.410) 11.083 3.013 ( -11.148 0.000 18.292) 21.421 3.188 ( -5.837 0.000 18.670) 19.562 3.333 ( -8.799 0.000 13.143) 15.817 3.487 ( 18.176 0.000 9.465) 20.492 3.604 ( 17.109 0.000 -5.411) 17.944 3.818 ( 6.117 0.000 2.186) 6.495 4.176 ( -4.313 0.000 5.070) 6.657 4.482 ( 0.941 0.000 4.315) 4.417 4.569 ( -3.144 0.000 1.773) 3.610 4.727 ( 6.461 0.000 -6.704) 9.310 4.881 ( 2.714 0.000 4.607) 5.347 5.037 ( 4.875 0.000 4.541) 6.662 5.356 ( -3.397 0.000 5.582) 6.534 5.704 ( 0.613 0.000 -7.159) 7.185 6.058 ( -8.103 0.000 -8.677) 11.872 6.255 ( 5.695 0.000 4.577) 7.306 6.344 ( 8.517 0.000 1.758) 8.697 6.583 ( 16.437 0.000 -6.603) 17.713 7.083 ( 2.493 0.000 3.673) 4.439 7.315 ( 3.375 0.000 3.926) 5.177 7.851 ( -4.517 0.000 -4.587) 6.438 7.919 ( -3.128 0.000 -6.390) 7.115 8.113 ( -4.049 0.000 -1.204) 4.224 8.125 ( 0.354 0.000 6.181) 6.191 8.986 ( 4.742 0.000 -0.606) 4.780 9.002 ( 5.119 0.000 -6.518) 8.288 10.030 ( 3.919 0.000 14.030) 14.567 10.134 ( 2.673 0.000 -10.685) 11.015 10.244 ( -4.467 0.000 -5.795) 7.317 10.375 ( 4.892 0.000 11.834) 12.806 10.686 ( 2.740 0.000 9.180) 9.580 10.844 ( 6.110 0.000 -3.991) 7.298 11.923 ( -5.235 0.000 2.743) 5.911 12.035 ( 0.249 0.000 -2.217) 2.231 12.503 ( 5.469 0.000 -8.796) 10.357 12.711 ( 9.719 0.000 -13.568) 16.690 13.192 ( -0.241 0.000 -10.254) 10.257 13.288 ( 5.171 0.000 2.126) 5.591 13.420 ( -5.275 0.000 -1.593) 5.510 13.562 ( -1.874 0.000 -1.840) 2.626 14.636 ( -6.985 0.000 4.079) 8.089 14.739 ( -5.398 0.000 -4.623) 7.107 14.959 ( -2.948 0.000 16.128) 16.396 14.965 ( -8.895 0.000 -15.617) 17.972 15.271 ( -6.630 0.000 -6.239) 9.104 15.730 ( 5.814 0.000 3.658) 6.869 15.915 ( 5.062 0.000 4.266) 6.620 16.070 ( 10.205 0.000 7.461) 12.641 19.138 ( -2.057 0.000 3.923) 4.430 19.449 ( 6.512 0.000 -2.825) 7.099 24.724 ( 4.378 0.000 -7.406) 8.603 24.798 ( 7.681 0.000 -3.104) 8.284 26.010 ( -10.615 0.000 4.032) 11.355 26.405 ( 6.340 0.000 11.301) 12.957 26.573 ( -5.933 0.000 -3.206) 6.744 26.895 ( 4.621 0.000 4.064) 6.154 27.178 ( 4.829 0.000 -4.722) 6.754 27.264 ( 5.323 0.000 -3.780) 6.528 27.499 ( -21.227 0.000 -21.303) 30.073 28.043 ( 9.099 0.000 21.943) 23.755 28.650 ( -3.113 0.000 -20.992) 21.221 28.708 ( 6.642 0.000 28.195) 28.967 32.408 ( 0.739 0.000 2.542) 2.647 32.670 ( 7.726 0.000 -7.739) 10.935 ======================= Grid point 228 (126/150) ======================= q-point: (-0.27 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.049 ( -5.479 0.000 7.136) 8.997 2.339 ( 8.287 0.000 6.655) 10.628 2.889 ( -0.515 0.000 1.999) 2.065 3.079 ( -17.909 0.000 21.882) 28.276 3.210 ( 0.526 0.000 31.296) 31.301 3.777 ( 6.450 0.000 13.506) 14.967 3.930 ( 14.543 0.000 -2.638) 14.781 4.001 ( 13.794 0.000 1.480) 13.873 4.164 ( 2.512 0.000 1.304) 2.830 4.520 ( -1.785 0.000 5.891) 6.156 4.521 ( -0.598 0.000 10.297) 10.314 4.847 ( 6.460 0.000 -6.127) 8.903 4.918 ( 0.437 0.000 11.044) 11.053 5.039 ( -1.359 0.000 14.779) 14.841 5.547 ( 16.815 0.000 9.644) 19.384 5.692 ( 0.102 0.000 -11.790) 11.790 5.894 ( -6.760 0.000 -4.227) 7.973 6.357 ( 3.157 0.000 8.877) 9.422 6.452 ( 2.724 0.000 2.832) 3.930 6.837 ( 9.217 0.000 -4.777) 10.382 7.194 ( 8.041 0.000 0.586) 8.062 7.403 ( 4.849 0.000 3.883) 6.212 7.718 ( -7.383 0.000 0.033) 7.383 7.801 ( -6.315 0.000 -8.978) 10.977 8.104 ( 2.927 0.000 0.456) 2.962 8.213 ( 7.285 0.000 2.454) 7.687 9.069 ( 4.112 0.000 -0.494) 4.141 9.093 ( 5.349 0.000 -4.514) 6.999 10.122 ( -2.384 0.000 -7.376) 7.752 10.130 ( 3.348 0.000 11.941) 12.401 10.235 ( 5.518 0.000 -7.390) 9.223 10.525 ( 7.811 0.000 12.687) 14.899 10.815 ( 8.018 0.000 10.954) 13.575 10.984 ( 9.251 0.000 -6.080) 11.070 11.842 ( -2.983 0.000 -0.046) 2.983 12.023 ( -1.221 0.000 -1.931) 2.285 12.545 ( 0.502 0.000 -8.071) 8.087 12.847 ( 6.040 0.000 -10.340) 11.975 13.185 ( 2.902 0.000 -15.921) 16.183 13.285 ( -5.035 0.000 -4.069) 6.474 13.410 ( 3.906 0.000 3.873) 5.501 13.479 ( -5.511 0.000 -5.647) 7.891 14.453 ( -12.537 0.000 0.881) 12.568 14.579 ( -10.632 0.000 -6.663) 12.547 14.738 ( -10.983 0.000 -12.094) 16.337 14.819 ( -13.099 0.000 11.569) 17.476 15.287 ( 8.134 0.000 -4.656) 9.373 15.799 ( 2.793 0.000 -6.012) 6.629 16.087 ( 9.409 0.000 12.758) 15.852 16.288 ( 10.393 0.000 6.439) 12.226 19.126 ( -0.113 0.000 4.501) 4.502 19.558 ( 4.966 0.000 -4.419) 6.647 24.816 ( 6.462 0.000 -7.837) 10.158 24.950 ( 8.818 0.000 -6.330) 10.855 25.830 ( -8.879 0.000 6.595) 11.060 26.496 ( -1.639 0.000 -0.169) 1.648 26.583 ( 8.644 0.000 11.880) 14.692 26.933 ( -1.817 0.000 0.262) 1.836 27.035 ( -20.893 0.000 -14.641) 25.512 27.256 ( 4.137 0.000 -7.423) 8.498 27.336 ( 3.010 0.000 -5.202) 6.010 28.227 ( 5.327 0.000 20.677) 21.352 28.652 ( 6.731 0.000 -12.733) 14.403 28.863 ( 3.329 0.000 27.998) 28.196 32.447 ( 2.577 0.000 3.161) 4.078 32.805 ( 7.787 0.000 -10.482) 13.058 ======================= Grid point 229 (127/150) ======================= q-point: (-0.18 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.891 ( -10.281 0.000 13.384) 16.877 2.655 ( 21.472 0.000 2.901) 21.667 2.730 ( -21.477 0.000 18.461) 28.321 3.037 ( 15.239 0.000 -17.389) 23.121 3.305 ( 1.139 0.000 27.816) 27.839 3.801 ( -5.537 0.000 13.534) 14.623 4.075 ( 0.067 0.000 9.249) 9.249 4.284 ( 8.301 0.000 5.038) 9.711 4.290 ( 13.468 0.000 -0.633) 13.483 4.455 ( -7.094 0.000 10.020) 12.277 4.557 ( 4.176 0.000 5.446) 6.862 4.903 ( 0.971 0.000 -1.764) 2.014 4.995 ( 5.849 0.000 14.673) 15.796 5.182 ( 10.458 0.000 19.199) 21.862 5.663 ( -0.595 0.000 -9.570) 9.589 5.710 ( -3.869 0.000 -7.681) 8.601 5.986 ( 16.538 0.000 18.091) 24.510 6.404 ( 0.138 0.000 5.657) 5.659 6.488 ( 1.128 0.000 2.176) 2.451 6.916 ( 0.756 0.000 1.287) 1.492 7.383 ( 11.101 0.000 1.711) 11.232 7.418 ( -5.563 0.000 -2.400) 6.059 7.664 ( -5.506 0.000 -10.595) 11.940 7.685 ( 4.261 0.000 9.990) 10.861 8.196 ( 4.855 0.000 7.662) 9.070 8.397 ( 11.097 0.000 -2.951) 11.483 9.155 ( 5.183 0.000 0.732) 5.234 9.192 ( 5.612 0.000 -2.241) 6.043 10.097 ( 1.833 0.000 -5.263) 5.573 10.200 ( 1.757 0.000 8.831) 9.004 10.343 ( 6.334 0.000 -8.080) 10.267 10.688 ( 5.403 0.000 6.672) 8.585 11.017 ( 9.963 0.000 10.351) 14.367 11.168 ( 10.876 0.000 -6.541) 12.691 11.825 ( 1.647 0.000 -0.428) 1.701 11.986 ( -1.932 0.000 -0.870) 2.119 12.501 ( -2.779 0.000 -7.251) 7.765 12.862 ( -2.856 0.000 -6.065) 6.704 13.193 ( -3.343 0.000 -2.107) 3.951 13.250 ( 4.161 0.000 -11.785) 12.498 13.369 ( -0.544 0.000 -15.851) 15.860 13.482 ( 2.338 0.000 5.347) 5.835 14.156 ( -18.017 0.000 -1.899) 18.117 14.295 ( -16.177 0.000 -10.533) 19.303 14.510 ( -10.868 0.000 -5.683) 12.264 14.565 ( -14.280 0.000 7.610) 16.181 15.490 ( 12.389 0.000 -5.334) 13.489 15.833 ( 2.030 0.000 -6.127) 6.454 16.292 ( 8.806 0.000 11.495) 14.481 16.482 ( 8.421 0.000 2.756) 8.860 19.151 ( 1.684 0.000 4.906) 5.186 19.603 ( 0.453 0.000 -6.211) 6.227 24.930 ( 6.420 0.000 -5.756) 8.622 25.101 ( 8.112 0.000 -9.598) 12.567 25.703 ( -5.408 0.000 6.746) 8.646 26.447 ( -22.341 0.000 -5.701) 23.057 26.506 ( 2.229 0.000 1.996) 2.992 26.847 ( -4.825 0.000 -1.722) 5.123 26.996 ( 15.775 0.000 8.451) 17.896 27.297 ( 1.589 0.000 -8.006) 8.163 27.372 ( 2.082 0.000 -3.741) 4.282 28.315 ( -0.797 0.000 16.629) 16.648 28.827 ( 12.419 0.000 -7.954) 14.748 28.949 ( 0.130 0.000 26.193) 26.193 32.516 ( 3.647 0.000 4.848) 6.066 32.912 ( 5.348 0.000 -12.762) 13.837 ======================= Grid point 230 (128/150) ======================= q-point: (-0.09 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.826 ( 3.387 0.000 7.516) 8.244 2.352 ( -19.365 0.000 9.243) 21.457 3.098 ( 19.257 0.000 -0.327) 19.259 3.314 ( 15.797 0.000 -21.126) 26.379 3.323 ( -1.749 0.000 21.152) 21.224 3.628 ( -15.776 0.000 20.344) 25.745 4.073 ( -1.206 0.000 12.544) 12.602 4.308 ( -4.004 0.000 -4.451) 5.987 4.433 ( 4.611 0.000 14.213) 14.942 4.538 ( 8.239 0.000 4.457) 9.367 4.668 ( 5.829 0.000 3.127) 6.615 4.897 ( -1.276 0.000 -1.369) 1.871 5.192 ( 10.298 0.000 9.911) 14.293 5.397 ( 5.896 0.000 12.286) 13.628 5.621 ( -2.070 0.000 -5.182) 5.580 5.647 ( 1.015 0.000 -5.653) 5.743 6.295 ( 10.111 0.000 10.121) 14.306 6.397 ( -1.242 0.000 2.561) 2.847 6.539 ( 4.666 0.000 6.758) 8.213 6.918 ( -0.252 0.000 0.139) 0.288 7.287 ( -5.999 0.000 3.232) 6.815 7.526 ( -2.854 0.000 -9.770) 10.179 7.641 ( 10.945 0.000 1.276) 11.019 7.790 ( 2.255 0.000 10.950) 11.180 8.299 ( 2.985 0.000 15.914) 16.191 8.580 ( 7.222 0.000 -4.875) 8.714 9.280 ( 7.317 0.000 0.047) 7.317 9.292 ( 4.579 0.000 -0.375) 4.595 10.182 ( 7.734 0.000 -1.917) 7.968 10.236 ( 0.386 0.000 6.981) 6.991 10.422 ( 3.184 0.000 -9.592) 10.107 10.701 ( -4.989 0.000 -4.200) 6.522 11.211 ( 7.211 0.000 9.155) 11.654 11.354 ( 8.888 0.000 -6.277) 10.881 11.907 ( 5.928 0.000 1.543) 6.126 11.960 ( -0.219 0.000 -0.125) 0.252 12.438 ( -1.538 0.000 -5.066) 5.294 12.738 ( -8.183 0.000 -6.143) 10.233 13.153 ( -1.295 0.000 3.803) 4.018 13.233 ( 0.231 0.000 -0.341) 0.412 13.445 ( 6.512 0.000 -23.258) 24.152 