----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 20:48:34]------------------------- 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: [2 1 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.288601430054109 -5.745459699999999 0.000000000000000 b 3.288601430054109 5.745459699999999 0.000000000000000 c -0.079419878155902 0.000000000000000 6.947089095704935 Atomic positions (fractional): *1 F 0.13454671313286 0.93769071465459 0.95476320912036 18.998 2 F 0.06230928534541 0.86545328686714 0.54523679087964 18.998 3 F 0.86545328686714 0.06230928534541 0.04523679087964 18.998 4 F 0.93769071465459 0.13454671313286 0.45476320912036 18.998 *5 F 0.00146583788797 0.61897988298284 0.22315352413423 18.998 6 F 0.38102011701716 0.99853416211203 0.27684647586577 18.998 *7 F 0.72473979514131 0.69530409006656 0.78322161285150 18.998 8 F 0.30469590993344 0.27526020485869 0.71677838714850 18.998 9 F 0.27526020485869 0.30469590993344 0.21677838714850 18.998 10 F 0.69530409006656 0.72473979514131 0.28322161285150 18.998 11 F 0.61897988298284 0.00146583788797 0.72315352413423 18.998 12 F 0.99853416211203 0.38102011701716 0.77684647586577 18.998 *13 K 0.32134916189917 0.63601717142130 0.49701328320338 39.098 14 K 0.36398282857870 0.67865083810083 0.00298671679662 39.098 15 K 0.67865083810083 0.36398282857870 0.50298671679662 39.098 16 K 0.63601717142130 0.32134916189917 0.99701328320338 39.098 *17 Zr 0.04650471087228 0.95349528912772 0.25000000000000 91.224 18 Zr 0.95349528912772 0.04650471087228 0.75000000000000 91.224 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.577202860108217 0.000000000000000 0.000000000000000 b 0.000000000000000 11.490919399999997 0.000000000000000 c -0.079419878155902 0.000000000000000 6.947089095704935 Atomic positions (fractional): *1 F 0.53611871389373 0.40157200076087 0.95476320912036 18.998 > 1 2 F 0.46388128610627 0.40157200076087 0.54523679087964 18.998 > 2 3 F 0.96388128610627 0.09842799923914 0.04523679087964 18.998 > 3 4 F 0.03611871389373 0.09842799923914 0.45476320912036 18.998 > 4 *5 F 0.31022286043541 0.30875702254744 0.22315352413423 18.998 > 5 6 F 0.68977713956459 0.30875702254744 0.27684647586577 18.998 > 6 *7 F 0.21002194260394 0.48528214746262 0.78322161285150 18.998 > 7 8 F 0.78997805739606 0.48528214746262 0.71677838714850 18.998 > 8 9 F 0.28997805739606 0.01471785253738 0.21677838714850 18.998 > 9 10 F 0.71002194260394 0.01471785253738 0.28322161285150 18.998 > 10 11 F 0.81022286043541 0.19124297745256 0.72315352413423 18.998 > 11 12 F 0.18977713956459 0.19124297745256 0.77684647586577 18.998 > 12 13 F 0.03611871389373 0.90157200076087 0.95476320912036 18.998 > 1 14 F 0.96388128610627 0.90157200076087 0.54523679087964 18.998 > 2 15 F 0.46388128610627 0.59842799923913 0.04523679087964 18.998 > 3 16 F 0.53611871389373 0.59842799923913 0.45476320912036 18.998 > 4 17 F 0.81022286043541 0.80875702254744 0.22315352413423 18.998 > 5 18 F 0.18977713956459 0.80875702254744 0.27684647586577 18.998 > 6 19 F 0.71002194260394 0.98528214746262 0.78322161285150 18.998 > 7 20 F 0.28997805739606 0.98528214746262 0.71677838714850 18.998 > 8 21 F 0.78997805739606 0.51471785253738 0.21677838714850 18.998 > 9 22 F 0.21002194260394 0.51471785253738 0.28322161285150 18.998 > 10 23 F 0.31022286043541 0.69124297745256 0.72315352413423 18.998 > 11 24 F 0.68977713956459 0.69124297745256 0.77684647586577 18.998 > 12 *25 K 0.47868316666024 0.15733400476107 0.49701328320338 39.098 > 13 26 K 0.52131683333976 0.15733400476107 0.00298671679662 39.098 > 14 27 K 0.02131683333976 0.34266599523893 0.50298671679662 39.098 > 15 28 K 0.97868316666024 0.34266599523893 0.99701328320338 39.098 > 16 29 K 0.97868316666024 0.65733400476107 0.49701328320338 39.098 > 13 30 K 0.02131683333976 0.65733400476107 0.00298671679662 39.098 > 14 31 K 0.52131683333976 0.84266599523893 0.50298671679662 39.098 > 15 32 K 0.47868316666024 0.84266599523893 0.99701328320338 39.098 > 16 *33 Zr 0.50000000000000 0.45349528912772 0.25000000000000 91.224 > 17 34 Zr 0.00000000000000 0.04650471087228 0.75000000000000 91.224 > 18 35 Zr 0.00000000000000 0.95349528912772 0.25000000000000 91.224 > 17 36 Zr 0.50000000000000 0.54650471087228 0.75000000000000 91.224 > 18 -------------------------------- super cell -------------------------------- Lattice vectors: a 13.154405720216435 0.000000000000000 0.000000000000000 b 0.000000000000000 11.490919399999997 0.000000000000000 c -0.158839756311804 0.000000000000000 13.894178191409869 Atomic positions (fractional): *1 F 0.26805935694686 0.40157200076087 0.47738160456018 18.998 > 1 2 F 0.76805935694686 0.40157200076087 0.47738160456018 18.998 > 1 3 F 0.26805935694686 0.40157200076087 0.97738160456018 18.998 > 1 4 F 0.76805935694686 0.40157200076087 0.97738160456018 18.998 > 1 5 F 0.23194064305314 0.40157200076087 0.27261839543982 18.998 > 2 6 F 0.73194064305314 0.40157200076087 0.27261839543982 18.998 > 2 7 F 0.23194064305314 0.40157200076087 0.77261839543982 18.998 > 2 8 F 0.73194064305314 0.40157200076087 0.77261839543982 18.998 > 2 9 F 0.48194064305314 0.09842799923914 0.02261839543982 18.998 > 3 10 F 0.98194064305314 0.09842799923914 0.02261839543982 18.998 > 3 11 F 0.48194064305314 0.09842799923914 0.52261839543982 18.998 > 3 12 F 0.98194064305314 0.09842799923914 0.52261839543982 18.998 > 3 13 F 0.01805935694686 0.09842799923914 0.22738160456018 18.998 > 4 14 F 0.51805935694686 0.09842799923914 0.22738160456018 18.998 > 4 15 F 0.01805935694686 0.09842799923914 0.72738160456018 18.998 > 4 16 F 0.51805935694686 0.09842799923914 0.72738160456018 18.998 > 4 *17 F 0.15511143021770 0.30875702254744 0.11157676206711 18.998 > 5 18 F 0.65511143021770 0.30875702254744 0.11157676206711 18.998 > 5 19 F 0.15511143021770 0.30875702254744 0.61157676206711 18.998 > 5 20 F 0.65511143021770 0.30875702254744 0.61157676206711 18.998 > 5 21 F 0.34488856978230 0.30875702254744 0.13842323793289 18.998 > 6 22 F 0.84488856978230 0.30875702254744 0.13842323793289 18.998 > 6 23 F 0.34488856978230 0.30875702254744 0.63842323793289 18.998 > 6 24 F 0.84488856978230 0.30875702254744 0.63842323793289 18.998 > 6 *25 F 0.10501097130197 0.48528214746262 0.39161080642575 18.998 > 7 26 F 0.60501097130197 0.48528214746262 0.39161080642575 18.998 > 7 27 F 0.10501097130197 0.48528214746262 0.89161080642575 18.998 > 7 28 F 0.60501097130197 0.48528214746262 0.89161080642575 18.998 > 7 29 F 0.39498902869803 0.48528214746262 0.35838919357425 18.998 > 8 30 F 0.89498902869803 0.48528214746262 0.35838919357425 18.998 > 8 31 F 0.39498902869803 0.48528214746262 0.85838919357425 18.998 > 8 32 F 0.89498902869803 0.48528214746262 0.85838919357425 18.998 > 8 33 F 0.14498902869803 0.01471785253738 0.10838919357425 18.998 > 9 34 F 0.64498902869803 0.01471785253738 0.10838919357425 18.998 > 9 35 F 0.14498902869803 0.01471785253738 0.60838919357425 18.998 > 9 36 F 0.64498902869803 0.01471785253738 0.60838919357425 18.998 > 9 37 F 0.35501097130197 0.01471785253738 0.14161080642575 18.998 > 10 38 F 0.85501097130197 0.01471785253738 0.14161080642575 18.998 > 10 39 F 0.35501097130197 0.01471785253738 0.64161080642575 18.998 > 10 40 F 0.85501097130197 0.01471785253738 0.64161080642575 18.998 > 10 41 F 0.40511143021770 0.19124297745256 0.36157676206711 18.998 > 11 42 F 0.90511143021770 0.19124297745256 0.36157676206711 18.998 > 11 43 F 0.40511143021770 0.19124297745256 0.86157676206711 18.998 > 11 44 F 0.90511143021770 0.19124297745256 0.86157676206711 18.998 > 11 45 F 0.09488856978230 0.19124297745256 0.38842323793289 18.998 > 12 46 F 0.59488856978230 0.19124297745256 0.38842323793289 18.998 > 12 47 F 0.09488856978230 0.19124297745256 0.88842323793289 18.998 > 12 48 F 0.59488856978230 0.19124297745256 0.88842323793289 18.998 > 12 49 F 0.01805935694686 0.90157200076087 0.47738160456018 18.998 > 1 50 F 0.51805935694686 0.90157200076087 0.47738160456018 18.998 > 1 51 F 0.01805935694686 0.90157200076087 0.97738160456018 18.998 > 1 52 F 0.51805935694686 0.90157200076087 0.97738160456018 18.998 > 1 53 F 0.48194064305314 0.90157200076087 0.27261839543982 18.998 > 2 54 F 0.98194064305314 0.90157200076087 0.27261839543982 18.998 > 2 55 F 0.48194064305314 0.90157200076087 0.77261839543982 18.998 > 2 56 F 0.98194064305314 0.90157200076087 0.77261839543982 18.998 > 2 57 F 0.23194064305314 0.59842799923913 0.02261839543982 18.998 > 3 58 F 0.73194064305314 0.59842799923913 0.02261839543982 18.998 > 3 59 F 0.23194064305314 0.59842799923913 0.52261839543982 18.998 > 3 60 F 0.73194064305314 0.59842799923913 0.52261839543982 18.998 > 3 61 F 0.26805935694686 0.59842799923913 0.22738160456018 18.998 > 4 62 F 0.76805935694686 0.59842799923913 0.22738160456018 18.998 > 4 63 F 0.26805935694686 0.59842799923913 0.72738160456018 18.998 > 4 64 F 0.76805935694686 0.59842799923913 0.72738160456018 18.998 > 4 65 F 0.40511143021770 0.80875702254744 0.11157676206711 18.998 > 5 66 F 0.90511143021770 0.80875702254744 0.11157676206711 18.998 > 5 67 F 0.40511143021770 0.80875702254744 0.61157676206711 18.998 > 5 68 F 0.90511143021770 0.80875702254744 0.61157676206711 18.998 > 5 69 F 0.09488856978230 0.80875702254744 0.13842323793289 18.998 > 6 70 F 0.59488856978230 0.80875702254744 0.13842323793289 18.998 > 6 71 F 0.09488856978230 0.80875702254744 0.63842323793289 18.998 > 6 72 F 0.59488856978230 0.80875702254744 0.63842323793289 18.998 > 6 73 F 0.35501097130197 0.98528214746262 0.39161080642575 18.998 > 7 74 F 0.85501097130197 0.98528214746262 0.39161080642575 18.998 > 7 75 F 0.35501097130197 0.98528214746262 0.89161080642575 18.998 > 7 76 F 0.85501097130197 0.98528214746262 0.89161080642575 18.998 > 7 77 F 0.14498902869803 0.98528214746262 0.35838919357425 18.998 > 8 78 F 0.64498902869803 0.98528214746262 0.35838919357425 18.998 > 8 79 F 0.14498902869803 0.98528214746262 0.85838919357425 18.998 > 8 80 F 0.64498902869803 0.98528214746262 0.85838919357425 18.998 > 8 81 F 0.39498902869803 0.51471785253738 0.10838919357425 18.998 > 9 82 F 0.89498902869803 0.51471785253738 0.10838919357425 18.998 > 9 83 F 0.39498902869803 0.51471785253738 0.60838919357425 18.998 > 9 84 F 0.89498902869803 0.51471785253738 0.60838919357425 18.998 > 9 85 F 0.10501097130197 0.51471785253738 0.14161080642575 18.998 > 10 86 F 0.60501097130197 0.51471785253738 0.14161080642575 18.998 > 10 87 F 0.10501097130197 0.51471785253738 0.64161080642575 18.998 > 10 88 F 0.60501097130197 0.51471785253738 0.64161080642575 18.998 > 10 89 F 0.15511143021770 0.69124297745256 0.36157676206711 18.998 > 11 90 F 0.65511143021770 0.69124297745256 0.36157676206711 18.998 > 11 91 F 0.15511143021770 0.69124297745256 0.86157676206711 18.998 > 11 92 F 0.65511143021770 0.69124297745256 0.86157676206711 18.998 > 11 93 F 0.34488856978230 0.69124297745256 0.38842323793289 18.998 > 12 94 F 0.84488856978230 0.69124297745256 0.38842323793289 18.998 > 12 95 F 0.34488856978230 0.69124297745256 0.88842323793289 18.998 > 12 96 F 0.84488856978230 0.69124297745256 0.88842323793289 18.998 > 12 *97 K 0.23934158333012 0.15733400476107 0.24850664160169 39.098 > 13 98 K 0.73934158333012 0.15733400476107 0.24850664160169 39.098 > 13 99 K 0.23934158333012 0.15733400476107 0.74850664160169 39.098 > 13 100 K 0.73934158333012 0.15733400476107 0.74850664160169 39.098 > 13 101 K 0.26065841666988 0.15733400476107 0.00149335839831 39.098 > 14 102 K 0.76065841666988 0.15733400476107 0.00149335839831 39.098 > 14 103 K 0.26065841666988 0.15733400476107 0.50149335839831 39.098 > 14 104 K 0.76065841666988 0.15733400476107 0.50149335839831 39.098 > 14 105 K 0.01065841666988 0.34266599523893 0.25149335839831 39.098 > 15 106 K 0.51065841666988 0.34266599523893 0.25149335839831 39.098 > 15 107 K 0.01065841666988 0.34266599523893 0.75149335839831 39.098 > 15 108 K 0.51065841666988 0.34266599523893 0.75149335839831 39.098 > 15 109 K 0.48934158333012 0.34266599523893 0.49850664160169 39.098 > 16 110 K 0.98934158333012 0.34266599523893 0.49850664160169 39.098 > 16 111 K 0.48934158333012 0.34266599523893 0.99850664160169 39.098 > 16 112 K 0.98934158333012 0.34266599523893 0.99850664160169 39.098 > 16 113 K 0.48934158333012 0.65733400476107 0.24850664160169 39.098 > 13 114 K 0.98934158333012 0.65733400476107 0.24850664160169 39.098 > 13 115 K 0.48934158333012 0.65733400476107 0.74850664160169 39.098 > 13 116 K 0.98934158333012 0.65733400476107 0.74850664160169 39.098 > 13 117 K 0.01065841666988 0.65733400476107 0.00149335839831 39.098 > 14 118 K 0.51065841666988 0.65733400476107 0.00149335839831 39.098 > 14 119 K 0.01065841666988 0.65733400476107 0.50149335839831 39.098 > 14 120 K 0.51065841666988 0.65733400476107 0.50149335839831 39.098 > 14 121 K 0.26065841666988 0.84266599523893 0.25149335839831 39.098 > 15 122 K 0.76065841666988 0.84266599523893 0.25149335839831 39.098 > 15 123 K 0.26065841666988 0.84266599523893 0.75149335839831 39.098 > 15 124 K 0.76065841666988 0.84266599523893 0.75149335839831 39.098 > 15 125 K 0.23934158333012 0.84266599523893 0.49850664160169 39.098 > 16 126 K 0.73934158333012 0.84266599523893 0.49850664160169 39.098 > 16 127 K 0.23934158333012 0.84266599523893 0.99850664160169 39.098 > 16 128 K 0.73934158333012 0.84266599523893 0.99850664160169 39.098 > 16 *129 Zr 0.25000000000000 