13.524 ( 0.782 0.000 5.510) 5.566 13.775 ( -19.655 0.000 -2.113) 19.768 13.969 ( -13.184 0.000 -10.736) 17.003 14.306 ( -8.550 0.000 -2.413) 8.884 14.331 ( -9.996 0.000 3.066) 10.456 15.693 ( 8.695 0.000 -4.450) 9.768 15.841 ( -0.645 0.000 -3.335) 3.397 16.460 ( 6.375 0.000 7.690) 9.989 16.619 ( 5.743 0.000 -3.144) 6.547 19.211 ( 3.443 0.000 5.434) 6.433 19.547 ( -4.683 0.000 -6.346) 7.887 25.022 ( 3.154 0.000 0.282) 3.167 25.203 ( 3.830 0.000 -10.874) 11.529 25.665 ( 0.993 0.000 3.174) 3.326 26.023 ( -18.454 0.000 -1.621) 18.525 26.576 ( 4.146 0.000 2.395) 4.788 26.745 ( -4.553 0.000 -1.018) 4.665 27.276 ( 3.709 0.000 -1.929) 4.181 27.289 ( -0.705 0.000 -5.961) 6.003 27.530 ( 20.529 0.000 6.102) 21.416 28.241 ( -10.029 0.000 10.735) 14.691 28.982 ( -1.715 0.000 22.056) 22.122 29.061 ( 12.821 0.000 -8.766) 15.531 32.600 ( 3.508 0.000 7.319) 8.116 32.946 ( 0.795 0.000 -13.462) 13.485 ======================= Grid point 231 (129/150) ======================= q-point: ( 0.00 0.20 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.148 ( -12.352 8.853 3.990) 15.712 2.257 ( 21.658 16.919 -5.335) 27.996 2.842 ( -16.849 -13.015 27.500) 34.778 3.315 ( 13.824 -11.650 -17.591) 25.225 3.553 ( -14.937 16.147 18.667) 28.849 3.801 ( 11.133 5.320 -4.049) 12.986 4.028 ( 2.842 -3.222 12.926) 13.621 4.208 ( 1.167 -4.762 -5.328) 7.241 4.507 ( 0.654 -1.923 9.689) 9.899 4.640 ( 2.320 -0.305 -1.891) 3.008 4.719 ( -0.304 -11.837 -2.654) 12.135 4.746 ( 4.861 -2.469 -3.375) 6.412 5.417 ( -3.191 3.395 0.126) 4.661 5.431 ( -0.083 2.816 1.301) 3.103 5.660 ( 1.788 8.904 12.187) 15.199 5.917 ( 4.429 15.444 -9.685) 18.760 6.380 ( 1.617 0.557 1.682) 2.399 6.431 ( 0.671 0.741 -2.624) 2.808 6.728 ( 8.942 3.062 11.604) 14.966 6.915 ( -1.782 2.014 -6.381) 6.925 7.241 ( 0.321 -1.562 8.797) 8.940 7.431 ( -1.210 -2.666 -9.279) 9.730 7.612 ( -5.797 -14.863 10.856) 19.297 7.744 ( 8.859 -11.522 -1.042) 14.571 8.339 ( -1.758 -0.193 16.826) 16.919 8.604 ( 0.308 -3.245 -6.749) 7.495 9.343 ( -0.056 1.296 2.693) 2.989 9.426 ( 3.541 1.824 -5.200) 6.550 10.259 ( -0.383 1.566 5.148) 5.394 10.363 ( 2.340 -1.211 -2.627) 3.721 10.425 ( 3.918 0.851 -2.341) 4.643 10.515 ( -7.765 0.870 -7.944) 11.143 11.317 ( -1.880 2.264 6.965) 7.562 11.451 ( 2.263 -0.132 -6.125) 6.531 11.779 ( 7.539 -13.040 1.534) 15.141 11.861 ( -6.888 -13.094 -6.426) 16.130 12.615 ( 3.271 13.294 5.342) 14.696 12.727 ( -5.997 12.763 -4.839) 14.909 13.161 ( -8.448 4.631 13.055) 16.225 13.344 ( 9.319 0.207 1.533) 9.447 13.382 ( -5.322 0.413 -7.244) 8.998 13.411 ( -7.196 0.210 -5.540) 9.084 13.600 ( 0.747 -0.962 3.002) 3.240 13.764 ( -1.370 -5.308 -12.260) 13.430 14.290 ( -5.888 9.161 3.441) 11.421 14.388 ( 7.395 12.438 -5.739) 15.567 15.629 ( -8.280 -12.503 3.346) 15.365 15.728 ( 7.643 -9.120 -6.083) 13.364 16.562 ( 1.606 0.090 2.579) 3.040 16.654 ( 1.822 -2.797 -6.552) 7.353 19.349 ( 3.312 4.388 4.869) 7.344 19.440 ( -5.339 1.667 -3.637) 6.672 25.051 ( -2.075 0.961 6.228) 6.635 25.153 ( -5.306 -1.665 -3.539) 6.591 25.779 ( 7.551 1.081 -1.257) 7.731 25.793 ( -3.400 0.609 -3.092) 4.635 26.657 ( 3.217 -0.296 0.929) 3.362 26.668 ( -2.401 -0.544 -0.163) 2.467 27.255 ( -1.892 -0.104 -1.536) 2.439 27.258 ( -1.896 -0.068 -1.785) 2.605 28.026 ( -13.338 4.439 4.637) 14.802 28.064 ( 19.041 4.957 1.122) 19.707 28.924 ( -3.702 -3.584 13.924) 14.847 29.177 ( 10.536 -8.987 -11.087) 17.740 32.707 ( 1.414 3.514 7.088) 8.036 32.880 ( -3.206 -1.008 -10.106) 10.650 ======================= Grid point 232 (130/150) ======================= q-point: ( 0.09 0.20 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.049 ( 3.114 3.851 -7.788) 9.229 2.591 ( -13.195 -8.482 27.208) 31.406 2.712 ( 22.696 18.595 -4.748) 29.722 3.231 ( -15.375 20.139 6.399) 26.132 3.530 ( 7.237 -7.817 -7.270) 12.898 3.896 ( 1.605 -3.562 0.736) 3.975 4.097 ( -0.487 -7.427 2.589) 7.881 4.243 ( 3.148 -0.167 -4.513) 5.505 4.457 ( -7.181 -4.893 4.642) 9.852 4.651 ( 1.746 -0.311 0.450) 1.830 4.740 ( 2.184 -8.803 -13.281) 16.082 4.798 ( 1.373 -0.860 -4.741) 5.011 5.306 ( -6.340 1.776 3.365) 7.394 5.458 ( 0.222 -0.058 2.863) 2.872 5.704 ( 0.491 9.915 5.898) 11.547 5.944 ( 0.367 15.531 -13.873) 20.828 6.399 ( 0.216 0.573 -1.656) 1.766 6.445 ( 1.256 -2.079 -3.319) 4.113 6.827 ( -5.316 1.242 -12.283) 13.442 6.904 ( 7.011 4.888 3.987) 9.431 7.297 ( 1.560 -7.553 4.221) 8.792 7.413 ( -0.728 -4.502 1.048) 4.679 7.477 ( -5.556 -6.833 -1.294) 8.902 7.848 ( 2.023 -10.498 -3.952) 11.398 8.286 ( -6.765 -1.898 15.194) 16.740 8.515 ( -7.846 -2.394 -6.429) 10.423 9.299 ( -4.471 1.365 -0.410) 4.693 9.406 ( -4.051 2.596 -7.172) 8.636 10.176 ( -10.648 2.120 -0.100) 10.858 10.248 ( -4.721 -0.803 3.141) 5.727 10.433 ( -0.164 4.921 -5.651) 7.495 10.618 ( 10.517 -1.040 1.020) 10.617 11.213 ( -8.890 -0.408 5.654) 10.543 11.387 ( -7.858 -1.869 -5.772) 9.928 11.757 ( -0.347 -10.226 -5.656) 11.691 11.970 ( 9.457 -9.655 0.688) 13.532 12.582 ( -7.985 17.470 -4.154) 19.653 12.673 ( 1.082 7.713 9.534) 12.312 12.970 ( -13.491 0.704 21.330) 25.248 13.231 ( -3.513 0.043 -1.376) 3.774 13.297 ( -4.395 6.013 -2.455) 7.842 13.570 ( 5.468 -0.487 -0.789) 5.546 13.731 ( 10.481 -5.803 -0.386) 11.986 13.823 ( 12.636 -1.517 -0.623) 12.742 14.294 ( 5.382 2.330 1.152) 5.977 14.562 ( 10.048 10.786 -2.878) 15.020 15.468 ( -7.373 -10.820 -0.514) 13.104 15.822 ( 2.625 -0.807 -1.928) 3.356 16.549 ( -2.946 -3.024 -1.627) 4.525 16.632 ( -2.805 -2.607 -6.938) 7.925 19.335 ( -4.197 2.919 -1.566) 5.347 19.421 ( 2.132 1.684 5.889) 6.486 24.994 ( -5.669 -0.044 7.745) 9.598 25.001 ( -8.494 -0.037 4.029) 9.401 25.789 ( 3.270 2.046 -6.357) 7.436 25.980 ( 12.361 -2.696 -0.840) 12.680 26.636 ( -0.734 1.741 -0.889) 2.088 26.726 ( 3.894 -0.850 0.105) 3.987 27.206 ( -2.686 0.181 2.041) 3.378 27.227 ( -2.027 -0.183 2.191) 2.990 27.706 ( -17.389 8.871 -1.327) 19.566 28.368 ( 9.193 -5.875 -2.573) 11.209 28.868 ( -3.156 1.917 5.449) 6.582 29.330 ( 8.059 -8.314 -18.165) 21.541 32.722 ( -1.568 1.945 8.245) 8.616 32.771 ( -5.808 0.618 -7.328) 9.371 ======================= Grid point 233 (131/150) ======================= q-point: ( 0.18 0.20 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.144 ( 3.703 1.827 -6.874) 8.019 2.544 ( 8.276 -4.346 11.412) 14.752 2.790 ( -14.381 22.715 12.757) 29.757 3.245 ( 15.145 13.146 -13.839) 24.366 3.613 ( 3.786 0.008 -4.217) 5.668 3.926 ( 0.483 -2.644 3.542) 4.447 4.019 ( -5.997 -12.259 -2.704) 13.913 4.148 ( -11.660 -11.905 -5.298) 17.486 4.400 ( 0.176 4.764 -0.395) 4.784 4.660 ( -1.923 -3.969 -5.810) 7.294 4.750 ( 3.141 -4.482 -15.899) 16.815 4.796 ( -0.054 -3.166 -5.031) 5.944 5.195 ( -6.087 1.342 4.317) 7.582 5.425 ( -4.927 -0.928 4.450) 6.703 5.709 ( -0.377 12.104 0.914) 12.145 5.868 ( -4.894 13.337 -13.648) 19.700 6.302 ( -11.678 -3.413 -11.515) 16.752 6.484 ( 3.287 -1.222 -3.224) 4.763 6.670 ( -5.993 2.582 -13.170) 14.699 7.012 ( 2.218 7.507 -2.397) 8.186 7.161 ( -11.290 -22.846 0.697) 25.493 7.418 ( 2.803 -0.176 -0.453) 2.845 7.542 ( 7.397 2.005 -0.731) 7.699 7.821 ( -2.852 -3.948 -6.076) 7.788 8.174 ( -6.264 -5.255 8.972) 12.139 8.302 ( -11.905 -3.288 -3.665) 12.883 9.195 ( -5.475 2.332 -1.360) 6.105 9.273 ( -7.347 3.602 -5.871) 10.071 10.010 ( -5.417 2.184 4.167) 7.175 10.157 ( -6.028 -1.452 5.924) 8.575 10.438 ( 1.127 6.877 -5.282) 8.744 10.771 ( 4.545 -3.356 -5.428) 7.834 11.030 ( -10.456 -0.442 4.443) 11.369 11.189 ( -9.580 -3.533 -5.074) 11.402 11.794 ( 4.626 -2.074 -4.762) 6.955 12.120 ( 4.815 -1.314 -0.411) 5.008 12.418 ( -7.324 12.270 0.635) 14.303 12.677 ( -4.735 1.548 13.602) 14.485 12.782 ( -8.221 -1.176 22.661) 24.135 13.212 ( 1.081 4.454 0.809) 4.654 13.287 ( 3.277 0.698 1.001) 3.497 13.535 ( -4.461 -4.729 -3.728) 7.494 14.022 ( 15.709 -4.233 5.521) 17.180 14.137 ( 16.943 -1.331 2.840) 17.231 14.450 ( 9.094 -0.183 0.847) 9.135 14.737 ( 8.207 1.907 2.785) 8.874 15.374 ( -1.307 -0.944 -7.462) 7.634 15.832 ( -1.140 6.143 1.858) 6.518 16.443 ( -7.088 -5.688 -7.118) 11.543 16.523 ( -7.022 -2.282 -3.933) 8.366 19.268 ( -2.375 2.977 -1.723) 4.179 19.451 ( -0.557 -0.837 6.647) 6.723 24.835 ( -8.258 0.955 4.824) 9.612 24.909 ( -5.632 -0.856 8.042) 9.856 25.862 ( 5.122 2.530 -6.001) 8.285 26.207 ( 9.543 -9.341 0.291) 13.357 26.667 ( 5.474 7.178 1.447) 9.142 26.815 ( 5.276 -0.445 0.771) 5.350 27.148 ( -5.693 1.515 0.873) 5.956 27.174 ( -3.397 1.192 4.685) 5.909 27.401 ( -12.191 8.913 -1.969) 15.229 28.381 ( -6.166 -16.375 0.287) 17.500 28.846 ( 0.179 10.047 -7.121) 12.316 29.404 ( 3.725 -7.348 -23.969) 25.345 32.640 ( -5.890 1.456 -4.762) 7.713 32.684 ( -4.064 0.572 8.270) 9.232 ======================= Grid point 234 (132/150) ======================= q-point: ( 0.27 0.20 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.176 ( 3.531 8.135 -1.606) 9.013 2.547 ( -8.955 12.127 -0.191) 15.076 2.910 ( 23.180 -4.365 -7.006) 24.605 3.362 ( -0.991 2.399 -1.639) 3.070 3.624 ( -8.506 -0.639 -2.745) 8.960 