0.45349528912772 0.12500000000000 91.224 > 17 130 Zr 0.75000000000000 0.45349528912772 0.12500000000000 91.224 > 17 131 Zr 0.25000000000000 0.45349528912772 0.62500000000000 91.224 > 17 132 Zr 0.75000000000000 0.45349528912772 0.62500000000000 91.224 > 17 133 Zr 0.00000000000000 0.04650471087228 0.37500000000000 91.224 > 18 134 Zr 0.50000000000000 0.04650471087228 0.37500000000000 91.224 > 18 135 Zr 0.00000000000000 0.04650471087228 0.87500000000000 91.224 > 18 136 Zr 0.50000000000000 0.04650471087228 0.87500000000000 91.224 > 18 137 Zr 0.00000000000000 0.95349528912772 0.12500000000000 91.224 > 17 138 Zr 0.50000000000000 0.95349528912772 0.12500000000000 91.224 > 17 139 Zr 0.00000000000000 0.95349528912772 0.62500000000000 91.224 > 17 140 Zr 0.50000000000000 0.95349528912772 0.62500000000000 91.224 > 17 141 Zr 0.25000000000000 0.54650471087228 0.37500000000000 91.224 > 18 142 Zr 0.75000000000000 0.54650471087228 0.37500000000000 91.224 > 18 143 Zr 0.25000000000000 0.54650471087228 0.87500000000000 91.224 > 18 144 Zr 0.75000000000000 0.54650471087228 0.87500000000000 91.224 > 18 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.3585298 0.0000000 -0.0408287 0.0000000 2.2903253 0.0000000 -0.0408285 0.0000000 2.3624453 -------------------------- Born effective charges -------------------------- 1 F -0.6356882 0.0820793 0.0227151 0.0730621 -1.0254108 0.2582925 0.0350890 0.2793076 -1.8386183 2 F -0.6356882 -0.0820793 0.0227151 -0.0730621 -1.0254108 -0.2582925 0.0350890 -0.2793076 -1.8386183 3 F -0.6356882 0.0820793 0.0227151 0.0730621 -1.0254108 0.2582925 0.0350890 0.2793076 -1.8386183 4 F -0.6356882 -0.0820793 0.0227151 -0.0730621 -1.0254108 -0.2582925 0.0350890 -0.2793076 -1.8386183 5 F -1.1693869 -0.4192051 -0.0534250 -0.4046339 -1.3660044 -0.0537224 -0.0472083 -0.0559774 -0.8549653 6 F -1.1693869 0.4192051 -0.0534250 0.4046339 -1.3660044 0.0537224 -0.0472083 0.0559774 -0.8549653 7 F -1.7028162 -0.3877807 0.1336659 -0.3459965 -0.8457089 0.0460766 0.1134620 0.0211270 -0.8829289 8 F -1.7028162 0.3877807 0.1336659 0.3459965 -0.8457089 -0.0460766 0.1134620 -0.0211270 -0.8829289 9 F -1.7028162 -0.3877807 0.1336659 -0.3459965 -0.8457089 0.0460766 0.1134620 0.0211270 -0.8829289 10 F -1.7028162 0.3877807 0.1336659 0.3459965 -0.8457089 -0.0460766 0.1134620 -0.0211270 -0.8829289 11 F -1.1693869 0.4192051 -0.0534250 0.4046339 -1.3660044 0.0537224 -0.0472083 0.0559774 -0.8549653 12 F -1.1693869 -0.4192051 -0.0534250 -0.4046339 -1.3660044 -0.0537224 -0.0472083 -0.0559774 -0.8549653 13 K 1.2978493 0.0403254 -0.0244589 0.0365630 1.2567042 -0.0810654 -0.0294571 -0.0452964 1.1655840 14 K 1.2978493 -0.0403254 -0.0244589 -0.0365630 1.2567042 0.0810654 -0.0294571 0.0452964 1.1655840 15 K 1.2978493 0.0403254 -0.0244589 0.0365630 1.2567042 -0.0810654 -0.0294571 -0.0452964 1.1655840 16 K 1.2978493 -0.0403254 -0.0244589 -0.0365630 1.2567042 0.0810654 -0.0294571 0.0452964 1.1655840 17 Zr 4.4200842 0.0000000 -0.1569943 0.0000000 3.9608398 0.0000000 -0.1437713 0.0000000 4.8218571 18 Zr 4.4200842 0.0000000 -0.1569943 0.0000000 3.9608398 0.0000000 -0.1437713 0.0000000 4.8218571 ---------------------------------------------------------------------------- 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: 432/432 Permutation basis: 14832/14832 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3052 Number of blocks in projector: 3052 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: 650 Use submatrix version of eigh solver. (1) Block: 500 / 650 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 241 eigenvectors found. (2) Complementary block size: 18 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 650 / 650 (1) 145 eigenvectors found. (1) Complementary block size: 14 (1) Compute compressed projector. (1) Use standard solver. (1) 5 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 646 Use submatrix version of eigh solver. (1) Block: 500 / 646 (2) Block: 250 / 500 (2) 242 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 15 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 492 eigenvectors found. (1) Block: 646 / 646 (1) 140 eigenvectors found. (1) Complementary block size: 14 (1) Compute compressed projector. (1) Use standard solver. (1) 6 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 646 Use submatrix version of eigh solver. (1) Block: 500 / 646 (2) Block: 250 / 500 (2) 242 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 15 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 492 eigenvectors found. (1) Block: 646 / 646 (1) 140 eigenvectors found. (1) Complementary block size: 14 (1) Compute compressed projector. (1) Use standard solver. (1) 6 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 370 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 370 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 370 Use standard eigh solver. Tree of FC basis block matrices: - (3052, 3012), data: False |-- (370, 365), data: True |-- (370, 365), data: True |-- (370, 365), data: True |-- (646, 638), data: False |-- (646, 6), data: (646, 14) @ (14, 6) |-- (146, 140), data: True |-- (500, 492), data: False |-- (500, 7), data: (500, 15) @ (15, 7) |-- (250, 243), data: True |-- (250, 242), data: True |-- (646, 638), data: False |-- (646, 6), data: (646, 14) @ (14, 6) |-- (146, 140), data: True |-- (500, 492), data: False |-- (500, 7), data: (500, 15) @ (15, 7) |-- (250, 243), data: True |-- (250, 242), data: True |-- (650, 641), data: False |-- (650, 5), data: (650, 14) @ (14, 5) |-- (150, 145), data: True |-- (500, 491), data: False |-- (500, 9), data: (500, 18) @ (18, 9) |-- (250, 241), data: True |-- (250, 241), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.005 Solver_block: 100 / 560 - Time: 1.064 Solver_block: 200 / 560 - Time: 1.038 Solver_block: 300 / 560 - Time: 1.025 Solver_block: 400 / 560 - Time: 1.033 Solver_block: 500 / 560 - Time: 1.024 Solver_block: 560 / 560 - Time: 0.659 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 5.971 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 432/432 Permutation basis: 14832/14832 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3052 Number of blocks in projector: 3052 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: 650 Use submatrix version of eigh solver. (1) Block: 500 / 650 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 241 eigenvectors found. (2) Complementary block size: 18 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 650 / 650 (1) 145 eigenvectors found. (1) Complementary block size: 14 (1) Compute compressed projector. (1) Use standard solver. (1) 5 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 646 Use submatrix version of eigh solver. (1) Block: 500 / 646 (2) Block: 250 / 500 (2) 242 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 15 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 492 eigenvectors found. (1) Block: 646 / 646 (1) 140 eigenvectors found. (1) Complementary block size: 14 (1) Compute compressed projector. (1) Use standard solver. (1) 6 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 646 Use submatrix version of eigh solver. (1) Block: 500 / 646 (2) Block: 250 / 500 (2) 242 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 15 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 492 eigenvectors found. (1) Block: 646 / 646 (1) 140 eigenvectors found. (1) Complementary block size: 14 (1) Compute compressed projector. (1) Use standard solver. (1) 6 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 370 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 370 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 370 Use standard eigh solver. Tree of FC basis block matrices: - (3052, 3012), data: False |-- (370, 365), data: True |-- (370, 365), data: True |-- (370, 365), data: True |-- (646, 638), data: False |-- (646, 6), data: (646, 14) @ (14, 6) |-- (146, 140), data: True |-- (500, 492), data: False |-- (500, 7), data: (500, 15) @ (15, 7) |-- (250, 243), data: True |-- (250, 242), data: True |-- (646, 638), data: False |-- (646, 6), data: (646, 14) @ (14, 6) |-- (146, 140), data: True |-- (500, 492), data: False |-- (500, 7), data: (500, 15) @ (15, 7) |-- (250, 243), data: True |-- (250, 242), data: True |-- (650, 641), data: False |-- (650, 5), data: (650, 14) @ (14, 5) |-- (150, 145), data: True |-- (500, 491), data: False |-- (500, 9), data: (500, 18) @ (18, 9) |-- (250, 241), data: True |-- (250, 241), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) 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 20:49:11]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 20:49:12]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.288601430054109 -5.745459699999999 0.000000000000000 b 3.288601430054109 5.745459699999999 0.000000000000000 c -0.079419878155902 0.000000000000000 6.947089095704935 Atomic positions (fractional): 1 F 0.13454671313286 0.93769071465459 0.95476320912036 18.998 2 F 0.06230928534541 0.86545328686714 0.54523679087964 18.998 3 F 0.86545328686714 0.06230928534541 0.04523679087964 18.998 4 F 0.93769071465459 0.13454671313286 0.45476320912036 18.998 5 F 0.00146583788797 0.61897988298284 0.22315352413423 18.998 6 F 0.38102011701716 0.99853416211203 0.27684647586577 18.998 7 F 0.72473979514131 0.69530409006656 0.78322161285150 18.998 8 F 0.30469590993344 0.27526020485869 0.71677838714850 18.998 9 F 0.27526020485869 0.30469590993344 0.21677838714850 18.998 10 F 0.69530409006656 0.72473979514131 0.28322161285150 18.998 11 F 0.61897988298284 0.00146583788797 0.72315352413423 18.998 12 F 0.99853416211203 0.38102011701716 0.77684647586577 18.998 13 K 0.32134916189917 0.63601717142130 0.49701328320338 39.098 14 K 0.36398282857870 0.67865083810083 0.00298671679662 39.098 15 K 0.67865083810083 0.36398282857870 0.50298671679662 39.098 16 K 0.63601717142130 0.32134916189917 0.99701328320338 39.098 17 Zr 0.04650471087228 0.95349528912772 0.25000000000000 91.224 18 Zr 0.95349528912772 0.04650471087228 0.75000000000000 91.224 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.154405720216435 0.000000000000000 0.000000000000000 b 0.000000000000000 11.490919399999997 0.000000000000000 c -0.158839756311804 0.000000000000000 13.894178191409869 Atomic positions (fractional): 1 F 0.26805935694686 0.40157200076087 0.47738160456018 18.998 > 1 2 F 0.76805935694686 0.40157200076087 0.47738160456018 18.998 > 1 3 F 0.26805935694686 0.40157200076087 0.97738160456018 18.998 > 1 4 F 0.76805935694686 0.40157200076087 0.97738160456018 18.998 > 1 5 F 0.23194064305314 0.40157200076087 0.27261839543982 18.998 > 5 6 F 0.73194064305314 0.40157200076087 0.27261839543982 18.998 > 5 7 F 0.23194064305314 0.40157200076087 0.77261839543982 18.998 > 5 8 F 0.73194064305314 0.40157200076087 0.77261839543982 18.998 > 5 9 F 0.48194064305314 0.09842799923914 0.02261839543982 18.998 > 9 10 F 0.98194064305314 0.09842799923914 0.02261839543982 18.998 > 9 11 F 0.48194064305314 0.09842799923914 0.52261839543982 18.998 > 9 12 F 0.98194064305314 0.09842799923914 0.52261839543982 18.998 > 9 13 F 0.01805935694686 0.09842799923914 0.22738160456018 18.998 > 13 14 F 0.51805935694686 0.09842799923914 0.22738160456018 18.998 > 13 15 F 0.01805935694686 0.09842799923914 0.72738160456018 18.998 > 13 16 F 0.51805935694686 0.09842799923914 0.72738160456018 18.998 > 13 17 F 0.15511143021770 0.30875702254744 0.11157676206711 18.998 > 17 18 F 0.65511143021770 0.30875702254744 0.11157676206711 18.998 > 17 19 F 0.15511143021770 0.30875702254744 0.61157676206711 18.998 > 17 20 F 0.65511143021770 0.30875702254744 0.61157676206711 18.998 > 17 21 F 0.34488856978230 0.30875702254744 0.13842323793289 18.998 > 21 22 F 0.84488856978230 0.30875702254744 0.13842323793289 18.998 > 21 23 F 0.34488856978230 0.30875702254744 0.63842323793289 18.998 > 21 24 F 0.84488856978230 0.30875702254744 0.63842323793289 18.998 > 21 25 F 0.10501097130197 0.48528214746262 0.39161080642575 18.998 > 25 26 F 0.60501097130197 0.48528214746262 0.39161080642575 18.998 > 25 27 F 0.10501097130197 0.48528214746262 0.89161080642575 18.998 > 25 28 F 0.60501097130197 0.48528214746262 0.89161080642575 18.998 > 25 29 F 0.39498902869803 0.48528214746262 0.35838919357425 18.998 > 29 30 F 0.89498902869803 0.48528214746262 0.35838919357425 18.998 > 29 31 F 0.39498902869803 0.48528214746262 0.85838919357425 18.998 > 29 32 F 0.89498902869803 0.48528214746262 0.85838919357425 18.998 > 29 33 F 0.14498902869803 0.01471785253738 0.10838919357425 18.998 > 33 34 F 0.64498902869803 0.01471785253738 0.10838919357425 18.998 > 33 35 F 0.14498902869803 0.01471785253738 0.60838919357425 18.998 > 33 36 F 0.64498902869803 0.01471785253738 0.60838919357425 18.998 > 33 37 F 0.35501097130197 0.01471785253738 0.14161080642575 18.998 > 37 38 F 0.85501097130197 0.01471785253738 0.14161080642575 18.998 > 37 39 F 0.35501097130197 0.01471785253738 0.64161080642575 18.998 > 37 40 F 0.85501097130197 0.01471785253738 0.64161080642575 18.998 > 37 41 F 0.40511143021770 0.19124297745256 0.36157676206711 18.998 > 41 42 F 0.90511143021770 0.19124297745256 0.36157676206711 18.998 > 41 43 F 0.40511143021770 0.19124297745256 0.86157676206711 18.998 > 41 44 F 0.90511143021770 0.19124297745256 0.86157676206711 