3.814 ( -10.728 -8.060 -9.690) 16.551 3.911 ( -4.718 -7.824 4.932) 10.383 4.036 ( 5.456 2.940 -10.792) 12.445 4.348 ( -4.902 7.062 -7.409) 11.349 4.588 ( -3.143 -7.690 -7.276) 11.043 4.737 ( -1.934 -2.669 -8.956) 9.543 4.825 ( 3.253 -4.753 -7.491) 9.449 5.066 ( -8.237 0.953 -2.085) 8.550 5.303 ( -7.387 3.756 4.305) 9.339 5.675 ( -2.854 13.423 -3.961) 14.283 5.752 ( -5.777 2.480 -7.450) 9.748 5.937 ( -17.252 -2.933 -11.167) 20.759 6.515 ( -0.354 -0.312 -8.226) 8.240 6.556 ( -5.478 -0.053 -8.502) 10.114 6.868 ( -9.997 -1.796 -6.859) 12.257 7.094 ( -0.383 -5.757 1.369) 5.930 7.454 ( -0.492 -0.558 -2.524) 2.631 7.692 ( 7.321 1.214 1.130) 7.507 7.749 ( -2.636 1.544 -2.091) 3.702 8.073 ( -4.384 -5.559 -1.609) 7.260 8.152 ( -1.676 -5.628 3.233) 6.703 9.085 ( -6.358 4.461 0.746) 7.802 9.132 ( -5.350 3.306 -4.166) 7.544 9.976 ( -0.900 -0.005 6.712) 6.772 10.060 ( -3.906 -1.322 7.560) 8.612 10.429 ( -1.149 5.653 -8.990) 10.681 10.751 ( -4.118 -5.165 -11.567) 13.321 10.849 ( -8.455 2.195 3.586) 9.443 11.033 ( -5.963 -0.172 -6.084) 8.520 11.905 ( 7.619 2.577 -4.651) 9.290 12.106 ( -4.618 8.057 0.699) 9.313 12.354 ( -1.747 -1.531 6.927) 7.306 12.557 ( -8.297 3.586 16.722) 19.009 12.762 ( 0.442 -8.585 15.687) 17.888 13.263 ( 2.388 1.091 0.927) 2.785 13.353 ( 1.225 -4.237 0.663) 4.460 13.467 ( 0.671 -0.858 0.158) 1.100 14.319 ( 13.228 -3.551 8.860) 16.312 14.437 ( 12.994 -3.041 2.631) 13.602 14.616 ( 7.650 1.425 2.900) 8.304 14.909 ( 8.751 -4.102 5.886) 11.316 15.369 ( 2.123 8.562 -12.597) 15.379 15.803 ( -1.986 8.770 3.847) 9.781 16.255 ( -10.318 -5.833 -9.429) 15.146 16.353 ( -9.693 -2.826 -2.412) 10.380 19.232 ( -0.968 2.236 -2.156) 3.253 19.424 ( -3.380 -2.000 5.764) 6.975 24.706 ( -5.947 1.375 4.464) 7.562 24.817 ( -5.153 -1.383 5.253) 7.488 25.957 ( 5.743 2.417 -3.533) 7.163 26.318 ( 3.018 -11.408 -1.183) 11.860 26.873 ( 11.684 5.039 7.878) 14.966 26.922 ( 5.664 0.197 0.458) 5.686 26.968 ( -8.984 12.118 -5.577) 16.083 27.134 ( -2.205 1.273 6.078) 6.590 27.246 ( -5.557 2.348 4.197) 7.349 28.217 ( -9.260 -17.292 4.249) 20.070 28.800 ( -3.074 11.270 -15.808) 19.656 29.372 ( -1.696 -6.630 -27.257) 28.103 32.533 ( -4.133 1.484 -3.108) 5.380 32.609 ( -5.169 -0.265 7.166) 8.840 ======================= Grid point 235 (133/150) ======================= q-point: ( 0.36 0.20 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.320 ( 11.790 8.037 -6.589) 15.717 2.472 ( 3.391 0.426 -13.559) 13.983 3.083 ( -13.383 -7.830 9.436) 18.151 3.320 ( -18.192 -21.318 -10.228) 29.833 3.456 ( 15.530 5.153 -10.799) 19.606 3.589 ( -5.069 -2.743 -6.735) 8.864 3.885 ( -3.144 6.967 3.500) 8.407 3.987 ( -9.159 10.394 -16.425) 21.487 4.334 ( 6.134 -1.285 -7.119) 9.484 4.475 ( -8.997 -5.674 -6.596) 12.516 4.669 ( -4.100 -3.062 -3.052) 5.958 4.801 ( -3.840 5.640 -0.612) 6.851 4.914 ( -4.845 -2.429 -9.216) 10.691 5.170 ( -7.774 5.011 -0.178) 9.251 5.457 ( -11.698 -1.812 -5.321) 12.979 5.729 ( 8.139 1.217 -4.830) 9.542 5.821 ( -0.295 2.803 1.525) 3.205 6.354 ( -9.756 -0.803 -10.832) 14.600 6.473 ( -3.644 -0.214 -9.035) 9.745 6.658 ( -12.734 8.806 0.865) 15.506 7.109 ( 2.541 -4.953 -1.943) 5.897 7.336 ( -9.682 -3.511 -1.008) 10.349 7.752 ( 3.858 -1.160 1.366) 4.254 7.837 ( 6.032 3.238 2.187) 7.187 8.081 ( 3.804 -0.704 0.823) 3.955 8.169 ( 2.246 -7.022 -2.332) 7.733 8.966 ( -5.283 5.066 0.905) 7.375 9.040 ( -4.115 3.023 -2.213) 5.565 9.935 ( -3.463 0.610 9.102) 9.758 10.090 ( 3.396 -2.505 8.088) 9.123 10.350 ( -4.494 3.376 -10.878) 12.244 10.606 ( -7.207 -2.471 -13.219) 15.258 10.750 ( -2.612 1.258 1.453) 3.243 10.906 ( -6.034 2.386 -6.203) 8.977 12.027 ( 1.598 -0.358 -2.194) 2.738 12.049 ( 2.153 3.880 -2.171) 4.940 12.320 ( -1.625 0.099 7.812) 7.980 12.452 ( -5.713 5.939 13.047) 15.432 12.844 ( 4.641 -12.142 10.306) 16.588 13.224 ( -4.247 -12.797 -3.813) 14.012 13.418 ( 4.843 4.724 4.134) 7.929 13.534 ( 3.527 0.917 1.799) 4.065 14.556 ( 9.058 -1.748 9.700) 13.386 14.650 ( 8.956 -2.710 3.145) 9.872 14.762 ( 6.357 3.666 5.206) 8.997 15.082 ( 7.429 -5.144 6.536) 11.152 15.384 ( 1.985 10.608 -13.732) 17.465 15.782 ( -0.873 7.616 3.986) 8.641 16.019 ( -11.983 -4.885 -8.543) 15.506 16.153 ( -10.021 -2.646 -2.507) 10.664 19.223 ( 0.593 1.145 -2.187) 2.539 19.353 ( -4.773 -1.714 4.275) 6.633 24.629 ( -2.726 1.283 3.131) 4.345 24.737 ( -3.713 -1.421 1.653) 4.306 26.068 ( 5.991 1.917 0.077) 6.291 26.361 ( 1.811 -9.391 -0.468) 9.576 26.768 ( -7.355 8.528 -6.917) 13.216 26.949 ( -1.116 -0.564 -1.826) 2.214 27.097 ( -0.686 0.897 3.555) 3.730 27.164 ( -4.068 0.937 6.081) 7.376 27.227 ( 15.001 7.573 13.957) 21.845 28.103 ( -2.938 -14.719 10.196) 18.145 28.661 ( -7.476 11.289 -19.091) 23.405 29.233 ( -6.525 -6.170 -28.645) 30.019 32.474 ( -1.316 0.821 -2.469) 2.916 32.523 ( -4.736 -0.324 5.342) 7.146 ======================= Grid point 236 (134/150) ======================= q-point: ( 0.45 0.20 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.517 ( 8.635 -13.479 -8.401) 18.079 2.659 ( 14.524 2.584 -8.596) 17.074 2.731 ( -17.356 -5.490 6.846) 19.448 2.906 ( -20.499 -20.380 -10.156) 30.638 3.530 ( -3.404 5.855 -5.186) 8.530 3.622 ( 0.135 3.434 -5.777) 6.722 3.726 ( -6.233 10.410 -11.061) 16.418 3.879 ( -4.862 7.128 -5.467) 10.214 4.272 ( -5.686 -1.903 10.779) 12.335 4.441 ( 5.930 -9.039 -9.450) 14.359 4.591 ( -2.799 -1.053 2.049) 3.625 4.720 ( -8.394 -2.515 -0.405) 8.772 4.852 ( 3.206 10.035 -6.429) 12.341 4.990 ( -7.334 7.769 -6.640) 12.579 5.426 ( 4.865 -8.441 6.503) 11.714 5.734 ( -4.272 -13.387 -7.756) 16.051 5.999 ( 12.396 14.032 0.416) 18.728 6.202 ( -3.189 8.859 -1.879) 9.601 6.341 ( -7.844 2.694 -6.911) 10.795 6.414 ( -9.140 1.469 -3.951) 10.065 7.161 ( -2.847 -2.978 1.603) 4.420 7.172 ( -0.997 -3.183 -0.600) 3.389 7.839 ( 3.457 -0.926 2.991) 4.664 7.923 ( 2.648 2.302 -1.174) 3.700 8.154 ( 2.145 -0.611 1.318) 2.590 8.205 ( 1.415 -5.771 -2.800) 6.568 8.903 ( -1.538 4.776 2.045) 5.418 8.970 ( -1.702 2.590 -4.032) 5.085 9.918 ( -0.275 2.435 11.685) 11.939 10.166 ( 2.012 -3.557 7.187) 8.268 10.248 ( -2.787 2.957 -9.699) 10.515 10.451 ( -5.951 -1.216 -10.450) 12.087 10.726 ( -0.838 0.432 -0.184) 0.960 10.788 ( -4.236 1.291 -3.894) 5.897 12.043 ( 1.482 -1.412 -2.169) 2.982 12.051 ( -1.348 -1.239 -0.493) 1.896 12.369 ( -0.795 4.178 7.273) 8.425 12.417 ( 6.030 5.491 -2.700) 8.591 12.956 ( 4.757 -11.808 6.785) 14.426 13.139 ( -3.359 -13.672 -4.120) 14.669 13.514 ( 3.857 3.220 3.398) 6.066 13.576 ( 0.386 1.443 0.804) 1.696 14.698 ( 3.825 1.058 7.756) 8.713 14.795 ( 4.667 -0.845 0.053) 4.743 14.877 ( 4.458 4.440 11.000) 12.672 15.196 ( 2.565 -2.310 -2.253) 4.122 15.408 ( 3.699 4.712 -3.156) 6.771 15.733 ( -10.329 0.072 -5.927) 11.909 15.826 ( -0.631 1.421 3.051) 3.424 15.981 ( -6.615 -1.064 -2.884) 7.294 19.249 ( 2.175 -0.210 -1.324) 2.555 19.270 ( -3.916 -0.356 2.596) 4.712 24.617 ( 1.128 0.781 1.306) 1.895 24.686 ( -1.365 -0.932 -1.970) 2.572 26.181 ( 5.089 1.118 4.111) 6.637 26.354 ( -3.763 -4.798 -0.712) 6.139 26.682 ( 0.239 4.737 -0.314) 4.753 26.870 ( -6.004 -1.639 -5.836) 8.531 27.095 ( 0.850 0.276 1.258) 1.543 27.104 ( -1.845 0.114 2.785) 3.342 27.553 ( 14.346 6.608 18.533) 24.350 28.127 ( 0.454 -9.486 5.799) 11.127 28.468 ( -7.110 9.714 -8.798) 14.910 29.016 ( -9.594 -5.982 -28.331) 30.503 32.455 ( -3.073 0.282 3.541) 4.697 32.475 ( 1.958 -0.229 -2.984) 3.576 ======================= Grid point 237 (135/150) ======================= q-point: (-0.45 0.20 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( -14.235 2.213 13.467) 19.720 2.484 ( -18.474 -14.314 -2.463) 23.500 2.779 ( 13.458 -22.418 -4.879) 26.599 2.996 ( 15.812 -9.981 -7.022) 19.974 3.355 ( -10.963 9.316 6.098) 15.626 3.507 ( -7.963 7.337 -3.444) 11.362 3.668 ( -8.841 7.673 7.973) 14.164 3.828 ( 8.929 10.616 -1.575) 13.961 4.203 ( -5.725 -6.424 7.829) 11.633 4.542 ( -5.109 0.523 -7.085) 8.751 4.573 ( 0.846 -5.028 0.452) 5.118 4.619 ( 8.734 -2.693 3.550) 9.805 4.871 ( -2.351 8.361 -4.458) 9.763 4.986 ( 8.818 11.298 -3.902) 14.853 5.468 ( -5.159 -7.635 3.428) 9.831 5.725 ( 7.637 -7.644 -5.657) 12.196 5.935 ( -10.502 3.521 1.421) 11.168 6.239 ( 0.563 1.880 1.978) 2.786 6.278 ( -3.541 1.694 -5.529) 6.781 6.438 ( 16.357 7.561 -5.197) 18.754 7.077 ( -2.780 -1.409 5.214) 6.074 7.223 ( 2.805 -1.086 -1.022) 3.177 7.862 ( -1.764 -1.919 0.731) 2.707 7.949 ( 0.874 -0.423 -3.986) 4.103 8.150 ( -2.105 -0.732 1.376) 2.619 8.186 ( -3.420 -2.874 -0.747) 4.529 8.907 ( 1.803 2.719 0.722) 3.341 8.986 ( 3.854 3.118 -4.561) 6.736 9.966 ( 2.267 3.139 12.983) 13.548 10.166 ( 0.293 2.433 -9.787) 10.089 10.253 ( 1.981 -2.782 8.153) 8.840 10.337 ( -4.076 -1.117 -7.376) 8.501 10.677 ( -2.616 0.842 3.557) 4.495 10.782 ( 2.989 0.849 -2.373) 3.910 12.033 ( 0.315 -0.063 -1.562) 1.595 12.059 ( -1.018 3.786 0.119) 3.923 12.384 ( 3.852 -0.081 -2.603) 4.650 12.575 ( 9.426 3.771 -9.975) 14.232 13.038 ( 1.612 -14.399 2.215) 14.657 13.093 ( 0.722 -11.704 -3.355) 12.196 13.552 ( -2.532 2.734 -0.336) 3.741 13.573 ( 1.276 1.319 1.352) 2.279 14.731 ( -1.972 1.950 5.365) 6.040 14.809 ( -2.300 -0.347 -3.013) 3.806 14.981 ( 2.693 5.199 13.143) 14.388 15.152 ( -4.004 1.751 -13.386) 14.081 15.462 ( -11.120 -1.998 -1.286) 11.371 15.564 ( 7.217 -0.874 7.128) 10.181 15.880 ( -0.070 0.870 0.524) 1.018 15.918 ( 4.263 1.425 1.304) 4.680 19.202 ( -2.889 1.385 2.830) 4.275 19.320 ( 4.812 -1.516 -1.874) 5.382 24.676 ( 4.712 0.026 -0.990) 4.815 24.681 ( 1.736 -0.096 -4.958) 5.254 26.215 ( -9.306 0.213 0.951) 9.357 26.272 ( 2.666 -1.117 6.984) 7.558 26.725 ( -6.222 0.041 -4.010) 7.402 26.760 ( 5.656 -0.550 4.454) 7.220 27.113 ( 2.669 0.568 -0.859) 2.861 27.156 ( 4.932 -0.450 -1.897) 5.304 27.841 ( 11.158 4.908 19.976) 23.401 27.969 ( -14.250 4.335 -20.434) 25.286 28.488 ( 5.987 -1.402 21.993) 22.837 28.772 ( -9.221 -5.850 -25.176) 27.442 32.423 ( -0.800 1.367 2.214) 2.722 32.536 ( 5.054 -1.442 -4.493) 6.914 ======================= Grid point 238 (136/150) ======================= q-point: (-0.36 0.20 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.158 ( -9.819 4.681 9.890) 14.702 2.296 ( 2.303 -1.045 2.152) 3.321 3.025 ( 9.125 -16.191 15.511) 24.208 3.047 ( -12.861 -4.543 13.140) 18.940 3.324 ( -3.355 1.264 1.975) 4.093 3.373 ( 7.449 -8.084 9.778) 14.712 3.616 ( 0.680 8.604 18.760) 20.650 3.995 ( 7.537 10.758 -5.681) 14.311 4.145 ( -0.969 -2.943 4.602) 5.547 4.467 ( -1.342 0.233 0.056) 1.363 4.573 ( -1.881 -3.800 3.616) 5.573 4.735 ( -1.128 -10.286 7.899) 13.018 4.887 ( 7.632 16.040 -8.145) 19.542 5.176 ( 8.759 10.586 1.106) 13.784 5.395 ( 1.959 3.490 2.266) 4.599 5.746 ( -3.558 4.758 -3.573) 6.933 5.914 ( 4.289 -14.044 -9.853) 17.684 6.226 ( 3.103 0.046 2.213) 3.812 6.319 ( 4.024 -0.471 5.784) 7.062 6.681 ( 7.970 0.322 -0.168) 7.978 7.082 ( 2.010 1.873 0.599) 2.812 7.292 ( 4.951 -0.646 3.150) 5.903 7.793 ( -4.551 -4.191 -3.655) 7.186 7.915 ( -3.909 -1.589 -4.750) 6.353 8.084 ( -5.387 -1.871 0.856) 5.767 8.134 ( 0.999 -0.511 0.678) 1.311 8.976 ( 5.050 1.840 -0.937) 5.455 9.063 ( 4.206 2.926 -3.361) 6.128 10.039 ( 2.823 1.775 7.548) 8.252 10.188 ( 2.523 3.706 -5.305) 6.946 10.230 ( -2.896 -1.219 -5.473) 6.311 10.354 ( 4.800 -2.266 11.520) 12.684 10.696 ( 3.831 2.241 6.282) 7.691 10.864 ( 5.880 1.298 -1.974) 6.337 11.967 ( -5.955 4.217 2.556) 7.732 12.090 ( 3.598 6.170 -4.149) 8.260 12.470 ( 4.272 -3.314 -7.395) 9.161 12.724 ( 8.308 1.616 -11.750) 14.481 13.042 ( 1.765 -13.279 -10.295) 16.894 13.159 ( 4.661 -12.666 2.670) 13.758 13.480 ( -4.316 4.401 -1.857) 6.438 13.571 ( -1.498 0.648 -1.733) 2.380 14.644 ( -7.797 0.661 2.106) 8.103 14.712 ( -6.780 -2.086 -3.845) 8.069 14.935 ( -8.586 0.975 -6.356) 10.727 15.108 ( 0.707 9.127 6.229) 11.073 15.218 ( -11.187 -2.881 -4.317) 12.332 15.785 ( 11.660 -0.449 11.124) 16.122 15.867 ( 0.035 0.188 -1.599) 1.610 16.078 ( 9.656 0.085 5.063) 10.903 19.171 ( -0.914 3.418 2.871) 4.556 19.423 ( 5.966 -2.796 -2.472) 7.037 24.731 ( 4.727 0.747 -7.061) 8.530 24.791 ( 7.390 -0.727 -3.600) 8.253 26.027 ( -10.075 1.926 4.045) 11.027 26.303 ( -1.127 -7.551 6.028) 9.727 26.662 ( 1.165 6.256 2.554) 6.857 26.880 ( 4.776 -1.617 4.403) 6.694 27.182 ( 4.404 0.612 -4.674) 6.451 27.256 ( 5.078 -0.977 -3.785) 6.408 27.593 ( -18.893 9.597 -20.946) 29.796 28.051 ( 6.423 0.236 16.771) 17.960 28.605 ( -2.423 -4.178 -15.559) 16.291 28.671 ( 6.551 -3.699 26.750) 27.788 32.434 ( 1.494 2.662 1.612) 3.452 32.645 ( 7.130 -2.563 -6.671) 10.095 ======================= Grid point 239 (137/150) ======================= q-point: (-0.27 0.20 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( -5.697 3.013 10.558) 12.370 2.481 ( 12.695 12.805 6.741) 19.251 2.811 ( -6.646 -7.217 4.008) 10.598 3.193 ( -7.428 7.129 18.411) 21.094 3.236 ( 3.545 0.235 27.818) 28.044 3.612 ( 9.120 -12.906 13.487) 20.776 3.733 ( 7.425 -8.131 12.408) 16.589 4.058 ( 0.771 -0.648 -5.498) 5.590 4.218 ( 7.304 4.322 3.362) 9.129 4.426 ( -4.172 -5.261 5.345) 8.582 4.532 ( -2.222 -4.748 8.582) 10.056 4.720 ( -0.018 -9.020 8.383) 12.314 5.078 ( 12.375 18.910 -5.394) 23.234 5.283 ( 3.085 15.751 6.590) 17.350 5.597 ( 13.005 5.891 5.755) 15.393 5.721 ( 3.510 2.183 -6.323) 7.554 5.885 ( -3.469 -0.620 -6.081) 7.028 6.346 ( 5.023 -1.347 8.024) 9.562 6.418 ( 3.958 -2.287 5.047) 6.810 6.809 ( 7.918 -8.781 -0.404) 11.831 7.105 ( 0.242 -2.056 1.501) 2.557 7.412 ( 4.961 -0.521 1.505) 5.211 7.676 ( -7.034 -3.834 0.750) 8.046 7.802 ( -5.965 -1.215 -5.979) 8.533 8.046 ( 2.686 -3.683 0.550) 4.591 8.205 ( 6.107 -1.940 -1.273) 6.533 9.081 ( 5.568 2.159 0.215) 5.975 9.128 ( 3.504 2.352 -2.708) 5.014 10.099 ( 1.431 -0.156 -2.556) 2.933 10.148 ( -0.047 0.068 0.076) 0.112 10.288 ( 4.913 4.135 -0.062) 6.422 10.496 ( 6.924 -3.000 12.385) 14.503 10.836 ( 8.759 3.045 6.427) 11.282 10.998 ( 8.563 0.990 -3.611) 9.346 11.852 ( -5.917 2.577 0.824) 6.506 12.145 ( 2.232 10.176 -2.740) 10.772 12.484 ( -0.905 -5.210 -6.085) 8.061 12.842 ( 5.528 0.141 -9.409) 10.914 13.087 ( 5.753 -7.480 -15.368) 18.034 13.255 ( 3.511 -11.579 1.013) 12.142 13.389 ( -4.383 5.397 -2.232) 7.302 13.524 ( -1.410 2.310 -6.296) 6.853 14.438 ( -13.495 -1.365 -1.532) 13.650 14.538 ( -10.576 -4.053 -5.937) 12.788 14.721 ( -11.017 1.271 -7.560) 13.421 14.960 ( -12.660 8.169 3.199) 15.403 15.195 ( 4.697 -3.661 0.530) 5.979 15.865 ( -0.100 0.088 -0.983) 0.992 16.041 ( 12.246 -0.418 9.844) 15.718 16.284 ( 10.076 -0.930 4.737) 11.173 19.178 ( 0.922 5.276 2.987) 6.133 19.525 ( 4.882 -3.456 -3.943) 7.164 24.829 ( 6.694 1.382 -7.743) 10.328 24.937 ( 8.588 -1.322 -6.534) 10.871 25.857 ( -8.474 2.851 6.388) 10.988 26.269 ( -2.909 -12.675 3.868) 13.568 26.783 ( 9.149 8.481 8.419) 15.051 26.927 ( -1.334 -0.634 0.703) 1.635 27.122 ( -17.007 8.484 -13.314) 23.205 27.269 ( 2.127 1.022 -7.171) 7.549 27.359 ( 2.421 4.589 -7.158) 8.841 28.172 ( 4.146 -6.821 11.648) 14.121 28.631 ( 6.077 -1.122 -2.999) 6.869 28.825 ( 3.535 -3.826 26.761) 27.263 32.484 ( 3.249 3.862 1.882) 5.386 32.773 ( 7.412 -3.326 -9.074) 12.180 ======================= Grid point 240 (138/150) ======================= q-point: (-0.18 0.20 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.932 ( -6.377 6.368 10.574) 13.893 2.685 ( 5.439 -1.179 4.518) 7.169 2.886 ( 0.722 14.403 10.741) 17.981 3.028 ( 1.280 1.849 1.411) 2.654 3.361 ( 1.500 5.381 18.832) 19.643 3.751 ( 2.234 -7.004 23.650) 24.766 3.888 ( 3.436 -12.500 9.592) 16.126 4.075 ( 3.623 -13.466 1.291) 14.005 4.341 ( 4.634 -0.705 5.195) 6.997 4.461 ( 6.745 -3.488 4.922) 9.049 4.528 ( 0.550 1.058 4.193) 4.359 4.748 ( 0.436 -8.176 5.617) 9.929 5.286 ( 7.452 17.645 -4.495) 19.674 5.363 ( 4.951 14.888 14.568) 21.410 5.667 ( -1.344 4.300 -1.070) 4.631 5.809 ( -0.766 8.651 -6.987) 11.147 6.004 ( 16.867 2.386 13.489) 21.729 6.421 ( 1.589 1.046 5.022) 5.370 6.469 ( 1.149 -1.736 5.492) 5.874 6.937 ( 1.902 0.958 2.583) 3.348 7.191 ( 10.937 -17.007 0.210) 20.222 7.414 ( -5.146 0.071 -2.339) 5.653 7.581 ( -2.741 -8.349 5.757) 10.506 7.691 ( -3.586 -1.781 -1.386) 4.237 8.166 ( 7.221 -1.755 4.845) 8.871 8.355 ( 9.751 -3.957 -4.280) 11.361 9.183 ( 5.292 2.467 0.843) 5.900 9.208 ( 5.110 1.508 -0.641) 5.366 10.104 ( 2.428 1.106 -4.927) 5.603 10.209 ( 3.374 0.288 4.081) 5.303 10.371 ( 3.787 2.775 -2.113) 5.149 10.639 ( 4.591 -4.883 7.450) 10.022 11.035 ( 10.109 2.237 5.401) 11.677 11.174 ( 10.251 0.231 -4.575) 11.227 11.751 ( -4.359 -1.582 -0.568) 4.672 12.138 ( -3.127 4.043 -1.817) 5.424 12.465 ( 1.367 3.037 -3.656) 4.945 12.879 ( 0.010 1.963 -5.825) 6.147 13.193 ( 6.462 -5.611 -12.700) 15.315 13.259 ( -1.722 -1.684 -3.236) 4.034 13.315 ( -1.862 3.182 -1.416) 3.949 13.534 ( 3.694 3.254 -8.385) 9.724 14.125 ( -18.064 -2.474 -3.965) 18.659 14.264 ( -15.851 -3.324 -8.792) 18.428 14.505 ( -9.846 2.442 -4.484) 11.091 14.719 ( -12.996 10.847 3.890) 17.369 15.330 ( 9.756 -10.949 -3.689) 15.122 15.846 ( -2.243 -3.921 1.216) 4.678 16.284 ( 10.874 1.028 6.561) 12.741 16.469 ( 7.993 -1.477 2.416) 8.480 19.215 ( 2.285 6.448 3.019) 7.477 19.577 ( 1.104 -2.862 -5.464) 6.266 24.946 ( 6.491 1.677 -6.084) 9.053 25.084 ( 7.826 -1.779 -9.127) 12.153 25.735 ( -5.224 3.409 6.386) 8.927 26.190 ( -7.434 -13.616 1.893) 15.629 26.730 ( -12.910 8.621 -5.126) 16.349 26.844 ( -5.238 -0.296 -1.794) 5.544 27.088 ( 14.006 9.657 6.255) 18.126 27.298 ( 1.515 -0.101 -7.088) 7.248 27.412 ( 4.368 5.814 -3.280) 7.978 28.261 ( 1.595 -6.804 11.773) 13.691 28.783 ( 9.381 -3.313 -1.101) 10.010 28.914 ( 0.390 -3.630 24.527) 24.797 32.561 ( 4.053 4.597 3.081) 6.859 32.880 ( 5.350 -3.415 -10.996) 12.697 ======================= Grid point 241 (139/150) ======================= q-point: (-0.09 0.20 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.949 ( 8.301 12.722 2.256) 15.357 2.478 ( -20.588 10.255 13.464) 26.652 3.042 ( 15.697 -5.251 -12.084) 20.494 3.075 ( -9.529 -11.687 20.239) 25.239 3.515 ( 15.541 10.426 -1.766) 18.797 3.745 ( -7.576 