18.998 > 41 45 F 0.09488856978230 0.19124297745256 0.38842323793289 18.998 > 45 46 F 0.59488856978230 0.19124297745256 0.38842323793289 18.998 > 45 47 F 0.09488856978230 0.19124297745256 0.88842323793289 18.998 > 45 48 F 0.59488856978230 0.19124297745256 0.88842323793289 18.998 > 45 49 F 0.01805935694686 0.90157200076087 0.47738160456018 18.998 > 1 50 F 0.51805935694686 0.90157200076087 0.47738160456018 18.998 > 1 51 F 0.01805935694686 0.90157200076087 0.97738160456018 18.998 > 1 52 F 0.51805935694686 0.90157200076087 0.97738160456018 18.998 > 1 53 F 0.48194064305314 0.90157200076087 0.27261839543982 18.998 > 5 54 F 0.98194064305314 0.90157200076087 0.27261839543982 18.998 > 5 55 F 0.48194064305314 0.90157200076087 0.77261839543982 18.998 > 5 56 F 0.98194064305314 0.90157200076087 0.77261839543982 18.998 > 5 57 F 0.23194064305314 0.59842799923913 0.02261839543982 18.998 > 9 58 F 0.73194064305314 0.59842799923913 0.02261839543982 18.998 > 9 59 F 0.23194064305314 0.59842799923913 0.52261839543982 18.998 > 9 60 F 0.73194064305314 0.59842799923913 0.52261839543982 18.998 > 9 61 F 0.26805935694686 0.59842799923913 0.22738160456018 18.998 > 13 62 F 0.76805935694686 0.59842799923913 0.22738160456018 18.998 > 13 63 F 0.26805935694686 0.59842799923913 0.72738160456018 18.998 > 13 64 F 0.76805935694686 0.59842799923913 0.72738160456018 18.998 > 13 65 F 0.40511143021770 0.80875702254744 0.11157676206711 18.998 > 17 66 F 0.90511143021770 0.80875702254744 0.11157676206711 18.998 > 17 67 F 0.40511143021770 0.80875702254744 0.61157676206711 18.998 > 17 68 F 0.90511143021770 0.80875702254744 0.61157676206711 18.998 > 17 69 F 0.09488856978230 0.80875702254744 0.13842323793289 18.998 > 21 70 F 0.59488856978230 0.80875702254744 0.13842323793289 18.998 > 21 71 F 0.09488856978230 0.80875702254744 0.63842323793289 18.998 > 21 72 F 0.59488856978230 0.80875702254744 0.63842323793289 18.998 > 21 73 F 0.35501097130197 0.98528214746262 0.39161080642575 18.998 > 25 74 F 0.85501097130197 0.98528214746262 0.39161080642575 18.998 > 25 75 F 0.35501097130197 0.98528214746262 0.89161080642575 18.998 > 25 76 F 0.85501097130197 0.98528214746262 0.89161080642575 18.998 > 25 77 F 0.14498902869803 0.98528214746262 0.35838919357425 18.998 > 29 78 F 0.64498902869803 0.98528214746262 0.35838919357425 18.998 > 29 79 F 0.14498902869803 0.98528214746262 0.85838919357425 18.998 > 29 80 F 0.64498902869803 0.98528214746262 0.85838919357425 18.998 > 29 81 F 0.39498902869803 0.51471785253738 0.10838919357425 18.998 > 33 82 F 0.89498902869803 0.51471785253738 0.10838919357425 18.998 > 33 83 F 0.39498902869803 0.51471785253738 0.60838919357425 18.998 > 33 84 F 0.89498902869803 0.51471785253738 0.60838919357425 18.998 > 33 85 F 0.10501097130197 0.51471785253738 0.14161080642575 18.998 > 37 86 F 0.60501097130197 0.51471785253738 0.14161080642575 18.998 > 37 87 F 0.10501097130197 0.51471785253738 0.64161080642575 18.998 > 37 88 F 0.60501097130197 0.51471785253738 0.64161080642575 18.998 > 37 89 F 0.15511143021770 0.69124297745256 0.36157676206711 18.998 > 41 90 F 0.65511143021770 0.69124297745256 0.36157676206711 18.998 > 41 91 F 0.15511143021770 0.69124297745256 0.86157676206711 18.998 > 41 92 F 0.65511143021770 0.69124297745256 0.86157676206711 18.998 > 41 93 F 0.34488856978230 0.69124297745256 0.38842323793289 18.998 > 45 94 F 0.84488856978230 0.69124297745256 0.38842323793289 18.998 > 45 95 F 0.34488856978230 0.69124297745256 0.88842323793289 18.998 > 45 96 F 0.84488856978230 0.69124297745256 0.88842323793289 18.998 > 45 97 K 0.23934158333012 0.15733400476107 0.24850664160169 39.098 > 97 98 K 0.73934158333012 0.15733400476107 0.24850664160169 39.098 > 97 99 K 0.23934158333012 0.15733400476107 0.74850664160169 39.098 > 97 100 K 0.73934158333012 0.15733400476107 0.74850664160169 39.098 > 97 101 K 0.26065841666988 0.15733400476107 0.00149335839831 39.098 > 101 102 K 0.76065841666988 0.15733400476107 0.00149335839831 39.098 > 101 103 K 0.26065841666988 0.15733400476107 0.50149335839831 39.098 > 101 104 K 0.76065841666988 0.15733400476107 0.50149335839831 39.098 > 101 105 K 0.01065841666988 0.34266599523893 0.25149335839831 39.098 > 105 106 K 0.51065841666988 0.34266599523893 0.25149335839831 39.098 > 105 107 K 0.01065841666988 0.34266599523893 0.75149335839831 39.098 > 105 108 K 0.51065841666988 0.34266599523893 0.75149335839831 39.098 > 105 109 K 0.48934158333012 0.34266599523893 0.49850664160169 39.098 > 109 110 K 0.98934158333012 0.34266599523893 0.49850664160169 39.098 > 109 111 K 0.48934158333012 0.34266599523893 0.99850664160169 39.098 > 109 112 K 0.98934158333012 0.34266599523893 0.99850664160169 39.098 > 109 113 K 0.48934158333012 0.65733400476107 0.24850664160169 39.098 > 97 114 K 0.98934158333012 0.65733400476107 0.24850664160169 39.098 > 97 115 K 0.48934158333012 0.65733400476107 0.74850664160169 39.098 > 97 116 K 0.98934158333012 0.65733400476107 0.74850664160169 39.098 > 97 117 K 0.01065841666988 0.65733400476107 0.00149335839831 39.098 > 101 118 K 0.51065841666988 0.65733400476107 0.00149335839831 39.098 > 101 119 K 0.01065841666988 0.65733400476107 0.50149335839831 39.098 > 101 120 K 0.51065841666988 0.65733400476107 0.50149335839831 39.098 > 101 121 K 0.26065841666988 0.84266599523893 0.25149335839831 39.098 > 105 122 K 0.76065841666988 0.84266599523893 0.25149335839831 39.098 > 105 123 K 0.26065841666988 0.84266599523893 0.75149335839831 39.098 > 105 124 K 0.76065841666988 0.84266599523893 0.75149335839831 39.098 > 105 125 K 0.23934158333012 0.84266599523893 0.49850664160169 39.098 > 109 126 K 0.73934158333012 0.84266599523893 0.49850664160169 39.098 > 109 127 K 0.23934158333012 0.84266599523893 0.99850664160169 39.098 > 109 128 K 0.73934158333012 0.84266599523893 0.99850664160169 39.098 > 109 129 Zr 0.25000000000000 0.45349528912772 0.12500000000000 91.224 > 129 130 Zr 0.75000000000000 0.45349528912772 0.12500000000000 91.224 > 129 131 Zr 0.25000000000000 0.45349528912772 0.62500000000000 91.224 > 129 132 Zr 0.75000000000000 0.45349528912772 0.62500000000000 91.224 > 129 133 Zr 0.00000000000000 0.04650471087228 0.37500000000000 91.224 > 133 134 Zr 0.50000000000000 0.04650471087228 0.37500000000000 91.224 > 133 135 Zr 0.00000000000000 0.04650471087228 0.87500000000000 91.224 > 133 136 Zr 0.50000000000000 0.04650471087228 0.87500000000000 91.224 > 133 137 Zr 0.00000000000000 0.95349528912772 0.12500000000000 91.224 > 129 138 Zr 0.50000000000000 0.95349528912772 0.12500000000000 91.224 > 129 139 Zr 0.00000000000000 0.95349528912772 0.62500000000000 91.224 > 129 140 Zr 0.50000000000000 0.95349528912772 0.62500000000000 91.224 > 129 141 Zr 0.25000000000000 0.54650471087228 0.37500000000000 91.224 > 133 142 Zr 0.75000000000000 0.54650471087228 0.37500000000000 91.224 > 133 143 Zr 0.25000000000000 0.54650471087228 0.87500000000000 91.224 > 133 144 Zr 0.75000000000000 0.54650471087228 0.87500000000000 91.224 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.3585298 0.0000000 -0.0408287 0.0000000 2.2903253 0.0000000 -0.0408285 0.0000000 2.3624453 -------------------------- Born effective charges -------------------------- 1 F -0.6356882 0.0820793 0.0227151 0.0730621 -1.0254108 0.2582925 0.0350890 0.2793076 -1.8386183 2 F -0.6356882 -0.0820793 0.0227151 -0.0730621 -1.0254108 -0.2582925 0.0350890 -0.2793076 -1.8386183 3 F -0.6356882 0.0820793 0.0227151 0.0730621 -1.0254108 0.2582925 0.0350890 0.2793076 -1.8386183 4 F -0.6356882 -0.0820793 0.0227151 -0.0730621 -1.0254108 -0.2582925 0.0350890 -0.2793076 -1.8386183 5 F -1.1693869 -0.4192051 -0.0534250 -0.4046339 -1.3660044 -0.0537224 -0.0472083 -0.0559774 -0.8549653 6 F -1.1693869 0.4192051 -0.0534250 0.4046339 -1.3660044 0.0537224 -0.0472083 0.0559774 -0.8549653 7 F -1.7028162 -0.3877807 0.1336659 -0.3459965 -0.8457089 0.0460766 0.1134620 0.0211270 -0.8829289 8 F -1.7028162 0.3877807 0.1336659 0.3459965 -0.8457089 -0.0460766 0.1134620 -0.0211270 -0.8829289 9 F -1.7028162 -0.3877807 0.1336659 -0.3459965 -0.8457089 0.0460766 0.1134620 0.0211270 -0.8829289 10 F -1.7028162 0.3877807 0.1336659 0.3459965 -0.8457089 -0.0460766 0.1134620 -0.0211270 -0.8829289 11 F -1.1693869 0.4192051 -0.0534250 0.4046339 -1.3660044 0.0537224 -0.0472083 0.0559774 -0.8549653 12 F -1.1693869 -0.4192051 -0.0534250 -0.4046339 -1.3660044 -0.0537224 -0.0472083 -0.0559774 -0.8549653 13 K 1.2978493 0.0403254 -0.0244589 0.0365630 1.2567042 -0.0810654 -0.0294571 -0.0452964 1.1655840 14 K 1.2978493 -0.0403254 -0.0244589 -0.0365630 1.2567042 0.0810654 -0.0294571 0.0452964 1.1655840 15 K 1.2978493 0.0403254 -0.0244589 0.0365630 1.2567042 -0.0810654 -0.0294571 -0.0452964 1.1655840 16 K 1.2978493 -0.0403254 -0.0244589 -0.0365630 1.2567042 0.0810654 -0.0294571 0.0452964 1.1655840 17 Zr 4.4200842 0.0000000 -0.1569943 0.0000000 3.9608398 0.0000000 -0.1437713 0.0000000 4.8218571 18 Zr 4.4200842 0.0000000 -0.1569943 0.0000000 3.9608398 0.0000000 -0.1437713 0.0000000 4.8218571 ---------------------------------------------------------------------------- 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] [-0.0001 0.0000 0.0100] [ 0.0001 0.0000 -0.0100] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0001 0.0000 0.0100] [ 0.0001 0.0000 -0.0100] 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] [-0.0001 0.0000 0.0100] [ 0.0001 0.0000 -0.0100] Computing fc3[ 97, 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] [-0.0001 0.0000 0.0100] [ 0.0001 0.0000 -0.0100] Computing fc3[ 129, 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] [-0.0001 0.0000 0.0100] [ 0.0001 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000001 (xyx) 0.00000001 (xyx) 0.00000001 (xxy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000001 (zx) -0.00000001 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 20:49:44]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 20:49:44]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 2] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.288601430054109 -5.745459699999999 0.000000000000000 b 3.288601430054109 5.745459699999999 0.000000000000000 c -0.079419878155902 0.000000000000000 6.947089095704935 Atomic positions (fractional): 1 F 0.13454671313286 0.93769071465459 0.95476320912036 18.998 2 F 0.06230928534541 0.86545328686714 0.54523679087964 18.998 3 F 0.86545328686714 0.06230928534541 0.04523679087964 18.998 4 F 0.93769071465459 0.13454671313286 0.45476320912036 18.998 5 F 0.00146583788797 0.61897988298284 0.22315352413423 18.998 6 F 0.38102011701716 0.99853416211203 0.27684647586577 18.998 7 F 0.72473979514131 0.69530409006656 0.78322161285150 18.998 8 F 0.30469590993344 0.27526020485869 0.71677838714850 18.998 9 F 0.27526020485869 0.30469590993344 0.21677838714850 18.998 10 F 0.69530409006656 0.72473979514131 0.28322161285150 18.998 11 F 0.61897988298284 0.00146583788797 0.72315352413423 18.998 12 F 0.99853416211203 0.38102011701716 0.77684647586577 18.998 13 K 0.32134916189917 0.63601717142130 0.49701328320338 39.098 14 K 0.36398282857870 0.67865083810083 0.00298671679662 39.098 15 K 0.67865083810083 0.36398282857870 0.50298671679662 39.098 16 K 0.63601717142130 0.32134916189917 0.99701328320338 39.098 17 Zr 0.04650471087228 0.95349528912772 0.25000000000000 91.224 18 Zr 0.95349528912772 0.04650471087228 0.75000000000000 91.224 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.154405720216435 0.000000000000000 0.000000000000000 b 0.000000000000000 11.490919399999997 0.000000000000000 c -0.158839756311804 0.000000000000000 13.894178191409869 Atomic positions (fractional): 1 F 0.26805935694686 0.40157200076087 0.47738160456018 18.998 > 1 2 F 0.76805935694686 0.40157200076087 0.47738160456018 18.998 > 1 3 F 0.26805935694686 0.40157200076087 0.97738160456018 18.998 > 1 4 F 0.76805935694686 0.40157200076087 0.97738160456018 18.998 > 1 5 F 0.23194064305314 0.40157200076087 0.27261839543982 18.998 > 5 6 F 0.73194064305314 0.40157200076087 0.27261839543982 18.998 > 5 7 F 0.23194064305314 0.40157200076087 0.77261839543982 18.998 > 5 8 F 0.73194064305314 0.40157200076087 0.77261839543982 18.998 > 5 9 F 0.48194064305314 0.09842799923914 0.02261839543982 18.998 > 9 10 F 0.98194064305314 0.09842799923914 0.02261839543982 18.998 > 9 11 F 0.48194064305314 0.09842799923914 0.52261839543982 18.998 > 9 12 F 0.98194064305314 0.09842799923914 0.52261839543982 18.998 > 9 13 F 0.01805935694686 0.09842799923914 0.22738160456018 18.998 > 13 14 F 0.51805935694686 0.09842799923914 0.22738160456018 18.998 > 13 15 F 0.01805935694686 0.09842799923914 0.72738160456018 18.998 > 13 16 F 0.51805935694686 0.09842799923914 0.72738160456018 18.998 > 13 17 F 0.15511143021770 0.30875702254744 0.11157676206711 18.998 > 17 18 F 0.65511143021770 0.30875702254744 0.11157676206711 18.998 > 17 19 F 0.15511143021770 0.30875702254744 0.61157676206711 18.998 > 17 20 F 0.65511143021770 0.30875702254744 0.61157676206711 18.998 > 17 21 F 0.34488856978230 0.30875702254744 0.13842323793289 18.998 > 21 22 F 0.84488856978230 0.30875702254744 0.13842323793289 18.998 > 21 23 F 0.34488856978230 0.30875702254744 0.63842323793289 18.998 > 21 24 F 0.84488856978230 0.30875702254744 0.63842323793289 18.998 > 21 25 F 0.10501097130197 0.48528214746262 0.39161080642575 18.998 > 25 26 F 0.60501097130197 0.48528214746262 0.39161080642575 18.998 > 25 27 F 0.10501097130197 0.48528214746262 0.89161080642575 18.998 > 25 28 F 0.60501097130197 0.48528214746262 0.89161080642575 18.998 > 25 29 F 0.39498902869803 0.48528214746262 0.35838919357425 18.998 > 29 30 F 0.89498902869803 0.48528214746262 0.35838919357425 18.998 > 29 31 F 0.39498902869803 0.48528214746262 0.85838919357425 18.998 > 29 32 F 0.89498902869803 0.48528214746262 0.85838919357425 18.998 > 29 33 F 0.14498902869803 0.01471785253738 0.10838919357425 18.998 > 33 34 F 0.64498902869803 0.01471785253738 0.10838919357425 18.998 > 33 35 F 0.14498902869803 0.01471785253738 0.60838919357425 18.998 > 33 36 F 0.64498902869803 0.01471785253738 0.60838919357425 18.998 > 33 37 F 0.35501097130197 0.01471785253738 0.14161080642575 18.998 > 37 38 F 0.85501097130197 0.01471785253738 0.14161080642575 18.998 > 37 39 F 0.35501097130197 0.01471785253738 0.64161080642575 18.998 > 37 40 F 0.85501097130197 0.01471785253738 0.64161080642575 18.998 > 37 41 F 0.40511143021770 0.19124297745256 0.36157676206711 18.998 > 41 42 F 0.90511143021770 0.19124297745256 0.36157676206711 18.998 > 41 43 F 0.40511143021770 0.19124297745256 0.86157676206711 18.998 > 41 44 F 0.90511143021770 0.19124297745256 0.86157676206711 18.998 > 41 45 F 0.09488856978230 0.19124297745256 0.38842323793289 18.998 > 45 46 F 0.59488856978230 0.19124297745256 0.38842323793289 18.998 > 45 47 F 0.09488856978230 0.19124297745256 0.88842323793289 18.998 > 45 48 F 0.59488856978230 0.19124297745256 0.88842323793289 18.998 > 45 49 F 0.01805935694686 0.90157200076087 0.47738160456018 18.998 > 1 50 F 0.51805935694686 0.90157200076087 0.47738160456018 18.998 > 1 51 F 0.01805935694686 0.90157200076087 0.97738160456018 18.998 > 1 52 F 0.51805935694686 0.90157200076087 0.97738160456018 18.998 > 1 53 F 0.48194064305314 0.90157200076087 0.27261839543982 18.998 > 5 54 F 0.98194064305314 0.90157200076087 0.27261839543982 18.998 > 5 55 F 0.48194064305314 0.90157200076087 0.77261839543982 18.998 > 5 56 F 0.98194064305314 0.90157200076087 0.77261839543982 18.998 > 5 57 F 0.23194064305314 0.59842799923913 0.02261839543982 18.998 > 9 58 F 0.73194064305314 0.59842799923913 0.02261839543982 18.998 > 9 59 F 0.23194064305314 0.59842799923913 0.52261839543982 18.998 > 9 60 F 0.73194064305314 0.59842799923913 0.52261839543982 18.998 > 9 61 F 0.26805935694686 0.59842799923913 0.22738160456018 18.998 > 13 62 F 0.76805935694686 0.59842799923913 0.22738160456018 18.998 > 13 63 F 0.26805935694686 0.59842799923913 0.72738160456018 18.998 > 13 64 F 0.76805935694686 0.59842799923913 0.72738160456018 18.998 > 13 65 F 0.40511143021770 0.80875702254744 0.11157676206711 18.998 > 17 66 F 0.90511143021770 0.80875702254744 0.11157676206711 18.998 > 17 67 F 0.40511143021770 0.80875702254744 0.61157676206711 18.998 > 17 68 F 0.90511143021770 0.80875702254744 0.61157676206711 18.998 > 17 69 F 0.09488856978230 0.80875702254744 0.13842323793289 18.998 > 21 70 F 0.59488856978230 0.80875702254744 0.13842323793289 18.998 > 21 71 F 0.09488856978230 0.80875702254744 0.63842323793289 18.998 > 21 72 F 0.59488856978230 0.80875702254744 0.63842323793289 18.998 > 21 73 F 0.35501097130197 0.98528214746262 0.39161080642575 18.998 > 25 74 F 0.85501097130197 0.98528214746262 0.39161080642575 18.998 > 25 75 F 0.35501097130197 0.98528214746262 0.89161080642575 18.998 > 25 76 F 0.85501097130197 0.98528214746262 0.89161080642575 18.998 > 25 77 F 0.14498902869803 0.98528214746262 0.35838919357425 18.998 > 29 78 F 0.64498902869803 0.98528214746262 0.35838919357425 18.998 > 29 79 F 0.14498902869803 0.98528214746262 0.85838919357425 18.998 > 29 80 F 0.64498902869803 0.98528214746262 0.85838919357425 18.998 > 29 81 F 0.39498902869803 0.51471785253738 0.10838919357425 18.998 > 33 82 F 0.89498902869803 0.51471785253738 0.10838919357425 18.998 > 33 83 F 0.39498902869803 0.51471785253738 0.60838919357425 18.998 > 33 84 F 0.89498902869803 0.51471785253738 0.60838919357425 18.998 > 33 85 F 0.10501097130197 0.51471785253738 0.14161080642575 18.998 > 37 86 F 0.60501097130197 0.51471785253738 0.14161080642575 18.998 > 37 87 F 0.10501097130197 0.51471785253738 0.64161080642575 18.998 > 37 88 F 0.60501097130197 0.51471785253738 0.64161080642575 18.998 > 37 89 F 0.15511143021770 0.69124297745256 0.36157676206711 18.998 > 41 90 F 0.65511143021770 0.69124297745256 0.36157676206711 18.998 > 41 91 F 0.15511143021770 0.69124297745256 0.86157676206711 18.998 > 41 92 F 0.65511143021770 0.69124297745256 0.86157676206711 18.998 > 41 93 F 0.34488856978230 0.69124297745256 0.38842323793289 18.998 > 45 94 F 0.84488856978230 0.69124297745256 0.38842323793289 18.998 > 45 95 F 0.34488856978230 0.69124297745256 0.88842323793289 18.998 > 45 96 F 0.84488856978230 0.69124297745256 0.88842323793289 18.998 > 45 97 K 0.23934158333012 0.15733400476107 0.24850664160169 39.098 > 97 98 K 0.73934158333012 0.15733400476107 0.24850664160169 39.098 > 97 99 K 0.23934158333012 0.15733400476107 0.74850664160169 39.098 > 97 100 K 0.73934158333012 0.15733400476107 0.74850664160169 39.098 > 97 101 K 0.26065841666988 0.15733400476107 0.00149335839831 39.098 > 101 102 K 0.76065841666988 0.15733400476107 0.00149335839831 39.098 > 101 103 K 0.26065841666988 0.15733400476107 0.50149335839831 39.098 > 101 104 K 0.76065841666988 0.15733400476107 0.50149335839831 39.098 > 101 105 K 0.01065841666988 0.34266599523893 0.25149335839831 39.098 > 105 106 K 0.51065841666988 0.34266599523893 0.25149335839831 39.098 > 105 107 K 0.01065841666988 0.34266599523893 0.75149335839831 39.098 > 105 108 K 0.51065841666988 0.34266599523893 0.75149335839831 39.098 > 105 109 K 0.48934158333012 0.34266599523893 0.49850664160169 39.098 > 109 110 K 0.98934158333012 0.34266599523893 0.49850664160169 39.098 > 109 111 K 0.48934158333012 0.34266599523893 0.99850664160169 39.098 > 109 112 K 0.98934158333012 0.34266599523893 0.99850664160169 39.098 > 109 113 K 0.48934158333012 0.65733400476107 0.24850664160169 39.098 > 97 114 K 0.98934158333012 0.65733400476107 0.24850664160169 39.098 > 97 115 K 0.48934158333012 0.65733400476107 0.74850664160169 39.098 > 97 116 K 0.98934158333012 0.65733400476107 0.74850664160169 39.098 > 97 117 K 0.01065841666988 0.65733400476107 0.00149335839831 39.098 > 101 118 K 0.51065841666988 0.65733400476107 0.00149335839831 39.098 > 101 119 K 0.01065841666988 0.65733400476107 0.50149335839831 39.098 > 101 120 K 0.51065841666988 0.65733400476107 0.50149335839831 39.098 > 101 121 K 0.26065841666988 0.84266599523893 0.25149335839831 39.098 > 105 122 K 0.76065841666988 0.84266599523893 0.25149335839831 39.098 > 105 123 K 0.26065841666988 0.84266599523893 0.75149335839831 39.098 > 105 124 K 0.76065841666988 0.84266599523893 0.75149335839831 39.098 > 105 125 K 0.23934158333012 0.84266599523893 0.49850664160169 39.098 > 109 126 K 0.73934158333012 0.84266599523893 0.49850664160169 39.098 > 109 127 K 0.23934158333012 0.84266599523893 0.99850664160169 39.098 > 109 128 K 0.73934158333012 0.84266599523893 0.99850664160169 39.098 > 109 129 Zr 0.25000000000000 0.45349528912772 0.12500000000000 91.224 > 129 130 Zr 0.75000000000000 0.45349528912772 0.12500000000000 91.224 > 129 131 Zr 0.25000000000000 0.45349528912772 0.62500000000000 91.224 > 129 132 Zr 0.75000000000000 0.45349528912772 0.62500000000000 91.224 > 129 133 Zr 0.00000000000000 0.04650471087228 0.37500000000000 91.224 > 133 134 Zr 0.50000000000000 0.04650471087228 0.37500000000000 91.224 > 133 135 Zr 0.00000000000000 0.04650471087228 0.87500000000000 91.224 > 133 136 Zr 0.50000000000000 0.04650471087228 0.87500000000000 91.224 > 133 137 Zr 0.00000000000000 0.95349528912772 0.12500000000000 91.224 > 129 138 Zr 0.50000000000000 0.95349528912772 0.12500000000000 91.224 > 129 139 Zr 0.00000000000000 0.95349528912772 0.62500000000000 91.224 > 129 140 Zr 0.50000000000000 0.95349528912772 0.62500000000000 91.224 > 129 141 Zr 0.25000000000000 0.54650471087228 0.37500000000000 91.224 > 133 142 Zr 0.75000000000000 0.54650471087228 0.37500000000000 91.224 > 133 143 Zr 0.25000000000000 0.54650471087228 0.87500000000000 91.224 > 133 144 Zr 0.75000000000000 0.54650471087228 0.87500000000000 91.224 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.3585298 0.0000000 -0.0408287 0.0000000 2.2903253 0.0000000 -0.0408285 0.0000000 2.3624453 -------------------------- Born effective charges -------------------------- 1 F -0.6356882 0.0820793 0.0227151 0.0730621 -1.0254108 0.2582925 0.0350890 0.2793076 -1.8386183 2 F -0.6356882 -0.0820793 0.0227151 -0.0730621 -1.0254108 -0.2582925 0.0350890 -0.2793076 -1.8386183 3 F -0.6356882 0.0820793 0.0227151 0.0730621 -1.0254108 0.2582925 0.0350890 0.2793076 -1.8386183 4 F -0.6356882 -0.0820793 0.0227151 -0.0730621 -1.0254108 -0.2582925 0.0350890 -0.2793076 -1.8386183 5 F -1.1693869 -0.4192051 -0.0534250 -0.4046339 -1.3660044 -0.0537224 -0.0472083 -0.0559774 -0.8549653 6 F -1.1693869 0.4192051 -0.0534250 0.4046339 -1.3660044 0.0537224 -0.0472083 0.0559774 -0.8549653 7 F -1.7028162 -0.3877807 0.1336659 -0.3459965 -0.8457089 0.0460766 0.1134620 0.0211270 -0.8829289 8 F -1.7028162 0.3877807 0.1336659 0.3459965 -0.8457089 -0.0460766 0.1134620 -0.0211270 -0.8829289 9 F -1.7028162 -0.3877807 0.1336659 -0.3459965 -0.8457089 0.0460766 0.1134620 0.0211270 -0.8829289 10 F -1.7028162 0.3877807 0.1336659 0.3459965 -0.8457089 -0.0460766 0.1134620 -0.0211270 -0.8829289 11 F -1.1693869 0.4192051 -0.0534250 0.4046339 -1.3660044 0.0537224 -0.0472083 0.0559774 -0.8549653 12 F -1.1693869 -0.4192051 -0.0534250 -0.4046339 -1.3660044 -0.0537224 -0.0472083 -0.0559774 -0.8549653 13 K 1.2978493 0.0403254 -0.0244589 0.0365630 1.2567042 -0.0810654 -0.0294571 -0.0452964 1.1655840 14 K 1.2978493 -0.0403254 -0.0244589 -0.0365630 1.2567042 0.0810654 -0.0294571 0.0452964 1.1655840 15 K 1.2978493 0.0403254 -0.0244589 0.0365630 1.2567042 -0.0810654 -0.0294571 -0.0452964 1.1655840 16 K 1.2978493 -0.0403254 -0.0244589 -0.0365630 1.2567042 0.0810654 -0.0294571 0.0452964 1.1655840 17 Zr 4.4200842 0.0000000 -0.1569943 0.0000000 3.9608398 0.0000000 -0.1437713 0.0000000 4.8218571 18 Zr 4.4200842 0.0000000 -0.1569943 0.0000000 3.9608398 0.0000000 -0.1437713 0.0000000 4.8218571 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000001 (xyx) 0.00000001 (xyx) 0.00000001 (xxy) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 9 9 7 ] 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: 0.65, Number of G-points: 313, Lambda: 0.10 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/160) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 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 1.627 ( 0.000 0.000 0.000) 0.000 2.088 ( 0.000 0.000 0.000) 0.000 2.333 ( 0.000 0.000 0.000) 0.000 2.524 ( 0.000 0.000 0.000) 0.000 2.740 ( 0.000 0.000 0.000) 0.000 2.942 ( 0.000 0.000 0.000) 0.000 3.172 ( 0.000 0.000 0.000) 0.000 3.586 ( 0.000 0.000 0.000) 0.000 3.662 ( 0.000 0.000 0.000) 0.000 3.782 ( 0.000 0.000 0.000) 0.000 4.021 ( 0.000 0.000 0.000) 0.000 4.115 ( 0.000 0.000 0.000) 0.000 4.213 ( 0.000 0.000 0.000) 0.000 4.364 ( 0.000 0.000 0.000) 0.000 4.613 ( 0.000 0.000 0.000) 0.000 4.666 ( 0.000 0.000 0.000) 0.000 4.847 ( 0.000 0.000 0.000) 0.000 4.916 ( 0.000 0.000 0.000) 0.000 5.110 ( 0.000 0.000 0.000) 0.000 5.315 ( 0.000 0.000 0.000) 0.000 5.689 ( 0.000 0.000 0.000) 0.000 5.721 ( 0.000 0.000 0.000) 0.000 5.823 ( 0.000 0.000 0.000) 0.000 6.051 ( 0.000 0.000 0.000) 0.000 6.749 ( 0.000 0.000 0.000) 0.000 6.876 ( 0.000 0.000 0.000) 0.000 7.296 ( 0.000 0.000 0.000) 0.000 7.514 ( 0.000 0.000 0.000) 0.000 8.362 ( 0.000 0.000 0.000) 0.000 8.685 ( 0.000 0.000 0.000) 0.000 9.015 ( 0.000 0.000 0.000) 0.000 9.027 ( 0.000 0.000 0.000) 0.000 9.161 ( 0.000 0.000 0.000) 0.000 9.373 ( 0.000 0.000 0.000) 0.000 9.667 ( 0.000 0.000 0.000) 0.000 10.052 ( 0.000 0.000 0.000) 0.000 10.590 ( 0.000 0.000 0.000) 0.000 10.624 ( 0.000 0.000 0.000) 0.000 10.739 ( 0.000 0.000 0.000) 0.000 10.751 ( 0.000 0.000 0.000) 0.000 11.024 ( 0.000 0.000 0.000) 0.000 11.313 ( 0.000 0.000 0.000) 0.000 11.722 ( 0.000 0.000 0.000) 0.000 12.637 ( 0.000 0.000 0.000) 0.000 12.785 ( 0.000 0.000 0.000) 0.000 13.006 ( 0.000 0.000 0.000) 0.000 13.027 ( 0.000 0.000 0.000) 0.000 13.424 ( 0.000 0.000 0.000) 0.000 13.476 ( 0.000 0.000 0.000) 0.000 15.346 ( 0.000 0.000 0.000) 0.000 15.895 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/160) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.402 ( 18.684 -8.709 -0.514) 20.621 0.523 ( 22.959 -13.178 -4.014) 26.775 0.929 ( 43.805 -17.057 -7.169) 47.552 1.650 ( 0.760 -3.479 3.183) 4.776 2.315 ( 2.194 6.112 -0.680) 6.530 2.491 ( 11.778 15.014 15.849) 24.806 2.558 ( 5.142 1.239 2.260) 5.752 2.764 ( 1.816 -0.339 2.408) 3.035 2.977 ( 0.805 2.212 2.116) 3.166 3.153 ( -3.955 -1.648 -5.004) 6.588 3.556 ( -3.097 1.087 -5.078) 6.046 3.682 ( 2.672 1.892 6.491) 7.270 3.788 ( 0.116 0.319 6.687) 6.696 4.045 ( -12.537 -7.555 4.780) 15.398 4.102 ( -1.503 3.521 -1.794) 4.228 4.243 ( -6.057 -5.840 -0.562) 8.432 4.381 ( 0.275 -3.839 -1.949) 4.315 4.585 ( -3.094 1.267 0.285) 3.356 4.643 ( -1.386 -0.272 2.491) 2.863 4.842 ( -2.819 -5.781 -4.320) 7.748 5.138 ( 5.213 1.362 -2.200) 5.820 5.247 ( 0.321 -0.645 -20.964) 20.977 5.642 ( -2.546 4.076 12.904) 13.770 5.689 ( 3.113 7.584 19.820) 21.448 5.793 ( -0.294 -0.725 17.859) 17.876 5.855 ( 1.035 5.124 -26.856) 27.360 6.058 ( 0.840 0.090 -0.704) 1.100 6.766 ( -8.338 -6.822 0.787) 10.802 6.846 ( -3.816 -0.424 0.333) 3.854 7.289 ( -0.668 0.331 -0.274) 0.794 7.510 ( 0.009 0.717 -0.005) 0.718 8.444 ( 1.980 0.957 16.025) 16.176 8.710 ( 0.749 3.801 -5.639) 6.842 9.065 ( 1.861 -1.897 0.008) 2.657 9.150 ( 0.438 0.075 -0.149) 0.469 9.219 ( 7.868 8.665 -8.590) 14.518 9.381 ( 0.365 -0.375 -2.917) 2.964 9.624 ( -6.395 -0.646 -1.913) 6.706 10.056 ( -0.964 -2.673 -0.270) 2.855 10.563 ( -3.232 2.393 -3.394) 5.262 10.634 ( 1.793 1.703 2.470) 3.495 10.753 ( -0.833 -2.770 -5.831) 6.509 10.783 ( 1.868 2.340 23.929) 24.116 11.057 ( 2.898 -0.759 -2.130) 3.676 11.353 ( 3.399 -1.672 -1.392) 4.035 11.813 ( -11.463 -13.539 1.328) 17.790 12.658 ( 0.624 -1.784 0.267) 1.909 12.767 ( -4.700 -3.262 1.902) 6.029 12.868 ( -4.195 6.304 -3.353) 8.281 13.146 ( -9.079 -20.793 -2.322) 22.807 13.594 ( 16.214 -1.175 6.150) 17.380 15.335 ( -1.627 -0.684 -0.669) 1.887 15.873 ( -0.020 1.923 -0.521) 1.992 16.477 ( 21.896 41.153 -25.684) 53.223 ======================= Grid point 2 (3/160) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.795 ( 18.078 -7.953 -1.565) 19.812 1.021 ( 21.052 -12.734 -4.183) 24.957 1.712 ( 6.184 -7.853 3.612) 10.629 1.788 ( 33.643 -12.434 -5.234) 36.248 2.305 ( 3.782 6.163 0.213) 7.234 2.564 ( 9.994 7.412 -0.147) 12.443 2.664 ( 8.330 1.967 -0.966) 8.614 2.781 ( -0.470 0.345 1.709) 1.806 2.933 ( -4.247 2.486 -2.116) 5.357 3.115 ( -2.866 -4.552 -5.785) 7.900 3.475 ( -4.575 0.931 -3.323) 5.731 3.700 ( -0.214 1.638 7.027) 7.219 3.765 ( -2.156 0.339 9.800) 10.040 3.935 ( -2.026 5.707 0.936) 6.128 3.993 ( -8.623 0.590 1.599) 8.790 4.152 ( -5.123 0.630 -1.069) 5.271 4.419 ( 0.681 -0.694 -2.266) 2.466 4.538 ( -0.556 -0.838 0.154) 1.017 4.633 ( -0.860 -0.906 2.908) 3.165 4.865 ( -3.494 -9.118 -3.813) 10.482 5.195 ( 2.741 2.238 -1.641) 3.901 5.250 ( 0.571 1.137 -4.811) 4.976 5.529 ( -4.136 8.994 17.715) 20.294 5.664 ( -0.550 1.300 2.373) 2.761 5.782 ( 0.064 1.743 -7.480) 7.681 5.836 ( -0.200 -0.032 -3.333) 3.339 6.072 ( 0.776 0.105 -1.335) 1.547 6.676 ( -6.727 -1.815 0.807) 7.014 6.762 ( -6.218 -0.391 0.179) 6.233 7.268 ( -1.215 0.511 -0.279) 1.347 7.503 ( 0.166 1.039 0.018) 1.052 8.480 ( 1.911 -0.817 5.634) 6.005 8.681 ( 0.244 3.548 -1.790) 3.982 9.070 ( -1.865 -0.652 -0.273) 1.994 9.199 ( 3.792 -0.898 -0.212) 3.903 9.277 ( 4.016 2.659 -2.286) 5.332 9.379 ( -1.276 -1.497 -2.203) 2.954 9.521 ( -4.319 0.642 -4.944) 6.596 10.080 ( 0.118 -4.320 -0.575) 4.360 10.474 ( -2.487 5.084 -1.114) 5.768 10.654 ( 2.408 1.377 0.519) 2.822 10.763 ( -1.077 -2.187 -3.058) 3.911 10.794 ( 1.571 1.778 13.080) 13.294 11.128 ( 4.232 -0.818 -0.713) 4.368 11.441 ( 4.043 -2.594 -2.004) 5.205 11.740 ( -4.941 -0.555 0.079) 4.973 12.631 ( -2.675 3.179 -0.499) 4.185 12.740 ( -0.722 -3.591 1.083) 3.820 12.810 ( -0.390 1.124 -1.208) 1.696 13.175 ( -10.045 -18.963 -2.326) 21.585 13.907 ( 17.686 -1.552 5.697) 18.646 15.308 ( -2.365 -0.833 -0.903) 2.665 15.843 ( -2.454 -0.034 -0.223) 2.464 16.434 ( 10.865 23.675 -10.873) 28.228 ======================= Grid point 3 (4/160) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.153 ( 15.570 -6.185 -2.387) 16.922 1.468 ( 17.598 -11.744 -4.783) 21.691 1.829 ( 1.867 -7.646 6.846) 10.431 2.308 ( 6.090 4.040 1.148) 7.398 2.412 ( 20.172 -2.475 -3.150) 20.566 2.678 ( 1.478 2.416 -6.254) 6.865 2.740 ( 7.387 0.822 -0.279) 7.438 2.764 ( -3.102 4.783 -6.542) 8.677 2.833 ( 4.790 1.888 -0.742) 5.202 3.143 ( -0.915 -6.314 -1.145) 6.482 3.394 ( -4.262 -0.374 -1.612) 4.572 3.652 ( -4.290 -1.566 4.674) 6.535 3.708 ( -2.802 7.945 4.110) 9.374 3.743 ( -8.766 2.405 1.614) 9.232 3.976 ( 3.118 -0.653 3.997) 5.111 4.090 ( -1.987 -0.854 2.443) 3.263 4.409 ( -0.450 2.626 -2.979) 3.997 4.577 ( 1.801 -2.990 -0.767) 3.574 4.632 ( -0.102 -0.544 3.462) 3.506 4.878 ( -5.470 -8.205 -3.212) 10.371 5.173 ( 0.251 7.549 -2.449) 7.940 5.242 ( 0.360 1.757 -2.135) 2.788 5.354 ( -6.146 6.443 14.603) 17.104 5.664 ( 0.117 -1.811 -2.628) 3.194 5.771 ( 0.683 1.765 -4.541) 4.920 5.834 ( -0.283 -0.181 -0.070) 0.343 6.077 ( -0.084 0.091 -1.385) 1.391 6.590 ( -4.293 -0.209 0.914) 4.394 6.660 ( -5.840 -0.635 -0.453) 5.892 7.242 ( -1.184 0.435 -0.132) 1.268 7.497 ( 0.281 0.830 0.034) 0.877 8.518 ( 1.258 -0.877 2.210) 2.690 8.651 ( -0.045 2.715 -0.624) 2.786 9.043 ( -2.078 -1.046 -0.894) 2.492 9.255 ( -2.032 -0.747 2.019) 2.961 9.271 ( 2.988 1.652 -0.346) 3.432 9.396 ( 0.873 -1.310 -1.131) 1.938 9.475 ( -0.836 0.631 -6.524) 6.608 10.143 ( 1.880 -4.493 -0.572) 4.904 10.391 ( -1.726 4.305 -0.310) 4.649 10.688 ( 2.596 0.663 -0.451) 2.717 10.759 ( -0.850 -0.620 1.202) 1.597 10.807 ( 0.933 0.517 4.707) 4.827 11.204 ( 3.842 -0.099 0.034) 3.844 11.521 ( 1.876 -3.076 -2.162) 4.202 11.665 ( -2.369 3.112 0.498) 3.943 12.582 ( 1.747 4.793 -0.877) 5.177 12.763 ( 0.406 -0.901 2.005) 2.235 12.809 ( 0.080 -1.545 -1.019) 1.852 13.170 ( -10.868 -16.689 -1.771) 19.994 14.189 ( 13.343 -0.818 3.841) 13.909 15.277 ( -1.919 -0.508 -0.678) 2.098 15.795 ( -3.086 -0.258 -0.230) 3.105 16.389 ( 6.078 14.580 -5.168) 16.620 ======================= Grid point 4 (5/160) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.402 ( 7.412 -2.544 -1.512) 7.981 1.809 ( 9.153 -8.800 -8.232) 15.132 1.899 ( 0.392 -1.152 10.070) 10.143 2.359 ( 4.968 2.248 5.476) 7.728 2.507 ( -8.899 3.020 -7.949) 12.309 2.600 ( 2.814 -0.642 -3.563) 4.585 2.649 ( -2.134 4.331 1.633) 5.097 2.950 ( 7.883 0.595 -0.553) 7.924 2.978 ( 9.054 -0.090 -3.867) 9.846 3.147 ( -4.669 -2.819 0.320) 5.464 3.356 ( -1.046 -0.881 0.260) 1.392 3.568 ( -2.603 1.622 -1.045) 3.239 3.597 ( -3.331 -0.286 3.591) 4.907 3.674 ( -0.957 0.932 0.781) 1.548 4.012 ( 0.047 -0.257 0.018) 0.262 4.151 ( 5.548 -3.340 5.954) 8.797 4.352 ( -2.392 3.742 -3.634) 5.739 4.628 ( 0.300 -3.302 -1.452) 3.620 4.641 ( 0.678 0.434 2.311) 2.448 4.820 ( -5.632 -1.423 -1.415) 5.978 5.091 ( -0.131 5.373 0.316) 5.384 5.233 ( 0.744 1.731 -3.494) 3.970 5.257 ( -2.520 -0.291 7.068) 7.509 5.685 ( 0.210 -1.192 -1.342) 1.807 5.765 ( 0.291 0.926 -1.251) 1.584 5.831 ( -0.129 -0.040 0.150) 0.202 6.071 ( -0.353 0.046 -0.609) 0.705 6.543 ( -1.200 0.279 0.633) 1.385 6.592 ( -2.520 -0.537 -0.541) 2.633 7.224 ( -0.490 0.170 -0.025) 0.520 7.496 ( 0.143 0.302 0.018) 0.334 8.536 ( 0.253 -0.244 0.595) 0.692 8.632 ( 0.006 0.971 -0.162) 0.985 9.024 ( -0.977 -0.592 -0.405) 1.212 9.222 ( -1.057 -0.057 0.984) 1.446 9.311 ( 1.690 0.477 -0.030) 1.756 9.410 ( -0.047 -0.414 -0.076) 0.423 9.464 ( -0.170 0.139 -2.964) 2.972 10.210 ( 1.344 -2.353 -0.168) 2.715 10.336 ( -0.899 2.105 -0.104) 2.291 10.720 ( 1.303 0.074 -0.473) 1.388 10.752 ( -0.290 -0.095 0.786) 0.843 10.815 ( 0.263 0.092 1.366) 1.394 11.251 ( 1.618 0.177 0.122) 1.632 11.566 ( 0.438 -2.767 -1.893) 3.381 11.605 ( -1.095 2.958 1.255) 3.395 12.581 ( 1.769 2.523 -0.500) 3.122 12.775 ( 0.850 0.684 1.319) 1.712 12.831 ( 0.512 -1.123 -0.588) 1.367 13.139 ( -5.889 -7.528 -0.748) 9.587 14.354 ( 5.033 -0.198 1.368) 5.219 15.257 ( -0.701 -0.142 -0.239) 0.754 15.755 ( -1.446 -0.076 -0.125) 1.453 16.361 ( 2.010 5.045 -1.568) 5.652 ======================= Grid point 10 (6/160) ======================= q-point: ( 0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.781 ( 22.739 -0.000 -4.328) 23.148 0.822 ( 23.095 -0.000 -11.314) 25.717 1.615 ( 27.442 -0.000 2.215) 27.531 1.675 ( 18.556 -0.000 0.095) 18.557 2.352 ( 1.543 -0.000 -4.356) 4.622 2.667 ( 8.976 -0.000 -3.371) 9.588 2.716 ( 6.936 -0.000 13.062) 14.790 2.777 ( -0.279 0.000 -0.474) 0.550 2.970 ( -2.788 0.000 1.644) 3.236 3.061 ( -5.150 0.000 -7.841) 9.381 3.487 ( -4.987 0.000 -3.466) 6.073 3.731 ( -6.493 0.000 7.102) 9.623 3.733 ( 2.565 -0.000 7.226) 7.668 3.932 ( -1.393 0.000 6.638) 6.783 4.118 ( -2.394 0.000 -2.697) 3.607 4.135 ( -5.808 0.000 -0.107) 5.808 4.363 ( 0.091 -0.000 -3.958) 3.959 4.523 ( -4.826 0.000 -2.413) 5.395 4.599 ( -1.549 0.000 7.592) 7.748 4.790 ( 0.325 -0.000 -4.518) 4.529 5.205 ( 3.152 -0.000 3.336) 4.589 5.263 ( 0.763 -0.000 -7.212) 7.252 5.611 ( -2.202 0.000 -1.241) 2.528 5.726 ( -5.440 0.000 24.053) 24.660 5.776 ( 1.557 -0.000 -5.288) 5.512 5.852 ( -2.004 0.000 -12.842) 12.998 6.074 ( 0.689 -0.000 0.400) 0.796 6.650 ( -4.519 0.000 -0.691) 4.571 6.758 ( -6.146 0.000 0.922) 6.215 7.273 ( -1.352 0.000 -0.305) 1.386 7.512 ( -0.155 0.000 -0.442) 0.469 8.474 ( 1.777 -0.000 8.728) 8.907 8.728 ( -0.446 0.000 -2.527) 2.566 9.060 ( -1.765 0.000 -0.296) 1.790 9.183 ( 4.699 -0.000 -0.516) 4.727 9.313 ( 2.324 -0.000 -8.743) 9.046 9.358 ( -3.180 0.000 -2.397) 3.982 9.524 ( -4.123 0.000 -2.288) 4.715 10.032 ( -0.522 0.000 -1.227) 1.333 10.532 ( -2.762 0.000 -0.690) 2.847 10.677 ( 1.465 -0.000 8.089) 8.221 10.719 ( -0.678 0.000 -10.001) 10.024 10.817 ( 0.607 -0.000 20.865) 20.874 11.132 ( 5.737 -0.000 -1.937) 6.055 11.392 ( 3.076 -0.000 -6.378) 7.081 11.733 ( 0.556 -0.000 1.509) 1.608 12.681 ( 2.434 -0.000 0.493) 2.483 12.708 ( 0.037 -0.000 4.210) 4.210 12.886 ( -7.732 0.000 -0.587) 7.754 12.889 ( -2.430 0.000 -7.907) 8.272 13.894 ( 18.394 -0.000 5.981) 19.342 15.299 ( -2.126 0.000 -0.853) 2.291 15.842 ( -2.861 0.000 -0.151) 2.865 16.716 ( -1.788 0.000 -14.096) 14.209 ======================= Grid point 11 (7/160) ======================= q-point: ( 0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( 20.463 2.921 -7.898) 22.128 1.255 ( 19.593 -9.802 -9.682) 23.952 1.719 ( 4.525 -3.127 8.713) 10.304 2.312 ( 29.163 -2.190 -3.611) 29.467 2.383 ( 3.973 0.120 1.476) 4.240 2.718 ( -5.803 0.958 -6.290) 8.612 2.800 ( 6.088 4.259 5.667) 9.344 2.842 ( 10.451 1.404 -4.043) 11.294 2.887 ( -4.041 4.164 -1.732) 6.055 3.025 ( -1.379 -5.489 -4.442) 7.194 3.411 ( -2.426 1.534 -1.902) 3.444 3.607 ( -8.040 -2.247 5.710) 10.115 3.755 ( -0.769 1.349 4.603) 4.858 3.902 ( -5.455 3.983 4.314) 8.014 3.973 ( -1.630 4.031 2.964) 5.263 4.066 ( -4.920 -1.088 -0.677) 5.084 4.389 ( -1.766 -6.638 -1.121) 6.960 4.465 ( -4.345 -3.620 -3.751) 6.786 4.606 ( 1.169 -0.777 7.543) 7.672 4.814 ( 1.787 0.199 -2.554) 3.123 5.235 ( 0.498 0.788 3.659) 3.776 5.265 ( 0.075 0.543 -2.648) 2.705 5.535 ( -5.385 8.252 4.015) 10.640 5.629 ( -2.858 -2.206 0.216) 3.617 5.794 ( 0.538 0.410 -3.262) 3.332 5.831 ( -0.351 0.033 -2.214) 2.242 6.078 ( -0.249 0.010 -0.208) 0.324 6.584 ( -3.200 -0.290 -0.938) 3.347 6.652 ( -6.018 -0.201 0.580) 6.049 7.247 ( -1.585 0.079 -0.089) 1.589 7.505 ( -0.545 0.130 -0.832) 1.003 8.513 ( 2.402 0.061 4.679) 5.260 8.705 ( -0.858 2.098 -0.495) 2.320 9.023 ( -2.483 -0.705 -0.851) 2.717 9.242 ( -1.025 -0.370 1.276) 1.678 9.306 ( 1.757 1.489 -2.036) 3.074 9.358 ( 1.321 -1.901 -6.063) 6.490 9.480 ( -1.565 0.055 -4.119) 4.406 10.053 ( 1.155 -3.566 -1.222) 3.943 10.464 ( -3.407 2.487 0.011) 4.218 10.691 ( 0.914 0.274 3.106) 3.250 10.722 ( -0.778 -2.185 -6.837) 7.220 10.824 ( 0.322 0.564 16.969) 16.982 11.229 ( 6.372 1.964 -1.212) 6.777 11.447 ( 1.360 -3.275 -5.349) 6.418 11.713 ( -2.419 1.442 0.780) 2.922 12.695 ( -0.917 6.314 0.319) 6.388 12.735 ( 2.616 -1.112 0.081) 2.843 12.796 ( 0.290 -0.992 2.466) 2.673 12.919 ( 0.652 -8.469 -4.948) 9.830 14.178 ( 13.996 -0.291 4.207) 14.618 15.267 ( -1.684 -0.306 -0.420) 1.762 15.791 ( -2.950 -0.111 -0.196) 2.959 16.614 ( -4.549 6.982 -7.362) 11.119 ======================= Grid point 12 (8/160) ======================= q-point: ( 0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( 12.653 1.356 -8.332) 15.211 1.633 ( 13.827 -8.900 -10.746) 19.644 1.863 ( 8.952 -2.042 11.031) 14.352 2.399 ( 2.069 1.476 6.311) 6.803 2.537 ( -12.089 1.029 -8.624) 14.886 2.607 ( 0.736 0.468 -1.781) 1.983 2.762 ( -2.609 6.054 3.104) 7.287 2.930 ( 8.551 -1.142 -0.933) 8.678 2.987 ( 4.168 0.330 -2.686) 4.969 3.069 ( 0.347 -4.486 -1.709) 4.813 3.389 ( 3.243 3.920 -1.328) 5.258 3.548 ( -0.917 -2.141 2.055) 3.106 3.672 ( -4.176 4.045 0.414) 5.828 3.745 ( -1.417 7.349 2.300) 7.830 3.994 ( -1.598 -1.138 -1.524) 2.484 4.047 ( 1.833 -6.605 6.654) 9.553 4.391 ( -3.940 0.526 -4.296) 5.853 4.443 ( -5.747 -13.354 0.442) 14.545 4.633 ( 0.736 -0.384 4.388) 4.466 4.829 ( 1.448 2.533 0.408) 2.946 5.211 ( -1.460 2.467 3.488) 4.515 5.255 ( -1.162 0.246 1.130) 1.639 5.346 ( -3.377 9.776 -2.538) 10.649 5.642 ( 0.244 -2.862 -3.450) 4.489 5.789 ( -0.180 1.043 -0.286) 1.096 5.829 ( -0.102 -0.140 0.066) 0.185 6.069 ( -0.636 -0.156 0.326) 0.732 6.551 ( -0.991 0.541 0.137) 1.138 6.580 ( -2.095 -0.714 -1.143) 2.491 7.223 ( -1.099 -0.182 0.147) 1.124 7.493 ( -1.004 -0.397 -1.051) 1.507 8.547 ( 1.924 1.024 2.529) 3.339 8.666 ( -1.079 2.154 1.022) 2.617 9.003 ( -0.732 -1.272 -0.360) 1.511 9.209 ( -1.766 -0.868 1.408) 2.420 9.337 ( 1.875 1.719 -1.918) 3.185 9.388 ( 0.284 -1.571 -2.529) 2.990 9.458 ( -1.289 -0.557 -4.460) 4.676 10.128 ( 2.245 -4.947 -0.891) 5.504 10.382 ( -3.281 2.171 0.201) 3.939 10.705 ( -0.116 -1.146 2.298) 2.570 10.725 ( -0.985 -1.940 -7.756) 8.056 10.826 ( 0.183 0.528 14.491) 14.502 11.291 ( 3.736 3.603 -1.595) 5.429 11.497 ( 0.617 -3.954 -3.319) 5.199 11.642 ( -3.741 0.896 0.681) 3.907 12.599 ( -5.717 -0.452 -0.236) 5.740 12.784 ( -0.230 0.218 -0.733) 0.799 12.809 ( 2.014 -1.060 -0.534) 2.337 13.107 ( 16.417 2.635 0.533) 16.635 14.348 ( 5.281 -0.275 1.676) 5.548 15.250 ( -0.742 -0.427 0.234) 0.887 15.754 ( -1.224 -0.039 -0.043) 