8.673 16.607) 20.209 3.961 ( 2.268 -9.727 16.433) 19.231 4.169 ( 3.880 -11.302 1.409) 12.032 4.463 ( 3.204 -3.397 9.656) 10.726 4.538 ( 4.932 2.560 -2.878) 6.258 4.629 ( 6.926 -2.781 0.912) 7.519 4.750 ( -1.138 -9.440 2.784) 9.908 5.369 ( 3.293 11.366 1.955) 11.993 5.475 ( 1.311 5.239 4.625) 7.111 5.627 ( -1.724 7.443 7.467) 10.683 5.837 ( 4.482 15.120 -5.643) 16.750 6.291 ( 8.614 1.054 7.039) 11.174 6.434 ( -0.371 1.910 0.085) 1.947 6.541 ( 6.080 0.532 11.776) 13.264 6.939 ( -0.728 2.680 1.680) 3.245 7.281 ( -5.370 -2.262 3.425) 6.759 7.444 ( 7.773 -11.942 -1.772) 14.359 7.544 ( 2.767 -7.482 -3.559) 8.735 7.673 ( -1.065 -9.747 10.304) 14.224 8.291 ( 3.434 0.247 12.531) 12.995 8.531 ( 8.213 -4.701 -6.536) 11.501 9.296 ( 4.068 1.723 3.293) 5.510 9.314 ( 7.245 1.552 -2.167) 7.719 10.189 ( 6.491 1.234 -1.643) 6.808 10.267 ( 2.013 2.214 4.897) 5.739 10.420 ( 1.901 0.248 -6.463) 6.742 10.659 ( -3.579 -4.356 -2.225) 6.061 11.231 ( 8.210 2.000 5.613) 10.144 11.356 ( 8.548 0.006 -4.296) 9.567 11.697 ( -0.198 -8.575 -0.205) 8.580 12.023 ( -7.428 -7.534 -4.148) 11.365 12.529 ( 4.607 13.616 1.005) 14.409 12.831 ( -3.640 6.587 -4.852) 8.954 13.218 ( -0.053 1.965 0.993) 2.203 13.233 ( 0.629 3.267 -1.976) 3.869 13.359 ( 4.161 -5.121 -5.288) 8.456 13.591 ( 2.334 4.092 -9.908) 10.970 13.750 ( -18.540 -2.438 -3.581) 19.039 13.936 ( -14.381 -3.222 -9.360) 17.459 14.353 ( -3.498 6.740 -4.653) 8.905 14.477 ( -12.528 12.601 4.511) 18.332 15.536 ( 11.660 -13.597 -6.520) 19.061 15.774 ( -5.772 -9.039 2.658) 11.049 16.472 ( 7.029 1.350 4.241) 8.320 16.595 ( 5.014 -2.119 -1.941) 5.779 19.276 ( 3.205 6.272 3.467) 7.850 19.541 ( -3.489 -0.825 -5.414) 6.494 25.036 ( 3.057 1.551 -0.566) 3.474 25.182 ( 3.535 -2.166 -9.347) 10.225 25.695 ( 0.577 3.042 2.670) 4.088 25.970 ( -13.057 -4.942 -0.124) 13.961 26.614 ( -0.064 3.255 0.924) 3.384 26.736 ( -4.708 -0.890 -1.021) 4.899 27.270 ( 2.092 -0.043 -3.241) 3.857 27.294 ( -0.580 0.059 -4.886) 4.921 27.636 ( 19.765 10.998 5.337) 23.240 28.236 ( -7.176 -1.196 9.785) 12.193 28.937 ( -0.368 -4.610 17.825) 18.415 28.985 ( 9.723 -6.894 -2.711) 12.224 32.645 ( 3.501 4.513 5.030) 7.611 32.922 ( 1.246 -2.586 -11.507) 11.860 ======================= Grid point 242 (140/150) ======================= q-point: ( 0.00 0.40 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.327 ( -12.915 9.526 10.252) 19.043 2.474 ( 4.862 -2.846 0.249) 5.639 2.785 ( 1.416 13.779 13.925) 19.642 3.091 ( 13.708 -14.171 -10.289) 22.239 3.768 ( -2.484 2.789 2.266) 4.368 3.789 ( 0.122 -1.270 4.007) 4.205 4.030 ( 0.477 5.308 15.949) 16.816 4.152 ( 4.782 -3.425 3.012) 6.608 4.475 ( -0.681 -1.639 0.324) 1.805 4.501 ( 1.981 -7.036 -3.537) 8.120 4.653 ( 1.609 1.241 -2.664) 3.350 4.697 ( 4.820 -2.923 -5.913) 8.170 5.463 ( -3.911 1.639 -0.670) 4.293 5.471 ( -1.318 0.900 -1.583) 2.248 5.933 ( -0.053 17.155 15.876) 23.374 6.118 ( 2.172 1.644 -1.010) 2.906 6.407 ( 0.633 1.802 1.355) 2.342 6.431 ( -0.201 -0.677 -0.518) 0.876 6.822 ( 7.442 8.218 9.879) 14.850 6.981 ( -2.568 1.789 -4.917) 5.829 7.099 ( 1.227 -7.982 10.282) 13.074 7.275 ( 3.849 -14.489 -6.328) 16.272 7.455 ( -1.110 -0.340 7.095) 7.190 7.528 ( 2.281 -7.906 2.185) 8.513 8.392 ( -1.030 5.512 5.078) 7.565 8.510 ( 0.532 -6.409 -4.558) 7.883 9.390 ( 1.046 2.961 0.904) 3.269 9.432 ( 2.992 -1.214 -3.153) 4.513 10.295 ( 0.128 2.120 1.594) 2.655 10.332 ( -0.701 -1.864 -1.743) 2.647 10.462 ( 3.427 2.658 -1.341) 4.540 10.507 ( -1.467 -1.767 -4.948) 5.455 11.380 ( -3.643 4.567 4.182) 7.185 11.448 ( 0.824 -1.046 -1.713) 2.169 11.597 ( 3.398 -4.948 -2.003) 6.328 11.643 ( -2.456 -8.676 -5.946) 10.801 12.827 ( -1.112 8.134 5.912) 10.117 12.882 ( -2.541 2.755 1.889) 4.197 13.266 ( -10.156 5.573 3.895) 12.222 13.332 ( 2.340 -1.642 -0.274) 2.871 13.397 ( 7.674 0.651 -1.906) 7.934 13.408 ( -3.769 -0.345 -2.821) 4.721 13.593 ( -3.135 0.946 -4.139) 5.278 13.655 ( -2.385 -5.524 -9.321) 11.095 14.522 ( -8.865 13.077 5.085) 16.597 14.607 ( 3.497 6.850 -2.396) 8.056 15.409 ( -3.016 -6.846 -0.285) 7.486 15.495 ( 10.583 -13.182 -8.004) 18.704 16.573 ( 0.370 1.130 0.311) 1.229 16.604 ( 0.967 -2.261 -2.815) 3.738 19.430 ( 0.470 3.476 1.663) 3.881 19.461 ( -2.739 0.052 -1.275) 3.021 25.077 ( -2.915 1.822 3.508) 4.911 25.115 ( -4.108 -2.221 -0.143) 4.672 25.798 ( 3.900 0.766 -2.075) 4.483 25.803 ( 0.312 0.252 -2.699) 2.728 26.653 ( 1.323 -0.037 0.459) 1.401 26.657 ( -0.858 -0.495 0.028) 0.991 27.255 ( -1.775 0.025 -1.566) 2.367 27.256 ( -1.913 -0.104 -1.706) 2.565 28.121 ( -5.973 4.649 5.099) 9.126 28.147 ( 7.452 2.425 2.723) 8.297 28.881 ( 1.463 0.800 6.206) 6.426 28.987 ( 8.532 -9.786 -3.988) 13.582 32.782 ( 0.208 4.143 1.098) 4.292 32.847 ( -1.556 -2.664 -5.275) 6.111 ======================= Grid point 243 (141/150) ======================= q-point: ( 0.09 0.40 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.184 ( -1.713 10.207 1.497) 10.458 2.395 ( -6.350 -11.631 12.968) 18.541 3.107 ( 22.079 19.939 -3.790) 29.990 3.363 ( 14.563 -7.257 -11.410) 19.873 3.649 ( -9.950 16.464 5.979) 20.145 3.790 ( -0.390 -5.455 2.052) 5.842 3.955 ( -7.588 -2.952 3.588) 8.898 4.122 ( -9.158 -13.126 1.000) 16.036 4.446 ( 0.022 2.689 -1.068) 2.894 4.543 ( 2.267 -8.398 -7.733) 11.638 4.688 ( 2.071 3.521 -6.366) 7.564 4.763 ( 2.542 -3.455 -7.278) 8.448 5.368 ( -5.817 4.190 4.307) 8.363 5.435 ( -3.004 -2.576 3.787) 5.477 5.975 ( 1.548 16.861 10.172) 19.752 6.156 ( 1.652 2.888 -5.007) 6.011 6.399 ( -1.284 -1.667 1.335) 2.492 6.400 ( -3.456 -1.533 -2.160) 4.354 6.846 ( -5.518 1.522 -6.075) 8.347 6.946 ( -4.135 -8.881 3.272) 10.328 7.126 ( 3.238 7.556 -3.254) 8.841 7.342 ( 4.359 -7.757 -0.341) 8.904 7.457 ( 1.957 2.349 -1.034) 3.228 7.593 ( 3.480 -12.861 -0.512) 13.333 8.312 ( -7.937 4.667 4.114) 10.085 8.426 ( -8.027 -6.487 -4.326) 11.191 9.358 ( -3.851 3.981 -2.173) 5.949 9.415 ( -3.507 -1.617 -5.506) 6.725 10.217 ( -8.244 2.048 -1.281) 8.591 10.242 ( -5.436 -0.494 1.440) 5.646 10.521 ( 3.262 4.269 -4.611) 7.080 10.585 ( 7.388 -2.595 -1.963) 8.073 11.227 ( -10.107 2.550 3.724) 11.069 11.310 ( -10.926 -5.673 0.255) 12.314 11.682 ( 7.404 1.834 -3.806) 8.525 11.785 ( 10.150 -8.592 -0.875) 13.327 12.791 ( -4.339 5.187 10.444) 12.442 12.825 ( -4.058 3.844 5.393) 7.767 13.035 ( -13.032 8.508 7.076) 17.097 13.189 ( -5.678 -5.466 -0.303) 7.887 13.420 ( -2.317 6.575 -2.401) 7.373 13.541 ( -3.271 -5.290 -3.655) 7.214 13.672 ( 15.876 2.781 1.403) 16.178 13.764 ( 13.969 -4.846 0.672) 14.801 14.422 ( -1.101 10.836 4.795) 11.900 14.622 ( -1.267 -6.831 4.426) 8.237 15.429 ( 5.551 8.944 -8.627) 13.610 15.679 ( 9.373 -13.564 -8.507) 18.553 16.527 ( -4.826 1.095 -1.358) 5.132 16.574 ( -3.656 -3.302 -2.776) 5.655 19.398 ( -3.209 3.286 1.052) 4.712 19.436 ( -0.772 -0.526 3.281) 3.412 24.995 ( -6.500 0.138 6.290) 9.047 24.998 ( -7.265 -0.193 5.364) 9.033 25.844 ( 4.528 3.647 -4.872) 7.585 25.916 ( 7.606 -3.963 -3.000) 9.086 26.671 ( 2.427 1.944 -0.254) 3.120 26.704 ( 3.760 -1.514 0.019) 4.053 27.212 ( -2.382 0.455 2.060) 3.182 27.221 ( -2.024 -0.461 2.204) 3.028 27.927 ( -12.806 14.135 1.127) 19.106 28.188 ( -4.252 -12.971 1.888) 13.781 28.958 ( 5.665 7.891 -4.666) 10.777 29.141 ( 8.237 -11.042 -12.157) 18.373 32.759 ( -2.940 1.721 2.432) 4.185 32.777 ( -4.490 -0.201 -3.156) 5.492 ======================= Grid point 244 (142/150) ======================= q-point: ( 0.18 0.40 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.245 ( 6.383 8.461 -3.816) 11.264 2.418 ( 8.457 -9.021 3.192) 12.770 3.276 ( -14.150 27.213 6.173) 31.286 3.485 ( 3.438 10.627 -9.859) 14.898 3.666 ( 13.374 -0.010 -2.029) 13.527 3.762 ( -8.674 -13.517 0.024) 16.060 3.814 ( -5.987 -8.092 -1.888) 10.242 3.921 ( -2.299 -8.649 -1.257) 9.038 4.454 ( 1.464 2.536 -7.073) 7.655 4.569 ( 2.949 -10.079 -15.496) 18.719 4.672 ( -2.518 4.130 -6.112) 7.794 4.752 ( -2.034 -3.371 -7.854) 8.786 5.266 ( -6.089 5.543 9.138) 12.301 5.370 ( -4.873 -4.871 8.702) 11.100 6.024 ( 1.646 18.975 4.266) 19.518 6.085 ( -8.821 8.864 -10.168) 16.117 6.233 ( -14.104 -2.840 -8.478) 16.699 6.412 ( 2.935 -11.100 2.201) 11.691 6.693 ( -6.739 0.268 -11.149) 13.031 6.768 ( -11.040 -13.257 -5.646) 18.152 7.218 ( 4.874 13.717 -4.107) 15.125 7.421 ( 2.698 -3.704 1.122) 4.718 7.545 ( 7.549 1.018 -5.945) 9.663 7.666 ( 5.110 -10.244 -4.640) 12.352 8.131 ( -10.453 1.600 2.912) 10.969 8.211 ( -12.152 -5.774 -1.707) 13.562 9.261 ( -4.989 3.815 -2.580) 6.789 9.305 ( -5.994 -0.461 -4.843) 7.719 10.067 ( -6.508 3.609 2.829) 7.962 10.125 ( -6.544 -2.331 3.702) 7.871 10.568 ( 1.673 6.719 -6.034) 9.184 10.684 ( 2.547 -5.747 -6.682) 9.174 11.049 ( -8.463 2.661 3.455) 9.521 11.116 ( -8.346 -4.119 1.201) 9.384 11.830 ( 8.351 5.418 -2.651) 10.302 11.976 ( 9.290 -9.668 0.097) 13.408 12.686 ( -10.749 5.659 14.881) 19.210 12.739 ( -7.915 -0.403 16.335) 18.156 12.807 ( -9.360 15.652 1.271) 18.281 13.120 ( -3.004 -13.213 -2.973) 13.872 13.379 ( -0.365 5.697 1.698) 5.956 13.455 ( -3.260 -3.287 -0.247) 4.636 13.989 ( 15.771 1.603 4.597) 16.505 14.068 ( 15.535 -5.388 3.171) 16.746 14.502 ( 7.440 5.733 3.606) 10.061 14.646 ( 4.031 -8.862 5.747) 11.305 15.540 ( 6.860 15.577 -11.323) 20.443 15.807 ( 5.297 -9.914 -6.807) 13.141 16.389 ( -8.807 1.237 -3.017) 9.391 16.456 ( -7.847 -4.508 -1.955) 9.258 19.341 ( -2.901 4.471 1.516) 5.541 19.415 ( -2.209 -3.127 4.259) 5.727 24.859 ( -7.442 1.506 5.755) 9.527 24.887 ( -6.450 -1.453 6.969) 9.606 25.932 ( 5.297 5.094 -4.723) 8.735 26.049 ( 6.188 -7.510 -2.836) 10.136 26.762 ( 6.905 3.212 1.735) 7.811 26.800 ( 6.033 -1.253 1.102) 6.260 27.168 ( -2.913 0.957 3.692) 4.799 27.182 ( -2.620 -0.373 4.391) 5.127 27.670 ( -12.922 18.785 -0.679) 22.810 28.040 ( -10.042 -20.007 1.376) 22.428 29.033 ( 3.060 10.430 -13.265) 17.150 29.231 ( 3.922 -10.605 -18.898) 22.022 32.671 ( -5.550 1.531 -1.383) 5.921 32.689 ( -4.889 -0.318 3.365) 5.944 ======================= Grid point 245 (143/150) ======================= q-point: ( 0.27 0.40 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( 9.894 14.725 -5.267) 18.506 2.666 ( 12.429 -11.316 -4.889) 17.505 2.941 ( -16.070 19.521 -3.917) 25.586 3.331 ( -18.513 -14.604 -2.836) 23.749 3.532 ( -6.610 -1.049 -5.560) 8.701 3.623 ( -7.222 -8.023 -6.477) 12.589 3.946 ( 8.678 8.576 6.504) 13.826 4.074 ( 10.895 -2.266 -3.139) 11.563 4.447 ( -1.897 2.873 -14.379) 14.785 4.496 ( -7.457 -1.207 -15.341) 17.100 4.669 ( 2.874 -5.046 -12.995) 14.233 4.682 ( -0.773 -4.752 -3.828) 6.150 5.166 ( -6.204 7.473 9.654) 13.694 5.293 ( -4.818 -4.875 11.099) 13.044 5.802 ( -15.750 3.036 -10.621) 19.238 5.845 ( -21.371 -1.075 -12.085) 24.575 6.066 ( 2.307 21.279 -0.761) 21.417 6.462 ( -1.541 -14.691 -0.446) 14.778 6.538 ( -5.334 1.936 -12.162) 13.421 6.627 ( -0.337 -10.832 -12.093) 16.239 7.228 ( -4.046 12.386 -0.554) 13.042 7.415 ( -4.554 -5.855 -2.382) 7.791 7.688 ( 7.407 2.133 -5.324) 9.368 7.771 ( 5.989 -2.658 -3.707) 7.528 7.980 ( -2.855 -1.071 1.755) 3.518 8.043 ( -3.865 -5.646 3.574) 7.720 9.162 ( -5.258 3.091 -0.869) 6.161 9.181 ( -5.599 1.148 -3.344) 6.622 9.992 ( -2.693 1.702 6.379) 7.130 10.029 ( -3.645 -2.022 6.599) 7.805 10.536 ( -3.510 5.537 -8.514) 10.745 10.641 ( -4.392 -6.020 -9.225) 11.859 10.925 ( -5.090 5.196 0.615) 7.300 11.006 ( -3.896 -2.987 -2.085) 5.334 11.983 ( 7.244 6.029 -2.220) 9.682 12.115 ( 3.250 -6.793 1.483) 7.675 12.452 ( -11.857 9.913 12.810) 20.074 12.604 ( -8.024 -6.791 18.392) 21.184 12.703 ( -3.998 12.278 2.720) 13.196 13.022 ( -5.479 -18.887 -4.548) 20.185 13.421 ( 3.634 4.369 3.100) 6.473 13.463 ( 3.141 -0.521 2.255) 3.901 14.288 ( 13.849 0.949 7.198) 15.636 14.351 ( 12.983 -5.106 4.643) 14.704 14.679 ( 9.235 5.113 3.946) 11.269 14.793 ( 8.813 -6.928 5.430) 12.456 15.619 ( 3.453 15.768 -11.618) 19.888 15.857 ( 1.340 -6.561 -5.061) 8.394 16.187 ( -11.031 1.722 -4.057) 11.878 16.275 ( -10.133 -5.423 -1.247) 11.560 19.292 ( -2.370 4.035 1.030) 4.792 19.369 ( -3.319 -3.848 3.769) 6.327 24.740 ( -5.760 2.201 4.674) 7.737 24.782 ( -5.466 -2.211 4.965) 7.708 26.025 ( 5.154 4.909 -3.030) 7.736 26.141 ( 4.231 -7.805 -2.270) 9.164 26.905 ( 4.611 0.920 1.462) 4.924 26.918 ( 4.606 -0.487 0.769) 4.695 27.122 ( -1.377 2.748 3.529) 4.680 27.151 ( -1.015 -0.482 5.255) 5.373 27.460 ( -7.865 20.122 3.772) 21.931 27.857 ( -8.182 -21.222 4.400) 23.167 29.009 ( -2.234 11.188 -19.245) 22.372 29.210 ( -1.621 -10.284 -23.555) 25.753 32.567 ( -4.754 1.893 -0.396) 5.132 32.596 ( -5.159 -1.156 3.449) 6.312 ======================= Grid point 246 (144/150) ======================= q-point: ( 0.36 0.40 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.503 ( -7.981 13.443 -4.261) 16.204 2.622 ( 3.998 13.847 -14.729) 20.607 2.839 ( -11.864 -18.633 -1.269) 22.126 2.928 ( -12.528 -17.977 -10.005) 24.088 3.524 ( 6.904 2.006 -5.725) 9.190 3.551 ( 2.152 -1.411 -4.957) 5.585 4.054 ( 1.171 10.748 6.696) 12.717 4.146 ( -5.683 5.255 -15.843) 17.633 4.292 ( -5.063 -3.612 -2.201) 6.597 4.335 ( -7.992 -7.881 -13.011) 17.183 4.640 ( -1.209 1.122 -6.144) 6.362 4.717 ( 0.003 -6.600 -6.554) 9.301 5.085 ( -2.934 11.851 4.972) 13.183 5.222 ( -5.064 -1.319 7.488) 9.135 5.452 ( -14.500 1.498 -7.790) 16.528 5.550 ( -6.730 -9.729 -8.109) 14.342 6.129 ( 5.140 19.731 -4.277) 20.833 6.354 ( -4.289 -2.066 -8.417) 9.670 6.466 ( -2.757 1.121 -9.207) 9.677 6.618 ( -2.327 -12.540 -8.337) 15.237 7.113 ( -5.424 6.295 4.558) 9.478 7.244 ( -10.507 -6.459 2.621) 12.609 7.790 ( 4.600 5.223 -2.962) 7.564 7.878 ( 5.114 -1.030 -3.333) 6.190 8.038 ( 5.222 -2.810 1.219) 6.054 8.060 ( 4.129 -3.178 2.088) 5.613 9.053 ( -5.161 3.494 -0.679) 6.270 9.080 ( -4.739 0.607 -1.231) 4.934 9.965 ( -1.324 2.748 9.090) 9.588 10.029 ( 1.128 -3.784 8.892) 9.729 10.425 ( -5.148 4.690 -9.727) 11.963 10.521 ( -5.357 -5.472 -10.502) 12.997 10.835 ( -4.277 5.935 -2.382) 7.694 10.914 ( -5.282 -1.912 -4.971) 7.502 12.038 ( -2.134 1.871 1.183) 3.075 12.081 ( -4.329 -1.441 3.017) 5.470 12.391 ( 3.030 8.240 5.931) 10.595 12.575 ( 0.941 -5.022 9.501) 10.788 12.649 ( -1.252 4.879 4.188) 6.551 12.920 ( -4.313 -17.698 -2.197) 18.348 13.505 ( 3.863 3.523 2.835) 5.947 13.540 ( 3.557 -0.492 1.974) 4.098 14.547 ( 11.019 1.079 8.046) 13.687 14.591 ( 10.719 -3.284 5.583) 12.524 14.851 ( 7.292 5.870 5.215) 10.716 14.969 ( 7.750 -6.614 5.718) 11.683 15.619 ( -1.129 13.485 -11.513) 17.767 15.838 ( -2.928 -8.098 -6.585) 10.841 15.970 ( -9.399 5.384 -1.663) 10.958 16.081 ( -9.029 -5.156 -0.562) 10.413 19.258 ( -1.257 2.490 0.388) 2.816 19.309 ( -3.335 -2.821 2.681) 5.125 24.661 ( -3.067 2.107 2.662) 4.575 24.702 ( -3.442 -2.194 2.101) 4.591 26.121 ( 5.141 3.914 0.008) 6.461 26.215 ( 3.773 -6.366 -0.134) 7.401 26.877 ( -5.135 3.785 -5.535) 8.445 26.927 ( -2.747 -1.849 -3.455) 4.786 27.120 ( -1.284 1.514 3.376) 3.916 27.149 ( -2.490 -1.467 3.710) 4.703 27.474 ( 8.016 16.841 15.254) 24.095 27.800 ( 1.491 -17.597 12.502) 21.638 28.875 ( -7.053 11.553 -22.230) 26.026 29.078 ( -6.575 -10.138 -25.951) 28.626 32.493 ( -2.612 1.149 -0.266) 2.866 32.513 ( -3.923 -0.846 2.671) 4.820 ======================= Grid point 247 (145/150) ======================= q-point: ( 0.45 0.40 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.327 ( -3.384 -3.140 -12.717) 13.529 2.454 ( -16.855 -15.887 -10.929) 25.611 2.716 ( 2.422 3.096 -1.664) 4.269 2.761 ( -8.641 -1.928 3.716) 9.602 3.620 ( 2.252 3.703 -4.588) 6.311 3.657 ( 2.450 -0.065 -5.128) 5.683 3.932 ( -5.401 11.465 -12.512) 17.809 4.018 ( -7.694 6.309 -4.404) 10.881 4.189 ( -3.317 -6.403 3.328) 7.942 4.242 ( 0.920 -10.542 -3.618) 11.184 4.593 ( -1.834 1.568 -1.734) 2.971 4.647 ( -4.894 -4.042 -3.435) 7.217 5.072 ( -0.316 10.801 2.863) 11.179 5.155 ( -0.172 6.656 -3.278) 7.421 5.306 ( -1.164 -1.672 1.912) 2.794 5.480 ( -0.763 -13.878 -8.606) 16.347 6.238 ( 4.608 9.618 -0.939) 10.707 6.311 ( 2.378 2.069 -5.764) 6.570 6.378 ( -4.918 2.398 -6.163) 8.242 6.436 ( -13.401 -0.824 -0.851) 13.454 7.101 ( -3.491 -2.255 4.930) 6.448 7.109 ( 2.979 -2.750 0.340) 4.068 7.856 ( 2.307 2.945 -1.278) 3.953 7.925 ( 0.666 -2.967 -4.914) 5.778 8.128 ( 3.008 -0.479 2.147) 3.726 8.145 ( 2.787 -1.219 1.281) 3.301 8.981 ( -2.109 2.977 0.408) 3.671 9.004 ( -2.072 0.504 -1.806) 2.794 9.985 ( 1.131 4.646 11.438) 12.397 10.081 ( 1.959 -5.343 10.309) 11.775 10.318 ( -3.539 4.481 -11.137) 12.516 10.401 ( -4.675 -4.021 -11.138) 12.731 10.762 ( -2.553 2.874 -1.354) 4.076 10.799 ( -4.578 -0.565 -3.387) 5.722 12.016 ( 1.057 -0.907 -1.916) 2.368 12.022 ( -0.315 -1.422 -1.146) 1.853 12.495 ( 2.016 9.236 6.013) 11.203 12.572 ( 1.781 10.768 -1.290) 10.991 12.716 ( 3.990 -12.218 5.094) 13.826 12.847 ( -2.368 -16.196 -2.435) 16.548 13.569 ( 2.130 2.280 2.332) 3.896 13.591 ( 1.209 -0.065 1.241) 1.734 14.727 ( 5.596 2.008 5.899) 8.376 14.767 ( 5.631 -2.077 3.137) 6.773 14.984 ( 5.485 6.740 8.576) 12.209 15.110 ( 5.466 -6.351 5.308) 9.919 15.538 ( -4.303 8.084 -8.406) 12.431 15.673 ( -10.380 -5.909 -8.666) 14.757 15.888 ( -0.482 4.065 2.113) 4.606 15.950 ( -4.129 -2.437 -0.385) 4.810 19.250 ( 0.265 0.319 0.304) 0.515 19.260 ( -1.817 -0.666 1.364) 2.368 24.637 ( 0.379 1.319 0.277) 1.400 24.663 ( -0.567 -1.412 -0.968) 1.804 26.213 ( 3.554 2.386 3.441) 5.492 26.271 ( 0.916 -3.884 2.086) 4.503 26.764 ( -4.152 3.934 -3.855) 6.898 26.827 ( -5.839 -2.904 -5.257) 8.376 27.102 ( -0.175 0.352 1.453) 1.505 27.106 ( -0.935 -0.055 1.687) 1.930 27.720 ( 11.731 10.874 18.822) 24.701 27.932 ( 7.054 -11.396 15.548) 20.527 28.663 ( -9.603 11.143 -19.817) 24.680 28.864 ( -9.773 -10.040 -25.483) 29.081 32.462 ( -1.635 0.409 1.465) 2.233 32.469 ( 0.274 -0.378 -1.002) 1.105 ======================= Grid point 248 (146/150) ======================= q-point: (-0.45 0.40 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( -2.729 -2.934 -4.662) 6.147 2.360 ( 6.208 -14.644 -0.866) 15.929 2.567 ( -7.863 8.665 7.676) 13.994 2.780 ( 1.556 -12.516 4.422) 13.366 3.498 ( -10.704 5.947 3.089) 12.629 3.564 ( -9.569 -0.763 -0.552) 9.615 3.841 ( -5.194 9.847 2.495) 11.409 3.987 ( 3.566 -1.676 -0.872) 4.035 4.132 ( 1.457 7.044 -0.069) 7.193 4.373 ( 6.936 -14.012 -2.175) 15.785 4.560 ( -2.566 1.334 -3.050) 4.203 4.588 ( 0.685 -1.560 1.488) 2.262 5.085 ( 2.760 12.915 0.197) 13.208 5.226 ( 7.444 11.354 -9.062) 16.323 5.317 ( 0.732 -7.653 4.418) 8.867 5.486 ( 4.441 -13.692 -11.263) 18.277 6.138 ( -13.045 13.528 6.302) 19.821 6.277 ( -2.386 1.230 1.060) 2.886 6.291 ( -1.184 0.429 0.922) 1.561 6.416 ( 4.577 -9.493 1.564) 10.655 7.109 ( 3.884 5.240 -0.120) 6.524 7.198 ( 5.059 -2.931 -3.143) 6.638 7.854 ( -2.920 1.129 -0.580) 3.184 7.901 ( -1.540 -3.618 -3.540) 5.291 8.140 ( -1.740 -0.046 0.883) 1.952 8.151 ( -2.482 -1.072 0.680) 2.788 8.974 ( 1.585 3.535 0.273) 3.883 9.013 ( 2.951 -0.435 -1.913) 3.544 10.048 ( 2.540 5.386 11.857) 13.268 10.149 ( 3.129 -4.887 9.500) 11.132 10.246 ( -1.580 2.725 -9.465) 9.975 10.301 ( -3.269 -2.699 -9.311) 10.231 10.724 ( -0.285 3.740 1.789) 4.156 10.779 ( 2.434 -1.565 -0.976) 3.054 12.049 ( 3.970 2.077 -5.055) 6.755 12.093 ( 6.006 -1.306 -7.155) 9.432 12.460 ( -2.898 9.884 4.413) 11.206 12.678 ( 6.842 6.624 -6.944) 11.786 12.728 ( -2.421 -16.209 3.373) 16.732 12.863 ( 3.614 -11.905 -3.421) 12.903 13.590 ( -1.200 1.191 0.319) 1.720 13.594 ( -0.103 0.688 0.991) 1.210 14.769 ( -2.187 1.963 2.368) 3.774 14.798 ( -2.560 -1.059 -0.958) 2.932 15.085 ( 1.151 5.397 7.180) 9.055 15.158 ( -1.476 -1.902 -3.787) 4.487 15.456 ( -6.910 1.917 0.099) 7.172 15.517 ( 1.652 -3.715 2.827) 4.952 15.911 ( 1.019 1.894 0.245) 2.164 15.932 ( 3.576 -0.138 0.969) 3.708 19.238 ( -0.227 2.321 1.189) 2.618 19.283 ( 2.720 -2.399 -0.600) 3.676 24.677 ( 3.810 0.091 -2.319) 4.461 24.679 ( 2.739 -0.133 -3.771) 4.663 26.225 ( -6.014 0.872 2.675) 6.639 26.247 ( -1.762 -1.422 4.661) 5.182 26.731 ( -1.876 0.602 -0.746) 2.107 26.746 ( 2.392 -0.894 2.157) 3.342 27.127 ( 3.223 0.915 -1.280) 3.586 27.144 ( 4.085 -0.806 -1.724) 4.507 27.951 ( 7.262 6.054 15.131) 17.841 28.021 ( -2.917 -0.341 -2.083) 3.601 28.501 ( -2.040 4.045 1.517) 4.777 28.631 ( -8.330 -8.596 -18.259) 21.833 32.457 ( 1.015 2.242 0.197) 2.469 32.501 ( 3.253 -2.288 -2.354) 4.622 ======================= Grid point 249 (147/150) ======================= q-point: (-0.36 0.40 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.277 ( 0.195 11.093 15.341) 18.933 2.418 ( 5.333 8.934 8.159) 13.222 2.664 ( 11.944 -16.526 9.450) 22.474 2.790 ( -1.360 -17.746 4.807) 18.436 3.348 ( -3.262 3.417 9.481) 10.593 3.386 ( -6.805 0.231 7.930) 10.452 3.811 ( -1.815 12.392 15.548) 19.965 4.025 ( 1.167 -8.918 6.716) 11.225 4.204 ( 2.865 10.335 -3.088) 11.161 4.409 ( -3.122 -11.583 3.173) 12.409 4.501 ( -2.879 3.367 0.200) 4.434 4.588 ( -2.164 -5.846 4.783) 7.857 5.219 ( 11.173 18.169 -8.702) 23.036 5.356 ( 8.694 7.496 -1.691) 11.603 5.431 ( 11.156 -1.073 -5.016) 12.278 5.578 ( 6.344 -17.552 -13.437) 22.997 5.988 ( -3.269 18.245 8.141) 20.245 6.236 ( 0.128 -1.814 3.412) 3.867 6.320 ( 1.799 0.702 5.990) 6.294 6.466 ( -0.136 -17.859 6.905) 19.148 7.201 ( 3.896 7.678 -2.623) 9.001 7.287 ( 4.960 -1.472 -0.609) 5.209 7.758 ( -5.979 1.396 -1.302) 6.276 7.839 ( -5.339 -5.874 0.151) 7.939 8.073 ( -3.964 0.808 -1.981) 4.505 8.104 ( -0.702 -2.178 -2.174) 3.157 9.038 ( 4.556 3.720 0.129) 5.883 9.084 ( 4.109 -0.812 -1.101) 4.330 10.100 ( 0.998 4.428 1.541) 4.793 10.179 ( -2.507 -3.396 -3.386) 5.411 10.250 ( 4.017 2.183 0.593) 4.610 10.299 ( 4.290 -3.179 8.136) 9.731 10.782 ( 5.519 5.899 2.773) 8.541 10.862 ( 5.857 -2.091 0.275) 6.226 12.073 ( -2.696 7.344 -1.622) 7.990 12.189 ( 4.297 -1.125 -6.734) 8.067 12.461 ( 3.042 7.935 -2.150) 8.766 12.738 ( 5.555 -15.260 -4.449) 16.838 12.788 ( 6.644 1.864 -9.678) 11.886 12.919 ( 2.629 -10.636 -2.352) 11.206 13.549 ( -2.638 2.714 -1.448) 4.052 13.576 ( -1.536 -0.355 -1.654) 2.285 14.657 ( -9.227 0.816 -1.556) 9.393 14.678 ( -9.038 -1.486 -3.304) 9.737 14.986 ( -8.514 4.322 -6.596) 11.605 15.083 ( -6.440 -5.670 -4.914) 9.888 15.381 ( -1.597 13.845 10.237) 17.292 15.628 ( 4.573 -12.084 11.993) 17.629 15.971 ( 5.987 6.173 -0.437) 8.610 16.055 ( 8.326 -2.827 2.059) 9.031 19.254 ( 1.706 5.220 0.629) 5.527 19.350 ( 4.301 -4.830 -1.341) 6.605 24.750 ( 5.599 1.187 -6.107) 8.370 24.773 ( 6.610 -1.177 -4.798) 8.252 26.081 ( -8.516 3.938 4.044) 10.217 26.174 ( -5.844 -6.081 4.274) 9.455 26.764 ( 4.389 4.665 4.818) 8.015 26.836 ( 4.977 -3.138 4.960) 7.696 27.202 ( 4.235 1.403 -4.386) 6.256 27.231 ( 4.533 -1.603 -4.058) 6.292 27.814 ( -12.764 12.770 -17.051) 24.834 28.005 ( -2.793 -6.481 -1.833) 7.291 28.546 ( 1.815 -0.702 4.000) 4.448 28.589 ( 5.710 -4.397 20.909) 22.116 32.500 ( 3.369 4.247 -0.848) 5.487 32.581 ( 5.511 -4.185 -3.990) 7.988 ======================= Grid point 250 (148/150) ======================= q-point: (-0.27 0.40 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.225 ( -5.547 16.118 11.195) 20.394 2.573 ( -6.212 -18.375 4.786) 19.978 2.757 ( 16.185 15.868 13.363) 26.312 3.045 ( 16.565 -14.914 25.875) 34.152 3.337 ( -0.855 7.464 10.448) 12.869 3.479 ( 11.162 -7.512 8.040) 15.673 3.743 ( -10.078 11.307 22.993) 27.533 3.986 ( -8.525 -10.331 10.425) 16.973 4.250 ( 3.877 1.274 0.966) 4.194 4.313 ( -3.548 -4.204 2.917) 6.226 4.501 ( 1.900 1.867 3.649) 4.518 4.581 ( 1.319 -6.340 5.304) 8.371 5.407 ( 9.161 14.440 -13.104) 21.544 5.517 ( 5.065 6.671 -6.867) 10.831 5.689 ( 11.800 -0.503 -4.306) 12.571 5.704 ( 14.078 -3.063 1.127) 14.451 6.010 ( 2.756 18.034 4.817) 18.868 6.324 ( 6.853 -2.384 8.804) 11.409 6.381 ( 2.790 -1.960 7.209) 7.974 6.472 ( 2.054 -21.201 2.576) 21.455 7.209 ( -2.962 9.686 3.882) 10.847 7.366 ( 1.934 -5.378 3.333) 6.617 7.622 ( -8.538 0.046 -0.147) 8.540 7.707 ( -7.092 -7.536 0.548) 10.362 8.051 ( 3.702 3.825 -4.666) 7.079 8.138 ( 5.068 -4.747 -4.692) 8.380 9.133 ( 4.895 2.585 1.026) 5.630 9.156 ( 3.551 0.295 -0.361) 3.582 10.114 ( 0.988 1.424 -5.098) 5.385 10.139 ( 0.735 -0.990 -3.537) 3.746 10.354 ( 4.815 3.318 7.529) 9.533 10.425 ( 5.632 -4.270 11.007) 13.081 10.925 ( 8.345 5.393 1.312) 10.022 10.996 ( 7.913 -1.809 -1.101) 8.192 11.962 ( -7.405 9.297 -0.054) 11.886 12.162 ( -5.723 -9.978 -2.742) 11.825 12.574 ( 8.244 17.219 -2.288) 19.227 12.872 ( 6.359 3.187 -9.728) 12.051 12.939 ( 11.313 -16.135 -8.787) 21.576 12.966 ( 3.751 -10.027 -3.566) 11.284 13.495 ( -1.893 4.790 -4.204) 6.649 13.544 ( -0.235 -0.474 -6.377) 6.399 14.421 ( -14.179 0.120 -4.604) 14.908 14.457 ( -12.433 -3.744 -5.520) 14.109 14.790 ( -9.888 5.726 -7.035) 13.418 14.917 ( -8.432 -7.479 -6.613) 13.068 15.372 ( -2.606 16.980 11.894) 20.895 15.685 ( -1.155 -15.430 11.120) 19.055 16.140 ( 10.621 6.889 0.965) 12.696 16.241 ( 9.898 -3.867 2.210) 10.854 19.301 ( 2.916 7.460 -0.026) 8.010 19.433 ( 4.341 -6.361 -2.504) 8.098 24.863 ( 7.282 2.170 -7.455) 10.645 24.904 ( 7.999 -2.138 -6.999) 10.841 25.935 ( -7.351 5.689 5.779) 10.945 26.069 ( -5.597 -8.899 4.845) 11.576 26.873 ( 3.700 2.697 4.383) 6.338 26.909 ( 0.279 -1.352 1.989) 2.422 27.230 ( -1.351 2.936 -7.115) 7.815 27.266 ( 1.010 -1.253 -6.197) 6.403 27.601 ( -3.080 19.190 -10.098) 21.902 27.951 ( 0.588 -16.691 -3.870) 17.144 28.650 ( 5.053 3.272 14.312) 15.527 28.735 ( 4.141 -5.367 22.950) 23.930 32.578 ( 4.783 5.915 -1.421) 7.738 32.688 ( 6.342 -5.589 -5.557) 10.116 ======================= Grid point 251 (149/150) ======================= q-point: (-0.18 0.40 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.157 ( -1.384 17.093 3.654) 17.534 2.500 ( 0.727 -17.424 -2.828) 17.667 3.097 ( 6.168 11.524 19.899) 23.808 3.227 ( -11.952 8.918 21.066) 25.810 3.400 ( 8.635 -0.695 20.283) 22.055 3.579 ( 2.495 -9.623 24.260) 26.218 3.765 ( 10.424 0.409 4.248) 11.264 3.876 ( -1.248 -7.767 3.461) 8.594 4.298 ( 2.440 -0.406 2.216) 3.321 4.370 ( 6.033 -6.479 2.383) 9.168 4.567 ( 3.578 3.127 2.845) 5.538 4.635 ( 2.003 -4.288 5.665) 7.382 5.494 ( 2.741 6.147 -12.608) 14.292 5.543 ( 0.531 2.028 -6.649) 6.972 5.848 ( 4.325 12.577 10.532) 16.965 5.984 ( 7.662 1.003 8.355) 11.381 6.147 ( 13.279 19.071 -1.222) 23.271 6.405 ( -0.071 -3.691 4.127) 5.537 6.450 ( 4.574 0.957 10.356) 11.361 6.679 ( 16.201 -24.183 1.160) 29.132 7.127 ( -5.615 9.116 6.347) 12.447 7.361 ( -5.253 -14.141 9.802) 17.990 7.461 ( -4.956 5.222 -0.031) 7.200 7.592 ( -4.785 -7.732 0.176) 9.095 8.184 ( 9.194 3.604 -2.655) 10.226 8.269 ( 8.984 -5.033 -5.294) 11.579 9.224 ( 4.610 1.579 0.930) 4.961 9.233 ( 4.531 0.692 1.538) 4.835 10.142 ( 3.616 2.806 -4.143) 6.173 10.193 ( 4.423 -2.145 -1.938) 5.283 10.437 ( 2.047 4.340 5.865) 7.578 10.533 ( 2.975 -5.885 8.000) 10.368 11.098 ( 9.347 4.005 -0.573) 10.185 11.159 ( 9.318 -2.149 -2.769) 9.956 11.811 ( -7.943 7.705 -0.976) 11.109 12.006 ( -9.075 -12.073 -2.694) 15.342 12.716 ( 5.904 17.817 1.778) 18.853 12.920 ( 0.850 0.335 -3.515) 3.632 13.077 ( 7.752 -6.223 -7.605) 12.516 13.100 ( 5.873 -9.482 -3.628) 11.729 13.468 ( -0.027 8.100 -6.883) 10.629 13.560 ( 3.535 -1.350 -11.354) 11.967 14.105 ( -17.143 1.340 -6.211) 18.282 14.177 ( -15.297 -5.424 -7.462) 17.864 14.605 ( -6.845 8.026 -6.535) 12.409 14.769 ( -5.007 -7.206 -5.655) 10.439 15.330 ( -2.956 12.956 8.010) 15.517 15.638 ( -5.533 -16.544 9.301) 19.769 16.348 ( 9.937 4.620 1.143) 11.018 16.424 ( 8.249 -3.366 1.347) 9.011 19.359 ( 2.894 8.188 -0.540) 8.701 19.494 ( 2.345 -6.091 -3.494) 7.403 24.988 ( 6.754 2.701 -6.945) 10.057 25.040 ( 7.246 -2.762 -8.071) 11.192 25.827 ( -5.040 6.475 5.582) 9.924 25.975 ( -5.484 -9.695 4.334) 11.952 26.813 ( -8.793 1.977 -3.131) 9.541 26.835 ( -6.377 -0.733 -2.087) 6.750 27.235 ( 3.828 4.487 -2.815) 6.535 27.284 ( 1.704 -1.518 -5.549) 6.000 27.659 ( 8.668 19.783 -0.190) 21.599 28.030 ( 6.516 -17.869 2.635) 19.202 28.763 ( 3.657 1.717 12.548) 13.182 28.830 ( 1.123 -4.769 20.412) 20.992 32.670 ( 4.790 6.672 -1.302) 8.316 32.791 ( 5.240 -5.965 -6.579) 10.311 ======================= Grid point 252 (150/150) ======================= q-point: (-0.09 0.40 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.245 ( 10.810 17.395 -4.007) 20.869 2.522 ( -3.099 -9.536 2.881) 10.432 2.934 ( -12.758 3.087 18.843) 22.964 3.024 ( -10.779 -2.610 11.685) 16.110 3.659 ( 11.933 5.175 9.689) 16.218 3.775 ( 3.916 -6.892 10.202) 12.920 3.900 ( 5.092 4.966 14.967) 16.570 3.989 ( 10.089 -6.196 2.773) 12.160 4.390 ( 5.992 -0.471 0.289) 6.017 4.485 ( 4.405 -8.857 -0.896) 9.933 4.617 ( 1.541 2.967 -0.414) 3.369 4.663 ( 0.193 -2.026 2.693) 3.375 5.491 ( -0.193 3.433 -7.034) 7.829 5.523 ( -1.547 0.125 -4.472) 4.734 5.907 ( -0.238 17.540 17.308) 24.643 6.075 ( 2.408 3.936 3.050) 5.531 6.357 ( 5.539 5.452 -0.809) 7.814 6.422 ( 1.073 -2.469 0.441) 2.728 6.612 ( 10.200 10.535 13.532) 19.954 6.976 ( 11.317 -21.322 6.434) 24.982 7.046 ( -3.544 4.890 0.543) 6.063 7.252 ( -3.748 -12.709 5.721) 14.432 7.442 ( 0.318 1.423 4.181) 4.428 7.528 ( -2.186 -6.216 3.008) 7.243 8.336 ( 5.683 4.393 2.337) 7.554 8.432 ( 7.852 -5.528 -5.259) 10.949 9.326 ( 4.405 1.147 2.464) 5.176 9.334 ( 6.353 0.376 -0.130) 6.365 10.230 ( 5.445 2.907 -1.796) 6.428 10.277 ( 4.155 -1.511 -0.472) 4.446 10.457 ( -0.410 4.052 0.881) 4.167 10.556 ( -1.528 -6.130 1.239) 6.438 11.279 ( 9.181 3.124 -0.314) 9.703 11.336 ( 9.150 -2.479 -2.234) 9.740 11.657 ( -7.328 4.228 -1.928) 8.677 11.816 ( -9.836 -11.590 -3.778) 15.663 12.804 ( 2.573 12.615 3.408) 13.318 12.914 ( -0.936 1.026 -0.579) 1.505 13.186 ( 5.724 -1.852 -2.308) 6.443 13.213 ( 7.654 -4.880 -3.174) 9.617 13.431 ( -3.723 9.529 -3.164) 10.708 13.588 ( -0.684 -6.000 -8.613) 10.519 13.756 ( -15.995 4.606 -7.571) 18.286 13.857 ( -14.897 -5.227 -8.194) 17.787 14.541 ( 1.993 12.198 -6.592) 14.008 14.673 ( -6.036 3.047 0.204) 6.765 15.341 ( 4.544 -1.723 -1.130) 4.989 15.522 ( -7.533 -15.902 6.283) 18.684 16.508 ( 6.097 2.351 0.618) 6.563 16.553 ( 4.767 -2.403 -0.573) 5.369 19.405 ( 1.879 6.759 -0.114) 7.016 19.503 ( -0.737 -3.618 -3.157) 4.857 25.077 ( 2.941 2.702 -2.888) 4.929 25.131 ( 3.090 -3.039 -6.121) 7.500 25.770 ( -1.316 4.848 2.033) 5.419 25.868 ( -5.719 -5.654 1.438) 8.170 26.671 ( -3.990 2.701 -0.506) 4.845 26.712 ( -4.874 -1.746 -0.947) 5.263 27.277 ( 0.545 0.627 -4.010) 4.095 27.289 ( -0.388 -0.568 -4.473) 4.525 27.898 ( 14.217 15.789 4.013) 21.622 28.149 ( 3.054 -9.486 5.942) 11.603 28.848 ( 2.788 -2.746 8.760) 9.594 28.872 ( 0.993 -4.510 11.426) 12.324 32.748 ( 3.159 6.059 -0.383) 6.844 32.852 ( 2.263 -4.917 -6.540) 8.490 =================== 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 3/32670 10.0 3361.289 3214.924 2624.605 0.000 -528.821 0.000 3/32670 20.0 456.734 514.515 470.049 0.000 67.020 0.000 3/32670 30.0 177.042 184.497 182.987 0.000 31.257 0.000 3/32670 40.0 98.874 97.191 101.363 0.000 17.062 0.000 3/32670 50.0 64.849 61.838 66.374 0.000 10.704 0.000 3/32670 60.0 46.843 43.963 47.995 0.000 7.400 0.000 3/32670 70.0 36.080 33.566 37.021 0.000 5.479 0.000 3/32670 80.0 29.070 26.904 29.864 0.000 4.265 0.000 3/32670 90.0 24.209 22.330 24.887 0.000 3.448 0.000 3/32670 100.0 20.673 19.025 21.259 0.000 2.871 0.000 3/32670 110.0 18.004 16.541 18.516 0.000 2.446 0.000 3/32670 120.0 15.930 14.616 16.380 0.000 2.124 0.000 3/32670 130.0 14.277 13.087 14.676 0.000 1.873 0.000 3/32670 140.0 12.933 11.845 13.290 0.000 1.672 0.000 3/32670 150.0 11.822 10.820 12.143 0.000 1.510 0.000 3/32670 160.0 10.889 9.961 11.180 0.000 1.375 0.000 3/32670 170.0 10.096 9.230 10.361 0.000 1.263 0.000 3/32670 180.0 9.414 8.603 9.657 0.000 1.167 0.000 3/32670 190.0 8.822 8.058 9.046 0.000 1.086 0.000 3/32670 200.0 8.303 7.581 8.510 0.000 1.015 0.000 3/32670 210.0 7.844 7.160 8.037 0.000 0.954 0.000 3/32670 220.0 7.437 6.785 7.617 0.000 0.900 0.000 3/32670 230.0 7.072 6.450 7.241 0.000 0.852 0.000 3/32670 240.0 6.743 6.148 6.903 0.000 0.809 0.000 3/32670 250.0 6.445 5.875 6.597 0.000 0.771 0.000 3/32670 260.0 6.175 5.627 6.319 0.000 0.737 0.000 3/32670 270.0 5.928 5.401 6.065 0.000 0.706 0.000 3/32670 280.0 5.701 5.193 5.832 0.000 0.678 0.000 3/32670 290.0 5.492 5.001 5.618 0.000 0.653 0.000 3/32670 300.0 5.299 4.825 5.420 0.000 0.629 0.000 3/32670 310.0 5.120 4.661 5.236 0.000 0.608 0.000 3/32670 320.0 4.953 4.508 5.066 0.000 0.588 0.000 3/32670 330.0 4.798 4.366 4.907 0.000 0.570 0.000 3/32670 340.0 4.653 4.234 4.759 0.000 0.553 0.000 3/32670 350.0 4.517 4.109 4.620 0.000 0.537 0.000 3/32670 360.0 4.389 3.992 4.489 0.000 0.522 0.000 3/32670 370.0 4.269 3.882 4.366 0.000 0.508 0.000 3/32670 380.0 4.155 3.779 4.250 0.000 0.495 0.000 3/32670 390.0 4.048 3.681 4.141 0.000 0.482 0.000 3/32670 400.0 3.946 3.588 4.037 0.000 0.471 0.000 3/32670 410.0 3.850 3.500 3.939 0.000 0.460 0.000 3/32670 420.0 3.759 3.417 3.845 0.000 0.449 0.000 3/32670 430.0 3.672 3.337 3.756 0.000 0.439 0.000 3/32670 440.0 3.589 3.262 3.672 0.000 0.430 0.000 3/32670 450.0 3.509 3.190 3.591 0.000 0.421 0.000 3/32670 460.0 3.434 3.121 3.514 0.000 0.412 0.000 3/32670 470.0 3.362 3.055 3.440 0.000 0.404 0.000 3/32670 480.0 3.292 2.992 3.370 0.000 0.396 0.000 3/32670 490.0 3.226 2.932 3.302 0.000 0.389 0.000 3/32670 500.0 3.163 2.874 3.237 0.000 0.381 0.000 3/32670 510.0 3.101 2.818 3.175 0.000 0.374 0.000 3/32670 520.0 3.043 2.765 3.115 0.000 0.368 0.000 3/32670 530.0 2.986 2.713 3.058 0.000 0.361 0.000 3/32670 540.0 2.932 2.664 3.002 0.000 0.355 0.000 3/32670 550.0 2.880 2.616 2.949 0.000 0.349 0.000 3/32670 560.0 2.829 2.570 2.898 0.000 0.343 0.000 3/32670 570.0 2.780 2.526 2.848 0.000 0.338 0.000 3/32670 580.0 2.733 2.483 2.800 0.000 0.332 0.000 3/32670 590.0 2.688 2.442 2.754 0.000 0.327 0.000 3/32670 600.0 2.644 2.402 2.709 0.000 0.322 0.000 3/32670 610.0 2.602 2.364 2.665 0.000 0.317 0.000 3/32670 620.0 2.560 2.326 2.623 0.000 0.312 0.000 3/32670 630.0 2.521 2.290 2.583 0.000 0.308 0.000 3/32670 640.0 2.482 2.255 2.543 0.000 0.303 0.000 3/32670 650.0 2.445 2.221 2.505 0.000 0.299 0.000 3/32670 660.0 2.408 2.188 2.468 0.000 0.295 0.000 3/32670 670.0 2.373 2.156 2.432 0.000 0.291 0.000 3/32670 680.0 2.339 2.125 2.397 0.000 0.287 0.000 3/32670 690.0 2.306 2.095 2.363 0.000 0.283 0.000 3/32670 700.0 2.273 2.065 2.330 0.000 0.279 0.000 3/32670 710.0 2.242 2.037 2.298 0.000 0.275 0.000 3/32670 720.0 2.211 2.009 2.267 0.000 0.272 0.000 3/32670 730.0 2.182 1.982 2.237 0.000 0.268 0.000 3/32670 740.0 2.153 1.956 2.207 0.000 0.265 0.000 3/32670 750.0 2.125 1.930 2.179 0.000 0.262 0.000 3/32670 760.0 2.097 1.905 2.151 0.000 0.259 0.000 3/32670 770.0 2.071 1.881 2.123 0.000 0.255 0.000 3/32670 780.0 2.045 1.858 2.097 0.000 0.252 0.000 3/32670 790.0 2.019 1.834 2.071 0.000 0.249 0.000 3/32670 800.0 1.994 1.812 2.045 0.000 0.246 0.000 3/32670 810.0 1.970 1.790 2.021 0.000 0.244 0.000 3/32670 820.0 1.947 1.769 1.997 0.000 0.241 0.000 3/32670 830.0 1.924 1.748 1.973 0.000 0.238 0.000 3/32670 840.0 1.901 1.727 1.950 0.000 0.235 0.000 3/32670 850.0 1.879 1.707 1.928 0.000 0.233 0.000 3/32670 860.0 1.858 1.688 1.906 0.000 0.230 0.000 3/32670 870.0 1.837 1.669 1.884 0.000 0.228 0.000 3/32670 880.0 1.816 1.650 1.863 0.000 0.225 0.000 3/32670 890.0 1.796 1.632 1.843 0.000 0.223 0.000 3/32670 900.0 1.776 1.614 1.823 0.000 0.220 0.000 3/32670 910.0 1.757 1.597 1.803 0.000 0.218 0.000 3/32670 920.0 1.738 1.580 1.784 0.000 0.216 0.000 3/32670 930.0 1.720 1.563 1.765 0.000 0.214 0.000 3/32670 940.0 1.702 1.547 1.747 0.000 0.212 0.000 3/32670 950.0 1.684 1.531 1.728 0.000 0.209 0.000 3/32670 960.0 1.667 1.515 1.711 0.000 0.207 0.000 3/32670 970.0 1.650 1.500 1.693 0.000 0.205 0.000 3/32670 980.0 1.634 1.485 1.677 0.000 0.203 0.000 3/32670 990.0 1.617 1.470 1.660 0.000 0.201 0.000 3/32670 1000.0 1.602 1.455 1.644 0.000 0.199 0.000 3/32670 Thermal conductivity related properties were written into "kappa-m1159.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 22:48:19]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|