1.226 16.447 ( -8.616 3.515 -3.546) 9.958 ======================= Grid point 13 (9/160) ======================= q-point: (-0.56 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.467 ( -0.805 3.585 -5.708) 6.788 1.871 ( 7.386 -2.518 -11.960) 14.281 1.979 ( 1.565 6.886 10.044) 12.278 2.323 ( -7.887 -1.390 -5.385) 9.651 2.449 ( 1.260 -2.037 6.956) 7.357 2.556 ( -3.710 -2.967 -0.781) 4.814 2.679 ( -1.031 4.331 4.925) 6.639 2.915 ( -9.706 -2.262 2.190) 10.203 2.963 ( -7.871 -2.179 2.192) 8.456 3.161 ( 7.196 -0.973 -1.373) 7.390 3.421 ( 3.868 5.387 -2.293) 7.017 3.574 ( 1.737 2.647 0.454) 3.199 3.635 ( 3.634 2.066 -0.927) 4.282 3.697 ( 2.578 4.172 -1.223) 5.054 3.991 ( -0.561 -2.579 -1.413) 2.993 4.142 ( -2.542 -4.804 2.194) 5.861 4.277 ( -6.029 -2.697 -4.993) 8.280 4.525 ( -0.330 -12.266 1.531) 12.366 4.632 ( -1.518 -0.581 0.598) 1.732 4.832 ( 3.330 2.670 5.255) 6.770 5.142 ( -1.298 5.088 4.366) 6.829 5.216 ( -1.941 -0.334 2.499) 3.182 5.294 ( 3.424 4.572 -12.255) 13.521 5.673 ( 0.314 -2.150 -1.873) 2.869 5.769 ( -0.983 0.958 2.812) 3.129 5.830 ( 0.107 -0.116 0.099) 0.187 6.067 ( 0.125 -0.304 1.543) 1.577 6.541 ( 0.983 0.065 -0.455) 1.085 6.601 ( 3.473 0.318 -0.844) 3.588 7.216 ( -0.150 -0.592 0.248) 0.659 7.480 ( -1.317 -1.142 -1.145) 2.086 8.558 ( 1.175 1.812 0.887) 2.334 8.633 ( -1.116 0.936 2.050) 2.515 9.022 ( 1.470 -0.739 0.481) 1.714 9.207 ( 0.216 -1.272 0.152) 1.299 9.325 ( -1.001 1.639 -1.812) 2.640 9.399 ( -0.926 -1.601 0.081) 1.851 9.449 ( -0.733 -1.296 -1.868) 2.388 10.201 ( 1.406 -2.573 -0.451) 2.967 10.320 ( -2.461 0.144 0.164) 2.471 10.698 ( -2.625 -1.834 3.758) 4.937 10.729 ( -0.475 -1.770 -10.978) 11.130 10.825 ( -0.018 0.598 13.054) 13.068 11.284 ( -0.104 3.410 -2.099) 4.006 11.538 ( -0.322 -3.620 -2.299) 4.300 11.594 ( -1.112 0.120 1.231) 1.663 12.527 ( -4.102 -2.379 0.618) 4.782 12.765 ( -1.036 -0.265 -2.296) 2.533 12.851 ( 2.224 0.908 0.086) 2.404 13.362 ( 21.405 13.294 1.630) 25.250 14.355 ( -4.438 0.027 -1.109) 4.574 15.252 ( 0.439 -0.620 0.866) 1.152 15.757 ( 1.616 0.109 0.221) 1.634 16.266 ( -13.041 -4.466 -0.650) 13.800 ======================= Grid point 14 (10/160) ======================= q-point: (-0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.313 ( -8.655 9.055 -4.430) 13.286 1.706 ( -14.830 12.988 1.094) 19.744 1.968 ( 2.207 4.608 -8.359) 9.796 2.222 ( -8.085 -2.269 0.204) 8.400 2.420 ( -9.954 -1.647 7.426) 12.528 2.610 ( 0.904 -4.500 4.041) 6.115 2.693 ( 3.326 -1.964 6.720) 7.751 2.769 ( -11.446 0.991 6.940) 13.422 2.802 ( -4.151 -1.152 -2.579) 5.021 3.259 ( 3.146 4.841 -1.218) 5.900 3.423 ( 3.431 2.285 0.583) 4.163 3.577 ( 1.073 -2.361 0.750) 2.700 3.662 ( 1.079 0.075 -0.808) 1.350 3.763 ( 6.498 2.865 -6.607) 9.700 3.985 ( -2.716 0.492 -4.271) 5.086 4.068 ( -1.871 -3.539 -2.944) 4.969 4.312 ( 0.132 -6.790 2.009) 7.082 4.594 ( -3.382 -0.455 -1.370) 3.677 4.603 ( -0.736 -4.868 0.399) 4.939 4.939 ( 6.531 -5.382 8.750) 12.173 5.088 ( -0.160 4.408 2.614) 5.127 5.209 ( -0.096 -1.463 -0.421) 1.525 5.328 ( 4.917 2.342 -16.491) 17.367 5.688 ( -0.097 -0.248 0.343) 0.434 5.742 ( -1.717 -0.440 5.776) 6.042 5.835 ( 0.347 -0.071 -0.204) 0.409 6.073 ( -0.013 -0.302 2.449) 2.467 6.592 ( 5.053 0.053 -1.405) 5.245 6.676 ( 6.016 1.001 0.013) 6.099 7.229 ( 0.709 -0.902 0.241) 1.172 7.472 ( -1.249 -1.724 -1.144) 2.417 8.552 ( 0.223 2.486 0.546) 2.555 8.613 ( -1.171 -1.177 1.067) 1.974 9.053 ( 1.409 -0.154 0.937) 1.699 9.233 ( -0.032 -1.557 -1.326) 2.045 9.285 ( -1.049 1.702 -1.648) 2.592 9.390 ( -1.679 -2.083 0.471) 2.716 9.454 ( -0.192 -1.426 3.464) 3.751 10.209 ( -0.092 2.454 -0.374) 2.484 10.314 ( -0.070 -3.423 0.292) 3.436 10.659 ( -3.925 -1.979 3.110) 5.384 10.737 ( -0.453 -1.904 -12.658) 12.809 10.819 ( -0.221 0.887 12.519) 12.552 11.235 ( -1.821 2.881 -1.919) 3.911 11.529 ( -4.167 -2.122 -1.973) 5.075 11.623 ( 3.814 -1.182 1.505) 4.267 12.520 ( 1.177 -1.703 1.273) 2.430 12.760 ( -0.168 -0.737 -2.244) 2.368 12.864 ( 1.887 3.426 0.261) 3.920 13.533 ( 16.751 19.478 1.783) 25.752 14.212 ( -10.743 1.891 -3.500) 11.456 15.279 ( 1.950 -0.589 1.335) 2.436 15.800 ( 3.295 0.251 0.286) 3.317 16.102 ( -16.830 -14.158 2.214) 22.104 ======================= Grid point 15 (11/160) ======================= q-point: (-0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.036 ( -9.984 14.133 -5.436) 18.137 1.278 ( -19.377 14.377 -0.747) 24.140 1.887 ( -2.458 9.519 -3.946) 10.594 2.084 ( -22.602 14.491 9.430) 28.457 2.129 ( -9.194 -8.713 -2.040) 12.830 2.513 ( -8.413 1.025 8.705) 12.149 2.613 ( -5.845 -3.230 2.909) 7.284 2.775 ( 0.982 -0.086 -3.175) 3.325 2.889 ( 7.107 -2.242 3.714) 8.326 3.215 ( 0.501 5.634 2.542) 6.201 3.460 ( 1.418 -0.375 2.256) 2.691 3.640 ( -1.656 -5.217 -4.755) 7.251 3.716 ( 3.588 -3.022 -7.683) 9.002 3.820 ( 2.684 -3.993 -0.770) 4.872 4.019 ( 7.564 0.893 -3.878) 8.547 4.122 ( 3.659 -2.740 0.369) 4.586 4.371 ( 0.023 -4.914 2.405) 5.471 4.544 ( -2.125 -0.201 -1.173) 2.436 4.624 ( 0.006 -1.449 -0.590) 1.564 5.038 ( -1.002 4.336 2.166) 4.949 5.075 ( 0.715 -6.749 11.087) 12.999 5.230 ( 0.979 -1.025 -1.454) 2.030 5.412 ( 5.709 -1.418 -23.864) 24.579 5.672 ( -0.827 1.384 3.338) 3.707 5.732 ( -1.527 -2.818 7.983) 8.602 5.842 ( 0.472 0.149 -0.373) 0.620 6.069 ( -0.808 -0.256 2.632) 2.765 6.701 ( 7.803 0.640 -1.924) 8.062 6.776 ( 6.629 1.091 0.318) 6.726 7.254 ( 0.974 -0.989 0.236) 1.408 7.473 ( -0.736 -1.994 -0.957) 2.331 8.514 ( -1.549 2.672 -0.580) 3.142 8.619 ( -0.568 -2.772 0.023) 2.830 9.070 ( -0.412 -1.185 0.303) 1.291 9.191 ( -5.598 -1.698 1.178) 5.968 9.249 ( -3.497 0.270 -2.075) 4.075 9.402 ( 1.052 0.608 -0.781) 1.445 9.493 ( 3.897 -2.042 6.640) 7.965 10.181 ( 1.875 5.593 -0.433) 5.915 10.368 ( 1.390 -5.191 0.320) 5.384 10.616 ( -3.531 -2.369 2.777) 5.079 10.744 ( -0.846 -2.180 -13.805) 14.002 10.807 ( -0.054 1.335 11.313) 11.392 11.171 ( -2.221 3.154 -1.219) 4.046 11.455 ( -5.713 -0.757 -1.998) 6.099 11.734 ( 7.854 -1.534 1.598) 8.160 12.601 ( 7.071 -0.090 1.681) 7.269 12.770 ( 0.347 -0.995 -2.056) 2.310 12.854 ( 2.538 5.584 0.555) 6.158 13.548 ( 6.791 17.370 1.406) 18.703 13.973 ( -12.217 6.542 -4.827) 14.675 15.324 ( 2.953 0.451 1.328) 3.269 15.832 ( -3.114 -2.761 1.047) 4.291 15.986 ( -14.846 -19.135 4.870) 24.703 ======================= Grid point 16 (12/160) ======================= q-point: (-0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.709 ( -13.651 14.575 -5.687) 20.763 0.808 ( -13.564 19.956 -4.086) 24.473 1.436 ( -23.700 30.201 11.617) 40.109 1.773 ( -1.453 8.826 -3.053) 9.452 2.069 ( -10.725 -12.361 -5.593) 17.295 2.418 ( -3.242 1.040 7.071) 7.848 2.535 ( -4.749 -1.404 -0.788) 5.014 2.771 ( -1.060 0.673 -3.188) 3.427 2.978 ( 2.240 0.897 1.640) 2.918 3.191 ( 1.353 2.621 4.866) 5.690 3.510 ( 2.245 -3.780 3.773) 5.794 3.627 ( -3.835 -3.510 -7.080) 8.783 3.755 ( -0.977 -2.728 -6.490) 7.108 3.990 ( 8.962 -5.636 2.206) 10.814 4.112 ( 2.629 -1.128 -2.629) 3.885 4.276 ( 11.587 -1.440 -0.119) 11.676 4.408 ( 0.494 -2.135 1.515) 2.664 4.553 ( 2.450 -1.868 -1.050) 3.254 4.632 ( -0.327 -0.682 -0.479) 0.895 4.970 ( -2.586 3.071 0.279) 4.024 5.074 ( -6.834 -3.292 10.702) 13.118 5.263 ( 2.480 0.235 4.786) 5.396 5.513 ( 3.123 -2.989 -31.954) 32.246 5.646 ( -1.557 -0.331 6.368) 6.564 5.741 ( -1.517 -3.559 9.546) 10.300 5.845 ( 0.315 0.650 -0.136) 0.735 6.057 ( -0.728 -0.154 2.120) 2.247 6.824 ( 6.069 0.142 -1.509) 6.256 6.877 ( 7.716 1.970 -0.068) 7.964 7.277 ( 0.615 -0.890 0.192) 1.099 7.484 ( -0.184 -1.888 -0.529) 1.969 8.453 ( -2.819 2.108 -3.951) 5.292 8.641 ( -0.361 -3.227 0.604) 3.303 9.020 ( -10.692 -5.955 1.787) 12.368 9.128 ( -1.324 0.710 0.774) 1.689 9.188 ( -1.491 1.502 -1.280) 2.473 9.394 ( -0.609 0.903 2.027) 2.301 9.606 ( 5.668 -1.709 2.722) 6.516 10.165 ( 3.359 7.497 -0.547) 8.233 10.461 ( 2.661 -6.581 0.516) 7.117 10.590 ( -2.524 -2.850 2.845) 4.752 10.742 ( -1.380 -1.808 -9.888) 10.146 10.798 ( 0.387 1.554 5.141) 5.384 11.104 ( -1.682 3.462 -0.391) 3.869 11.366 ( -4.551 0.134 -1.550) 4.810 11.923 ( 12.646 -1.605 0.697) 12.767 12.705 ( 3.629 2.768 0.428) 4.585 12.788 ( -0.633 -1.739 0.607) 1.948 12.900 ( 14.721 7.768 -0.761) 16.662 13.473 ( 0.981 8.744 0.427) 8.809 13.685 ( -11.297 10.573 -4.496) 16.113 15.358 ( 1.954 1.503 0.550) 2.525 15.690 ( -25.778 -17.747 7.402) 32.160 15.978 ( -2.943 -6.193 2.867) 7.432 ======================= Grid point 17 (13/160) ======================= q-point: (-0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.335 ( -0.000 16.601 -0.000) 16.601 0.502 ( -0.000 25.698 -0.000) 25.698 0.825 ( -0.000 41.554 -0.000) 41.554 1.690 ( -0.000 6.138 -0.000) 6.138 2.017 ( 0.000 -6.498 0.000) 6.498 2.365 ( -0.000 2.709 -0.000) 2.709 2.510 ( 0.000 -1.416 0.000) 1.416 2.747 ( -0.000 0.800 -0.000) 0.800 2.969 ( -0.000 2.500 -0.000) 2.500 3.197 ( -0.000 0.428 -0.000) 0.428 3.582 ( 0.000 -0.587 0.000) 0.587 3.607 ( 0.000 -5.306 0.000) 5.306 3.764 ( 0.000 -1.849 0.000) 1.849 4.103 ( 0.000 -1.492 0.000) 1.492 4.173 ( 0.000 -4.095 0.000) 4.095 4.378 ( -0.000 1.241 -0.000) 1.241 4.563 ( 0.000 -10.184 0.000) 10.184 4.622 ( 0.000 -1.049 0.000) 1.049 4.631 ( 0.000 -3.130 0.000) 3.130 4.915 ( 0.000 -0.420 0.000) 0.420 4.950 ( -0.000 5.514 -0.000) 5.514 5.305 ( 0.000 -0.992 0.000) 0.992 5.510 ( -0.000 2.729 -0.000) 2.729 5.654 ( 0.000 -2.900 0.000) 2.900 5.751 ( 0.000 -2.444 0.000) 2.444 5.839 ( -0.000 1.114 -0.000) 1.114 6.052 ( -0.000 0.009 -0.000) 0.009 6.873 ( 0.000 -0.330 0.000) 0.330 6.980 ( 0.000 -0.326 0.000) 0.326 7.290 ( 0.000 -0.652 0.000) 0.652 7.499 ( 0.000 -1.441 0.000) 1.441 8.386 ( -0.000 2.480 -0.000) 2.480 8.664 ( 0.000 -2.189 0.000) 2.189 8.930 ( 0.000 -4.502 0.000) 4.502 9.097 ( -0.000 3.077 -0.000) 3.077 9.173 ( -0.000 0.670 -0.000) 0.670 9.379 ( -0.000 0.645 -0.000) 0.645 9.680 ( 0.000 -2.022 0.000) 2.022 10.128 ( -0.000 6.970 -0.000) 6.970 10.568 ( 0.000 -7.443 0.000) 7.443 10.590 ( 0.000 -2.796 0.000) 2.796 10.736 ( 0.000 -0.595 0.000) 0.595 10.787 ( -0.000 1.906 -0.000) 1.906 11.056 ( -0.000 3.020 -0.000) 3.020 11.319 ( -0.000 0.493 -0.000) 0.493 12.133 ( 0.000 -6.610 0.000) 6.610 12.687 ( -0.000 4.251 -0.000) 4.251 12.781 ( 0.000 -0.473 0.000) 0.473 13.098 ( -0.000 6.927 -0.000) 6.927 13.421 ( 0.000 -0.065 0.000) 0.065 13.518 ( -0.000 3.960 -0.000) 3.960 15.346 ( 0.000 -0.477 0.000) 0.477 15.393 ( 0.000 -1.029 0.000) 1.029 15.976 ( 0.000 -0.385 0.000) 0.385 ======================= Grid point 20 (14/160) ======================= q-point: ( 0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( 10.392 -0.000 -13.987) 17.425 1.506 ( 19.675 -0.000 -8.391) 21.389 1.840 ( 11.544 -0.000 10.712) 15.748 2.412 ( 1.198 -0.000 5.922) 6.042 2.556 ( -12.281 0.000 -9.474) 15.511 2.602 ( 1.336 -0.000 0.422) 1.401 2.835 ( -2.521 0.000 5.728) 6.258 2.931 ( 4.229 -0.000 -1.563) 4.508 2.974 ( -0.667 0.000 -3.068) 3.140 3.018 ( 6.881 -0.000 -3.120) 7.555 3.465 ( 7.029 -0.000 -1.618) 7.213 3.499 ( -0.407 0.000 0.427) 0.590 3.720 ( -3.626 0.000 1.475) 3.914 3.873 ( -2.335 0.000 6.677) 7.073 3.951 ( 0.188 -0.000 1.698) 1.709 3.981 ( -4.239 0.000 -1.772) 4.594 4.265 ( -6.062 0.000 2.896) 6.718 4.393 ( -3.924 0.000 -3.827) 5.482 4.631 ( 0.985 -0.000 4.519) 4.625 4.861 ( 2.765 -0.000 -0.530) 2.815 5.229 ( -1.671 0.000 3.223) 3.630 5.258 ( -1.479 0.000 1.109) 1.848 5.475 ( -5.734 0.000 -0.091) 5.735 5.595 ( 0.932 -0.000 -5.807) 5.882 5.799 ( -0.295 0.000 0.400) 0.497 5.827 ( -0.071 0.000 -0.432) 0.438 6.067 ( -0.769 0.000 0.705) 1.044 6.561 ( 0.614 -0.000 -1.867) 1.965 6.569 ( -3.400 0.000 0.413) 3.425 7.221 ( -1.351 0.000 0.174) 1.362 7.488 ( -1.462 0.000 -1.469) 2.073 8.560 ( 2.659 -0.000 3.377) 4.298 8.693 ( -1.681 0.000 1.670) 2.370 8.988 ( -0.735 0.000 -0.441) 0.857 9.199 ( -2.083 0.000 1.453) 2.540 9.360 ( 1.821 -0.000 -1.977) 2.688 9.366 ( 0.684 -0.000 -6.895) 6.929 9.450 ( -2.060 0.000 -2.648) 3.355 10.070 ( 3.296 -0.000 -0.880) 3.411 10.406 ( -4.560 0.000 0.517) 4.590 10.693 ( -0.927 0.000 6.731) 6.794 10.701 ( -0.214 0.000 -12.183) 12.185 10.831 ( -0.070 0.000 16.918) 16.918 11.350 ( 5.742 -0.000 -1.074) 5.841 11.439 ( -0.193 0.000 -4.944) 4.948 11.649 ( -5.111 0.000 0.528) 5.138 12.590 ( -7.807 0.000 -0.079) 7.807 12.791 ( -1.586 0.000 -2.154) 2.675 12.793 ( 4.063 -0.000 -0.214) 4.068 13.148 ( 23.762 -0.000 1.291) 23.797 14.345 ( 5.346 -0.000 1.812) 5.644 15.245 ( -0.811 0.000 0.404) 0.906 15.754 ( -1.114 0.000 -0.013) 1.114 16.484 ( -13.271 0.000 -4.373) 13.973 ======================= Grid point 21 (15/160) ======================= q-point: ( 0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.524 ( 1.881 1.863 -10.689) 11.012 1.815 ( 14.069 -2.121 -10.595) 17.739 2.067 ( 12.856 1.890 10.043) 16.423 2.325 ( -12.587 1.423 -7.465) 14.703 2.432 ( 0.315 0.189 7.173) 7.182 2.502 ( -9.083 -2.761 0.678) 9.518 2.760 ( -3.018 3.300 4.702) 6.489 2.878 ( -10.593 -1.363 3.134) 11.131 2.910 ( -8.738 -2.336 1.764) 9.216 3.139 ( 7.665 -0.737 -2.108) 7.984 3.536 ( 5.340 5.448 -4.365) 8.789 3.600 ( 4.857 -0.964 -3.316) 5.960 3.693 ( 1.975 3.851 2.011) 4.772 3.826 ( 3.168 6.154 1.014) 6.995 3.925 ( -2.228 -1.932 -0.553) 3.000 4.031 ( 3.064 -4.585 1.608) 5.744 4.195 ( -8.448 -7.966 0.577) 11.625 4.323 ( -3.921 -4.062 -2.249) 6.077 4.626 ( -1.551 -0.059 1.250) 1.992 4.892 ( 2.141 2.199 3.226) 4.453 5.186 ( -2.890 0.445 2.946) 4.151 5.215 ( -2.749 0.128 3.800) 4.692 5.412 ( 1.765 5.105 -8.704) 10.244 5.624 ( 0.682 -2.321 -4.521) 5.128 5.784 ( -1.208 0.420 3.312) 3.550 5.828 ( 0.099 -0.068 0.045) 0.128 6.062 ( 0.062 -0.181 1.962) 1.971 6.544 ( 0.705 0.101 -0.234) 0.750 6.604 ( 4.351 0.067 -1.813) 4.714 7.206 ( -0.533 -0.348 0.319) 0.712 7.460 ( -1.963 -0.656 -1.762) 2.718 8.590 ( 1.324 1.110 0.733) 1.877 8.657 ( -1.704 1.044 4.737) 5.141 9.004 ( 1.848 -0.731 0.321) 2.013 9.185 ( 0.056 -0.751 0.857) 1.141 9.359 ( -1.212 0.365 -1.427) 1.908 9.365 ( -1.337 -0.020 -3.795) 4.024 9.418 ( -1.966 -1.616 -2.734) 3.735 10.153 ( 5.017 -1.554 -0.507) 5.277 10.324 ( -4.686 0.141 0.452) 4.710 10.669 ( -2.533 -0.831 5.145) 5.795 10.700 ( -0.241 -0.917 -12.384) 12.421 10.832 ( -0.133 0.117 16.475) 16.476 11.370 ( 0.020 5.033 -2.958) 5.838 11.464 ( -0.057 -4.340 -2.907) 5.224 11.584 ( -2.068 -0.586 1.122) 2.425 12.498 ( -3.076 -0.635 0.663) 3.210 12.763 ( -1.457 -0.030 -2.576) 2.960 12.864 ( 4.326 0.397 -0.731) 4.405 13.570 ( 27.398 6.383 2.494) 28.243 14.356 ( -3.507 0.035 -1.050) 3.661 15.238 ( -0.419 -0.571 1.329) 1.506 15.759 ( 1.717 0.065 0.286) 1.742 16.202 ( -20.128 -1.862 -2.190) 20.332 ======================= Grid point 22 (16/160) ======================= q-point: (-0.56 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.460 ( -4.934 5.404 -8.754) 11.410 1.960 ( -11.067 5.142 -3.382) 12.663 1.978 ( 0.673 6.202 -6.819) 9.242 2.252 ( -4.035 2.376 2.803) 5.458 2.371 ( -0.636 -2.522 5.767) 6.326 2.528 ( 2.121 -3.634 3.698) 5.602 2.669 ( -5.257 -0.938 9.630) 11.011 2.747 ( -12.451 -3.899 4.084) 13.671 2.771 ( 0.544 -0.794 -1.300) 1.618 3.288 ( 8.343 -0.694 -1.267) 8.467 3.514 ( 0.017 6.940 -2.228) 7.288 3.608 ( -2.540 2.543 -0.731) 3.668 3.682 ( 0.993 2.402 1.872) 3.203 3.850 ( 2.245 5.922 -3.498) 7.235 3.953 ( -1.746 -6.616 -0.079) 6.843 4.006 ( -3.232 1.234 -4.401) 5.597 4.177 ( 0.563 -6.538 -1.623) 6.760 4.409 ( 1.104 -12.689 1.788) 12.861 4.589 ( -2.619 -0.171 -1.199) 2.886 4.910 ( 2.577 1.464 5.354) 6.120 5.137 ( -2.234 0.336 3.870) 4.481 5.191 ( -0.209 -0.385 0.856) 0.961 5.413 ( 4.084 5.241 -12.988) 14.589 5.652 ( -0.120 -2.591 -2.415) 3.544 5.753 ( -1.803 0.782 5.784) 6.109 5.832 ( 0.300 -0.150 -0.063) 0.342 6.067 ( -0.034 -0.286 2.895) 2.910 6.594 ( 5.257 0.085 -0.958) 5.344 6.695 ( 6.575 0.791 -1.101) 6.714 7.211 ( 0.409 -0.826 0.291) 0.966 7.438 ( -1.792 -1.512 -1.858) 2.991 8.586 ( -0.549 0.344 -1.877) 1.986 8.620 ( -1.173 2.103 6.443) 6.879 9.037 ( -0.008 -1.335 0.712) 1.513 9.209 ( 0.166 -0.904 -1.771) 1.996 9.323 ( -1.557 2.131 -2.019) 3.323 9.334 ( -1.465 -2.840 3.011) 4.391 9.420 ( -0.358 -2.139 -1.638) 2.718 10.244 ( 2.405 1.038 -0.727) 2.718 10.264 ( -0.201 -1.575 0.361) 1.628 10.626 ( -3.676 -1.183 3.586) 5.270 10.703 ( -0.408 -1.338 -12.178) 12.259 10.831 ( -0.110 0.365 15.619) 15.624 11.306 ( -1.629 4.177 -2.925) 5.353 11.475 ( -2.929 -3.036 -2.902) 5.121 11.595 ( 1.995 -1.622 1.675) 3.069 12.505 ( 3.507 -0.096 1.249) 3.724 12.746 ( -0.846 -0.592 -2.217) 2.445 12.924 ( 4.245 2.424 -0.939) 4.978 13.851 ( 12.260 11.411 2.609) 16.950 14.280 ( 0.070 5.341 -3.303) 6.280 15.244 ( -0.685 -2.940 2.409) 3.862 15.804 ( 3.469 0.138 0.342) 3.488 15.874 ( -23.545 -8.648 -0.571) 25.090 ======================= Grid point 23 (17/160) ======================= q-point: (-0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.260 ( -10.558 8.429 -8.095) 15.750 1.591 ( -13.325 17.113 -2.375) 21.819 1.925 ( -9.077 -5.922 -6.269) 12.520 2.108 ( -5.852 7.903 2.067) 10.049 2.301 ( -5.872 6.399 10.946) 13.974 2.547 ( -4.914 -2.784 5.049) 7.576 2.567 ( -4.978 2.811 5.620) 8.016 2.744 ( 2.953 -4.795 1.317) 5.783 2.856 ( 7.360 -0.441 -0.206) 7.376 3.331 ( -1.383 6.018 -1.629) 6.386 3.469 ( -1.882 1.620 0.787) 2.605 3.549 ( -0.654 -2.319 -0.510) 2.463 3.691 ( 1.622 0.578 -1.256) 2.132 3.762 ( -2.903 -2.053 -3.823) 5.221 3.986 ( 0.330 -5.817 -3.504) 6.798 4.069 ( 5.512 -1.401 -1.097) 5.792 4.266 ( 2.559 -4.862 0.703) 5.539 4.516 ( -0.325 -4.961 1.747) 5.270 4.566 ( -0.010 -2.524 -1.997) 3.218 4.943 ( -0.623 -2.763 2.510) 3.784 5.107 ( -1.211 0.355 5.508) 5.651 5.210 ( 1.556 -0.906 -0.643) 1.912 5.440 ( 4.500 3.229 -16.887) 17.772 5.668 ( -0.959 -2.749 0.811) 3.023 5.711 ( -2.064 1.379 7.416) 7.820 5.840 ( 0.472 -0.203 -0.410) 0.657 6.062 ( -0.957 -0.423 3.044) 3.219 6.706 ( 7.532 0.079 -1.362) 7.655 6.801 ( 6.997 1.336 -0.463) 7.139 7.232 ( 0.856 -1.112 0.180) 1.415 7.431 ( -1.010 -2.088 -1.714) 2.884 8.569 ( -2.451 -0.085 3.308) 4.118 8.582 ( -0.073 1.687 -0.928) 1.927 9.016 ( -6.031 -3.914 0.019) 7.190 9.168 ( -3.612 -0.527 -0.496) 3.684 9.269 ( -2.448 1.460 -0.230) 2.860 9.402 ( 3.165 -0.369 -1.923) 3.721 9.452 ( 3.851 -2.117 5.294) 6.880 10.230 ( -1.212 -2.403 -0.751) 2.794 10.336 ( 6.333 3.515 -0.402) 7.254 10.577 ( -3.585 -1.497 2.542) 4.643 10.707 ( -0.593 -1.548 -10.859) 10.985 10.827 ( 0.033 0.813 13.292) 13.317 11.239 ( -1.649 3.800 -2.174) 4.679 11.430 ( -4.687 -1.680 -3.050) 5.839 11.683 ( 5.380 -3.425 1.918) 6.660 12.614 ( 9.443 1.079 1.402) 9.607 12.745 ( -0.309 -1.300 -1.746) 2.199 12.964 ( 5.396 5.150 -0.836) 7.506 13.759 ( -9.562 4.775 -0.151) 10.689 14.221 ( 2.243 18.392 -1.849) 18.620 15.287 ( 0.403 -6.496 3.390) 7.338 15.601 ( -20.227 -12.071 0.462) 23.560 15.869 ( 3.924 -0.317 0.187) 3.942 ======================= Grid point 24 (18/160) ======================= q-point: (-0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.931 ( -16.984 9.462 -5.216) 20.130 1.242 ( -4.240 22.554 -5.269) 23.546 1.836 ( -7.185 -3.704 -1.225) 8.176 1.918 ( -8.328 6.153 6.298) 12.119 2.056 ( -5.179 22.738 1.327) 23.358 2.446 ( -1.876 1.322 9.823) 10.087 2.516 ( -3.953 0.210 -1.691) 4.305 2.786 ( 0.059 0.191 -3.365) 3.371 2.985 ( 5.807 -0.291 2.531) 6.341 3.255 ( -1.527 3.754 2.217) 4.619 3.420 ( -2.627 -4.709 0.038) 5.393 3.561 ( -1.732 -2.757 -3.976) 5.139 3.699 ( -0.888 -2.428 -5.164) 5.775 3.877 ( 8.101 -5.875 3.704) 10.670 4.043 ( -0.861 -5.735 -2.739) 6.414 4.194 ( 4.560 -6.768 -0.219) 8.164 4.358 ( 4.217 -1.877 1.041) 4.732 4.530 ( 1.040 -0.459 -0.531) 1.255 4.610 ( 0.840 -2.139 0.183) 2.306 4.923 ( -5.095 -3.847 0.246) 6.389 5.074 ( -2.692 0.635 4.622) 5.386 5.252 ( 1.907 -1.006 0.519) 2.218 5.502 ( 5.254 0.582 -20.570) 21.238 5.655 ( -3.622 -0.117 12.700) 13.207 5.681 ( -0.343 -1.423 0.859) 1.697 5.850 ( 0.393 -0.099 -0.588) 0.714 6.050 ( -0.888 -0.550 2.169) 2.407 6.819 ( 4.897 -0.337 -0.839) 4.980 6.904 ( 6.600 1.030 -0.519) 6.700 7.257 ( 0.592 -1.155 0.084) 1.301 7.442 ( -0.219 -2.257 -1.067) 2.506 8.512 ( -1.980 3.338 1.131) 4.042 8.582 ( -0.703 -2.532 -1.312) 2.938 8.913 ( -9.739 -4.914 0.672) 10.930 9.143 ( 0.300 0.618 -0.290) 0.746 9.217 ( -1.851 1.365 0.160) 2.305 9.409 ( -0.462 0.538 0.640) 0.956 9.575 ( 5.926 -1.413 2.720) 6.672 10.254 ( 0.809 -2.433 -0.787) 2.682 10.399 ( 5.326 4.112 -0.866) 6.784 10.541 ( -2.541 -1.976 2.080) 3.832 10.709 ( -0.663 -1.516 -6.677) 6.879 10.821 ( 0.156 1.109 7.728) 7.809 11.175 ( -1.421 3.749 -1.202) 4.185 11.364 ( -3.714 -0.386 -2.228) 4.349 11.837 ( 6.888 -5.949 1.407) 9.210 12.755 ( -0.203 -1.685 -0.837) 1.892 12.758 ( 6.879 2.560 0.782) 7.382 13.058 ( 15.988 7.896 -0.660) 17.843 13.547 ( -9.867 1.630 -1.658) 10.138 13.949 ( -14.493 14.341 -0.078) 20.389 15.355 ( -3.189 -8.371 4.118) 9.859 15.418 ( -9.754 -3.588 -0.108) 10.394 15.936 ( 2.953 -0.665 0.173) 3.031 ======================= Grid point 25 (19/160) ======================= q-point: (-0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.628 ( -0.000 13.406 -0.000) 13.406 0.988 ( -0.000 24.347 -0.000) 24.347 1.572 ( -0.000 33.442 -0.000) 33.442 1.853 ( -0.000 11.550 -0.000) 11.550 1.866 ( 0.000 -8.516 0.000) 8.516 2.425 ( -0.000 3.428 -0.000) 3.428 2.475 ( 0.000 -2.103 0.000) 2.103 2.772 ( -0.000 1.462 -0.000) 1.462 3.022 ( -0.000 2.529 -0.000) 2.529 3.215 ( -0.000 1.507 -0.000) 1.507 3.475 ( 0.000 -7.886 0.000) 7.886 3.560 ( 0.000 -1.588 0.000) 1.588 3.715 ( 0.000 -2.874 0.000) 2.874 4.049 ( 0.000 -4.141 0.000) 4.141 4.060 ( 0.000 -7.278 0.000) 7.278 4.340 ( 0.000 -11.690 0.000) 11.690 4.401 ( -0.000 0.871 -0.000) 0.871 4.569 ( 0.000 -2.765 0.000) 2.765 4.626 ( -0.000 0.470 -0.000) 0.470 4.889 ( 0.000 -2.349 0.000) 2.349 5.025 ( -0.000 2.299 -0.000) 2.299 5.282 ( 0.000 -1.256 0.000) 1.256 5.569 ( -0.000 2.823 -0.000) 2.823 5.600 ( 0.000 -2.345 0.000) 2.345 5.697 ( 0.000 -2.607 0.000) 2.607 5.853 ( -0.000 0.263 -0.000) 0.263 6.048 ( 0.000 -0.472 0.000) 0.472 6.864 ( 0.000 -0.491 0.000) 0.491 6.973 ( 0.000 -0.295 0.000) 0.295 7.273 ( 0.000 -1.081 0.000) 1.081 7.463 ( 0.000 -2.195 0.000) 2.195 8.451 ( -0.000 4.026 -0.000) 4.026 8.606 ( 0.000 -3.457 0.000) 3.457 8.852 ( 0.000 -3.586 0.000) 3.586 9.140 ( -0.000 1.400 -0.000) 1.400 9.190 ( -0.000 0.944 -0.000) 0.944 9.395 ( -0.000 0.946 -0.000) 0.946 9.643 ( 0.000 -1.580 0.000) 1.580 10.266 ( -0.000 4.079 -0.000) 4.079 10.437 ( 0.000 -2.999 0.000) 2.999 10.537 ( 0.000 -2.419 0.000) 2.419 10.715 ( 0.000 -1.343 0.000) 1.343 10.813 ( -0.000 1.064 -0.000) 1.064 11.125 ( -0.000 3.809 -0.000) 3.809 11.328 ( -0.000 0.363 -0.000) 0.363 11.984 ( 0.000 -8.281 0.000) 8.281 12.765 ( 0.000 -1.233 0.000) 1.233 12.773 ( -0.000 4.210 -0.000) 4.210 13.269 ( -0.000 9.952 -0.000) 9.952 13.426 ( -0.000 0.700 -0.000) 0.700 13.614 ( -0.000 5.568 -0.000) 5.568 15.302 ( 0.000 -3.863 0.000) 3.863 15.395 ( -0.000 1.058 -0.000) 1.058 15.968 ( 0.000 -0.480 0.000) 0.480 ======================= Grid point 30 (20/160) ======================= q-point: (-0.67 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.512 ( -4.113 0.000 -9.768) 10.598 1.939 ( -2.823 0.000 -9.767) 10.167 2.199 ( 1.347 -0.000 -4.440) 4.640 2.201 ( -11.164 0.000 5.006) 12.235 2.347 ( 6.201 -0.000 5.159) 8.066 2.486 ( 3.766 -0.000 3.865) 5.397 2.662 ( -16.063 0.000 5.815) 17.083 2.686 ( -9.610 0.000 8.147) 12.598 2.768 ( 2.189 -0.000 -0.268) 2.206 3.279 ( 8.850 -0.000 -1.056) 8.913 3.601 ( -2.794 0.000 -3.593) 4.552 3.639 ( 2.645 -0.000 -2.522) 3.654 3.736 ( -1.593 0.000 -0.125) 1.598 3.811 ( -2.663 0.000 0.175) 2.669 3.985 ( -9.600 0.000 5.914) 11.275 4.055 ( 10.898 -0.000 -2.534) 11.189 4.070 ( -1.004 0.000 -4.442) 4.554 4.235 ( 1.046 -0.000 -1.884) 2.155 4.588 ( -2.571 0.000 -0.807) 2.695 4.933 ( 1.328 -0.000 5.267) 5.432 5.134 ( -3.130 0.000 1.562) 3.498 5.189 ( -0.446 0.000 2.015) 2.063 5.478 ( 2.995 -0.000 -8.896) 9.387 5.616 ( -0.213 0.000 -4.717) 4.721 5.761 ( -1.694 0.000 5.627) 5.877 5.830 ( 0.262 -0.000 0.007) 0.262 6.064 ( -0.029 0.000 2.898) 2.898 6.595 ( 5.273 -0.000 -0.699) 5.319 6.703 ( 6.885 -0.000 -1.591) 7.066 7.202 ( 0.318 -0.000 0.280) 0.424 7.422 ( -1.937 0.000 -2.061) 2.828 8.588 ( -2.075 0.000 -1.755) 2.718 8.647 ( -0.324 0.000 7.700) 7.706 9.020 ( -1.030 0.000 0.476) 1.135 9.199 ( 0.366 -0.000 -2.079) 2.111 9.304 ( -0.500 0.000 3.720) 3.754 9.358 ( -3.066 0.000 -0.300) 3.081 9.384 ( 0.995 -0.000 -4.996) 5.095 10.241 ( -4.672 0.000 0.254) 4.678 10.261 ( 8.049 -0.000 -0.621) 8.073 10.615 ( -3.419 0.000 3.508) 4.898 10.690 ( -0.227 0.000 -11.728) 11.730 10.834 ( 0.007 -0.000 16.193) 16.193 11.371 ( -2.508 0.000 -3.660) 4.437 11.424 ( -1.757 0.000 -2.432) 3.000 11.576 ( 1.252 -0.000 1.558) 1.998 12.506 ( 4.248 -0.000 1.226) 4.422 12.740 ( -1.158 0.000 -2.251) 2.532 12.948 ( 5.171 -0.000 -1.401) 5.358 13.953 ( 4.513 -0.000 2.552) 5.184 14.359 ( 12.367 -0.000 -2.709) 12.660 15.201 ( -5.215 0.000 2.970) 6.001 15.788 ( -24.901 0.000 -1.811) 24.967 15.806 ( 3.455 -0.000 0.369) 3.474 ======================= Grid point 32 (21/160) ======================= q-point: (-0.56 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( -11.752 2.759 -7.655) 14.294 1.796 ( -9.926 -0.233 -4.840) 11.046 1.916 ( -12.578 7.437 -3.001) 14.917 2.254 ( -2.084 7.347 0.793) 7.678 2.362 ( -3.283 -0.466 8.177) 8.823 2.500 ( -2.154 -1.653 4.380) 5.153 2.558 ( 0.686 -5.355 4.567) 7.071 2.641 ( 3.379 -1.669 4.439) 5.823 2.858 ( 7.959 0.181 -1.785) 8.158 3.392 ( 1.023 0.543 -2.820) 3.048 3.534 ( -0.755 0.816 1.366) 1.761 3.579 ( -6.015 7.195 -2.765) 9.777 3.704 ( 0.680 -0.129 0.651) 0.950 3.782 ( -8.275 3.443 2.512) 9.308 3.836 ( -1.509 -7.340 -2.317) 7.844 4.021 ( -3.071 -3.800 -2.251) 5.379 4.229 ( 8.955 1.274 -2.918) 9.504 4.371 ( 6.523 -6.910 0.982) 9.553 4.552 ( -1.374 -0.077 -1.250) 1.859 4.932 ( -1.530 0.460 2.819) 3.240 5.094 ( -1.966 -0.871 1.011) 2.376 5.198 ( 1.324 -0.326 0.898) 1.633 5.506 ( 2.385 2.859 -9.350) 10.064 5.614 ( -1.435 -2.440 -1.993) 3.461 5.732 ( -1.456 0.598 5.722) 5.935 5.837 ( 0.390 -0.134 -0.106) 0.426 6.055 ( -1.112 -0.205 2.949) 3.158 6.707 ( 7.297 0.021 -0.853) 7.347 6.821 ( 7.007 0.586 -1.002) 7.102 7.216 ( 0.853 -0.506 0.130) 1.000 7.400 ( -1.010 -0.907 -2.046) 2.456 8.547 ( -2.681 -0.693 0.016) 2.770 8.633 ( -0.488 1.749 4.417) 4.776 8.951 ( -7.852 -2.075 -0.186) 8.124 9.163 ( -2.126 -0.094 -1.207) 2.447 9.296 ( -2.979 1.038 1.837) 3.651 9.397 ( 4.567 0.119 -1.247) 4.735 9.414 ( 4.777 -1.616 1.798) 5.354 10.180 ( -3.254 -1.603 -0.241) 3.636 10.403 ( 9.332 2.094 -1.050) 9.622 10.559 ( -3.443 -0.426 1.903) 3.957 10.686 ( -0.314 -0.553 -9.640) 9.661 10.839 ( 0.541 0.405 13.907) 13.924 11.313 ( -1.764 3.622 -2.632) 4.812 11.389 ( -3.853 -2.534 -2.944) 5.472 11.625 ( 3.391 -1.919 1.792) 4.288 12.632 ( 10.346 0.572 1.151) 10.426 12.726 ( -0.689 -0.578 -1.684) 1.909 13.037 ( 6.936 2.070 -1.587) 7.411 13.802 ( -14.298 0.685 -0.735) 14.334 14.599 ( 10.103 18.453 0.013) 21.037 15.038 ( -15.451 -16.052 3.931) 22.625 15.495 ( -8.964 -1.260 -1.736) 9.217 15.868 ( 3.814 0.023 0.191) 3.819 ======================= Grid point 33 (22/160) ======================= q-point: (-0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.075 ( -15.795 5.320 -4.418) 17.243 1.632 ( -2.608 15.409 -5.129) 16.448 1.710 ( -7.505 -4.184 -2.216) 8.874 2.057 ( -7.871 5.755 5.852) 11.372 2.370 ( 3.687 6.032 6.685) 9.730 2.469 ( -1.013 2.443 1.993) 3.312 2.579 ( -1.361 5.483 0.559) 5.677 2.733 ( 1.447 -5.865 0.084) 6.042 2.990 ( 7.661 1.240 0.862) 7.808 3.307 ( -4.853 0.129 -1.412) 5.056 3.390 ( -7.967 3.743 -2.457) 9.139 3.544 ( -0.116 1.225 0.088) 1.234 3.685 ( -1.023 1.254 -2.052) 2.613 3.772 ( 5.211 -4.508 4.292) 8.118 3.903 ( -0.924 -8.259 -3.241) 8.920 4.042 ( -1.545 -8.196 0.278) 8.345 4.344 ( 5.808 0.286 -1.785) 6.083 4.521 ( 4.041 -1.648 1.549) 4.631 4.551 ( 1.546 -2.404 -0.355) 2.880 4.875 ( -5.134 -1.277 -0.438) 5.308 5.074 ( -1.622 -0.353 1.079) 1.980 5.233 ( 1.778 -0.777 0.584) 2.027 5.521 ( 2.706 1.377 -10.981) 11.393 5.609 ( -2.339 -2.732 4.226) 5.549 5.703 ( -0.921 1.440 3.277) 3.695 5.845 ( 0.332 -0.285 -0.284) 0.522 6.039 ( -1.075 -0.513 2.026) 2.351 6.814 ( 4.710 -0.146 -0.525) 4.741 6.920 ( 5.171 0.547 -0.569) 5.231 7.236 ( 0.642 -0.861 0.014) 1.074 7.404 ( -0.061 -1.539 -1.395) 2.078 8.520 ( -1.751 -1.621 0.787) 2.513 8.599 ( -0.866 3.084 0.996) 3.355 8.833 ( -7.760 -3.189 0.096) 8.391 9.151 ( 0.476 0.232 -0.766) 0.931 9.239 ( -2.492 0.870 1.565) 3.069 9.413 ( 0.055 -0.028 -0.487) 0.491 9.554 ( 6.612 -0.744 2.193) 7.006 10.168 ( -1.302 -3.947 -0.446) 4.180 10.507 ( 2.199 2.231 -1.640) 3.536 10.520 ( 2.465 1.874 1.542) 3.460 10.686 ( -0.334 -0.835 -5.846) 5.915 10.847 ( 0.992 1.522 8.801) 8.986 11.245 ( -2.022 3.369 -1.731) 4.293 11.349 ( -2.733 -1.237 -2.105) 3.664 11.725 ( 4.044 -4.956 1.385) 6.545 12.726 ( -0.280 -1.212 -0.946) 1.563 12.799 ( 8.186 1.518 0.518) 8.342 13.187 ( 17.014 4.983 -1.379) 17.783 13.566 ( -11.170 0.473 -1.397) 11.267 14.203 ( -27.989 11.082 2.218) 30.184 15.142 ( 2.820 -9.788 1.565) 10.306 15.429 ( -0.749 1.061 -0.566) 1.417 15.929 ( 2.985 -0.166 0.027) 2.990 ======================= Grid point 34 (23/160) ======================= q-point: (-0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.844 ( -0.000 8.699 -0.000) 8.699 1.431 ( -0.000 20.842 -0.000) 20.842 1.708 ( 0.000 -7.267 0.000) 7.267 1.924 ( -0.000 7.604 -0.000) 7.604 2.268 ( -0.000 24.641 -0.000) 24.641 2.438 ( 0.000 -1.085 0.000) 1.085 2.495 ( -0.000 3.746 -0.000) 3.746 2.777 ( 0.000 -1.985 0.000) 1.985 3.060 ( -0.000 1.521 -0.000) 1.521 3.259 ( -0.000 3.258 -0.000) 3.258 3.324 ( 0.000 -6.960 0.000) 6.960 3.535 ( 0.000 -0.344 0.000) 0.344 3.675 ( 0.000 -0.687 0.000) 0.687 3.910 ( 0.000 -7.752 0.000) 7.752 3.947 ( 0.000 -6.291 0.000) 6.291 4.124 ( 0.000 -10.550 0.000) 10.550 4.402 ( 0.000 -0.746 0.000) 0.746 4.539 ( 0.000 -0.349 0.000) 0.349 4.623 ( 0.000 -1.038 0.000) 1.038 4.832 ( 0.000 -3.111 0.000) 3.111 5.051 ( -0.000 0.845 -0.000) 0.845 5.259 ( 0.000 -1.027 0.000) 1.027 5.568 ( 0.000 -1.013 0.000) 1.013 5.586 ( 0.000 -1.262 0.000) 1.262 5.681 ( -0.000 1.177 -0.000) 1.177 5.851 ( 0.000 -0.301 0.000) 0.301 6.035 ( 0.000 -0.701 0.000) 0.701 6.856 ( 0.000 -0.270 0.000) 0.270 6.969 ( 0.000 -0.178 0.000) 0.178 7.251 ( 0.000 -1.062 0.000) 1.062 7.421 ( 0.000 -1.933 0.000) 1.933 8.516 ( -0.000 0.257 -0.000) 0.257 8.560 ( -0.000 1.191 -0.000) 1.191 8.790 ( 0.000 -2.911 0.000) 2.911 9.157 ( -0.000 0.538 -0.000) 0.538 9.207 ( -0.000 0.732 -0.000) 0.732 9.410 ( -0.000 0.471 -0.000) 0.471 9.621 ( 0.000 -0.812 0.000) 0.812 10.206 ( 0.000 -5.682 0.000) 5.682 10.501 ( 0.000 -1.301 0.000) 1.301 10.522 ( -0.000 6.868 -0.000) 6.868 10.691 ( 0.000 -1.062 0.000) 1.062 10.839 ( -0.000 1.905 -0.000) 1.905 11.194 ( -0.000 3.160 -0.000) 3.160 11.330 ( 0.000 -0.242 0.000) 0.242 11.828 ( 0.000 -7.396 0.000) 7.396 12.736 ( 0.000 -1.536 0.000) 1.536 12.842 ( -0.000 2.847 -0.000) 2.847 13.446 ( -0.000 1.138 -0.000) 1.138 13.453 ( -0.000 8.466 -0.000) 8.466 13.717 ( -0.000 4.637 -0.000) 4.637 15.218 ( 0.000 -4.283 0.000) 4.283 15.419 ( -0.000 1.204 -0.000) 1.204 15.959 ( 0.000 -0.343 0.000) 0.343 ======================= Grid point 41 (24/160) ======================= q-point: (-0.56 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.129 ( -15.371 0.000 -3.823) 15.839 1.645 ( -6.338 0.000 -2.192) 6.707 1.819 ( -3.459 0.000 -5.952) 6.884 2.124 ( -10.383 0.000 8.126) 13.185 2.399 ( 0.220 -0.000 7.065) 7.068 2.517 ( 7.868 -0.000 -5.859) 9.809 2.589 ( 2.599 -0.000 5.435) 6.025 2.682 ( 0.928 -0.000 0.525) 1.066 3.008 ( 8.501 -0.000 -0.346) 8.508 3.299 ( -8.192 0.000 -1.245) 8.286 3.469 ( -9.307 0.000 -4.620) 10.391 3.573 ( 0.878 -0.000 1.858) 2.055 3.723 ( -0.847 0.000 5.337) 5.404 3.750 ( 2.665 -0.000 0.480) 2.708 3.761 ( -0.513 0.000 -2.668) 2.717 3.937 ( -2.755 0.000 -1.643) 3.207 4.354 ( 3.919 -0.000 -3.286) 5.115 4.479 ( 9.076 -0.000 2.359) 9.377 4.541 ( -0.022 0.000 -0.157) 0.158 4.864 ( -6.276 0.000 -0.347) 6.286 5.070 ( -0.481 0.000 -0.566) 0.743 5.225 ( 1.748 -0.000 0.894) 1.964 5.547 ( 0.897 -0.000 -4.436) 4.526 5.570 ( -1.541 0.000 -1.128) 1.909 5.717 ( -0.817 0.000 3.193) 3.296 5.842 ( 0.292 -0.000 -0.081) 0.304 6.033 ( -1.152 0.000 1.901) 2.223 6.813 ( 4.696 -0.000 -0.435) 4.716 6.925 ( 4.594 -0.000 -0.540) 4.626 7.227 ( 0.682 -0.000 0.002) 0.682 7.388 ( 0.047 -0.000 -1.497) 1.498 8.502 ( -1.895 0.000 0.421) 1.941 8.635 ( -0.397 0.000 2.191) 2.226 8.799 ( -7.274 0.000 -0.155) 7.275 9.153 ( 0.500 -0.000 -0.989) 1.108 9.248 ( -2.903 0.000 2.207) 3.647 9.412 ( 0.368 -0.000 -0.957) 1.025 9.546 ( 6.958 -0.000 1.824) 7.193 10.128 ( -1.698 0.000 -0.306) 1.725 10.506 ( -2.420 0.000 0.596) 2.492 10.562 ( 7.003 -0.000 -0.685) 7.036 10.678 ( -0.219 0.000 -5.764) 5.768 10.866 ( 2.013 -0.000 8.774) 9.002 11.294 ( -4.325 0.000 -2.348) 4.922 11.322 ( -0.517 0.000 -1.513) 1.599 11.672 ( 3.102 -0.000 1.300) 3.364 12.713 ( -0.399 0.000 -0.951) 1.031 12.814 ( 8.565 -0.000 0.437) 8.576 13.237 ( 17.534 -0.000 -1.835) 17.630 13.570 ( -11.402 0.000 -1.063) 11.451 14.325 ( -38.463 0.000 3.483) 38.621 15.033 ( 13.105 -0.000 0.080) 13.105 15.440 ( -0.512 0.000 -0.545) 0.748 15.927 ( 2.893 -0.000 0.023) 2.893 ======================= Grid point 43 (25/160) ======================= q-point: (-0.44 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.959 ( -0.000 3.099 -0.000) 3.099 1.604 ( 0.000 -2.988 0.000) 2.988 1.750 ( -0.000 10.176 -0.000) 10.176 2.016 ( -0.000 2.326 -0.000) 2.326 2.402 ( 0.000 -0.613 0.000) 0.613 2.569 ( -0.000 4.226 -0.000) 4.226 2.625 ( -0.000 8.846 -0.000) 8.846 2.680 ( 0.000 -6.844 0.000) 6.844 3.090 ( -0.000 1.436 -0.000) 1.436 3.227 ( 0.000 -2.810 0.000) 2.810 3.344 ( -0.000 4.545 -0.000) 4.545 3.557 ( -0.000 1.879 -0.000) 1.879 3.703 ( -0.000 3.465 -0.000) 3.465 3.783 ( 0.000 -4.459 0.000) 4.459 3.819 ( 0.000 -6.232 0.000) 6.232 3.945 ( 0.000 -6.736 0.000) 6.736 4.386 ( 0.000 -0.545 0.000) 0.545 4.542 ( -0.000 0.266 -0.000) 0.266 4.595 ( 0.000 -1.227 0.000) 1.227 4.785 ( 0.000 -1.437 0.000) 1.437 5.065 ( -0.000 0.474 -0.000) 0.474 5.245 ( 0.000 -0.424 0.000) 0.424 5.557 ( 0.000 -0.225 0.000) 0.225 5.558 ( 0.000 -0.976 0.000) 0.976 5.706 ( -0.000 0.834 -0.000) 0.834 5.846 ( 0.000 -0.194 0.000) 0.194 6.025 ( 0.000 -0.328 0.000) 0.328 6.854 ( 0.000 -0.035 0.000) 0.035 6.966 ( 0.000 -0.073 0.000) 0.073 7.235 ( 0.000 -0.453 0.000) 0.453 7.394 ( 0.000 -0.769 0.000) 0.769 8.490 ( 0.000 -1.018 0.000) 1.018 8.618 ( -0.000 2.483 -0.000) 2.483 8.742 ( 0.000 -1.774 0.000) 1.774 9.163 ( -0.000 0.105 -0.000) 0.105 9.216 ( -0.000 0.258 -0.000) 0.258 9.414 ( -0.000 0.071 -0.000) 0.071 9.611 ( 0.000 -0.242 0.000) 0.242 10.125 ( 0.000 -2.270 0.000) 2.270 10.485 ( 0.000 -0.381 0.000) 0.381 10.613 ( -0.000 2.236 -0.000) 2.236 10.676 ( 0.000 -0.373 0.000) 0.373 10.883 ( -0.000 1.898 -0.000) 1.898 11.242 ( -0.000 1.529 -0.000) 1.529 11.321 ( 0.000 -0.512 0.000) 0.512 11.718 ( 0.000 -3.342 0.000) 3.342 12.713 ( 0.000 -0.703 0.000) 0.703 12.880 ( -0.000 0.999 -0.000) 0.999 13.463 ( -0.000 0.553 -0.000) 0.553 13.573 ( -0.000 3.368 -0.000) 3.368 13.781 ( -0.000 1.779 -0.000) 1.779 15.154 ( 0.000 -1.919 0.000) 1.919 15.436 ( -0.000 0.497 -0.000) 0.497 15.955 ( 0.000 -0.121 0.000) 0.121 ======================= Grid point 85 (26/160) ======================= q-point: ( 0.00 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.451 ( -3.369 0.000 21.752) 22.012 0.497 ( 1.694 -0.000 24.021) 24.081 0.921 ( -7.864 0.000 35.991) 36.840 1.776 ( 3.398 -0.000 17.102) 17.437 2.210 ( -5.390 0.000 -8.272) 9.873 2.242 ( 20.304 -0.000 -1.953) 20.398 2.567 ( -4.109 0.000 -0.551) 4.146 2.778 ( 3.016 -0.000 0.794) 3.119 3.025 ( -1.405 0.000 4.587) 4.797 3.096 ( -3.476 0.000 -1.464) 3.772 3.490 ( -0.636 0.000 -4.591) 4.635 3.830 ( 3.884 -0.000 10.193) 10.908 3.856 ( 4.743 -0.000 2.346) 5.291 3.989 ( 5.155 -0.000 1.382) 5.337 4.182 ( -1.421 0.000 -2.402) 2.791 4.189 ( -3.348 0.000 5.431) 6.380 4.394 ( -3.037 0.000 2.866) 4.176 4.573 ( 0.516 -0.000 -3.765) 3.800 4.637 ( 4.806 -0.000 -3.112) 5.725 4.818 ( -4.264 0.000 -2.536) 4.961 4.931 ( -4.340 0.000 -3.029) 5.292 4.986 ( 0.793 -0.000 -11.360) 11.388 5.645 ( 3.136 -0.000 -0.439) 3.167 5.657 ( 0.564 -0.000 2.468) 2.532 5.854 ( -3.709 0.000 6.514) 7.496 6.020 ( 1.227 -0.000 -2.451) 2.741 6.738 ( -0.197 0.000 -0.976) 0.996 6.757 ( -1.087 0.000 -6.052) 6.149 7.273 ( -0.292 0.000 -2.322) 2.340 7.326 ( -4.934 0.000 5.793) 7.609 7.526 ( 7.457 -0.000 4.952) 8.952 8.583 ( 6.028 -0.000 3.897) 7.178 8.981 ( 6.708 -0.000 0.882) 6.766 9.005 ( -0.723 0.000 -2.132) 2.251 9.138 ( 3.729 -0.000 -4.089) 5.534 9.239 ( -6.569 0.000 -10.711) 12.565 9.465 ( -11.622 0.000 -0.130) 11.623 9.644 ( -0.243 0.000 -2.084) 2.098 10.086 ( 0.348 -0.000 3.312) 3.330 10.503 ( 1.083 -0.000 -1.853) 2.146 10.726 ( 3.869 -0.000 3.602) 5.286 10.749 ( -0.822 0.000 0.011) 0.822 11.020 ( 2.125 -0.000 2.489) 3.273 11.276 ( -3.805 0.000 -3.342) 5.065 11.807 ( 0.380 -0.000 7.564) 7.574 12.591 ( 3.594 -0.000 -4.405) 5.685 12.739 ( 2.303 -0.000 -3.505) 4.194 13.000 ( -1.512 0.000 -2.573) 2.984 13.027 ( -11.999 0.000 1.490) 12.091 13.153 ( 128.705 -0.000 -1.105) 128.710 13.475 ( 11.409 -0.000 4.633) 12.314 14.273 (-136.236 0.000 -8.258) 136.486 15.443 ( -3.983 0.000 8.173) 9.092 15.900 ( -0.049 0.000 0.358) 0.361 ======================= Grid point 86 (27/160) ======================= q-point: ( 0.11 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.618 ( 11.472 -14.327 11.669) 21.749 0.738 ( 12.477 -9.648 21.248) 26.462 1.152 ( 26.828 -8.426 22.585) 36.067 1.810 ( 1.921 -1.849 16.423) 16.638 2.155 ( -0.263 0.214 -10.008) 10.014 2.502 ( 7.235 8.754 -4.187) 12.104 2.596 ( 10.222 3.050 -6.297) 12.387 2.804 ( -0.819 -0.571 -1.990) 2.226 3.022 ( 0.216 -0.071 2.007) 2.020 3.051 ( -2.463 -1.789 2.078) 3.686 3.475 ( -0.707 1.005 -3.052) 3.290 3.836 ( -0.112 4.600 9.772) 10.801 3.943 ( 2.618 -0.754 2.520) 3.711 4.015 ( 1.117 5.038 3.202) 6.073 4.127 ( -3.926 -1.788 2.913) 5.206 4.180 ( -4.135 -5.192 -3.734) 7.616 4.350 ( -2.001 -1.813 0.668) 2.782 4.564 ( -2.729 0.356 -2.680) 3.841 4.661 ( -1.582 2.509 -1.844) 3.493 4.718 ( -1.121 -3.337 -1.969) 4.033 4.988 ( 6.774 2.178 -4.914) 8.648 5.066 ( 6.034 -3.969 -11.152) 13.287 5.650 ( 0.706 3.887 1.588) 4.258 5.699 ( 2.079 -0.627 0.123) 2.175 5.782 ( -5.011 -1.547 4.210) 6.725 6.035 ( 0.650 0.343 -2.418) 2.528 6.598 ( -8.422 10.911 6.421) 15.206 6.755 ( -4.521 -4.816 -3.901) 7.671 7.066 ( -19.955 2.210 22.520) 30.170 7.262 ( -1.004 0.094 -2.234) 2.451 7.507 ( -2.156 2.519 1.760) 3.754 8.657 ( 3.509 2.368 0.864) 4.320 8.944 ( -7.118 9.915 9.046) 15.192 9.032 ( -3.883 -0.022 -6.083) 7.217 9.110 ( 2.723 2.272 -1.487) 3.845 9.212 ( 1.635 1.243 1.436) 2.506 9.235 ( -2.228 -2.285 -2.753) 4.215 9.583 ( -7.033 0.014 -1.858) 7.274 10.078 ( -2.972 -3.325 3.006) 5.378 10.482 ( -0.937 5.248 -0.940) 5.414 10.646 ( -3.529 5.460 -0.678) 6.537 10.801 ( 2.504 0.295 4.193) 4.893 11.067 ( 3.311 -0.972 2.394) 4.200 11.216 ( -1.227 5.079 -0.719) 5.275 11.659 ( -9.481 16.751 23.883) 30.674 11.979 ( -36.007 -4.676 16.737) 39.981 12.696 ( -1.145 5.875 1.816) 6.255 12.763 ( -0.270 0.483 -1.509) 1.607 12.838 ( -10.700 -3.116 2.278) 11.375 13.139 ( -13.699 -22.592 2.288) 26.520 13.751 ( 18.753 -0.708 8.949) 20.791 15.238 ( 60.265 -0.840 -54.404) 81.194 15.411 ( 3.365 -0.465 2.747) 4.369 15.890 ( -1.643 -0.716 -0.129) 1.797 ======================= Grid point 87 (28/160) ======================= q-point: ( 0.22 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.976 ( 10.759 -16.401 6.771) 20.751 1.079 ( 15.376 -12.386 16.564) 25.772 1.753 ( 24.962 -9.291 1.350) 26.669 1.924 ( 12.344 -2.525 18.015) 21.984 2.205 ( 6.830 -0.106 -7.893) 10.438 2.548 ( 8.557 7.206 -1.121) 11.243 2.658 ( 3.830 7.733 -4.703) 9.828 2.762 ( -3.879 0.107 -0.585) 3.924 3.010 ( -1.400 0.598 6.950) 7.114 3.075 ( 0.875 -6.035 2.385) 6.548 3.441 ( -2.241 0.837 -0.112) 2.395 3.745 ( -4.589 4.573 0.285) 6.485 3.913 ( -1.713 9.699 -0.262) 9.853 3.978 ( -5.312 -1.695 8.504) 10.169 4.042 ( -4.393 0.471 2.500) 5.076 4.160 ( -0.232 -0.545 1.215) 1.352 4.356 ( -0.450 -0.326 -2.518) 2.578 4.502 ( -3.169 -3.475 -2.636) 5.391 4.655 ( 1.530 0.447 -3.056) 3.447 4.760 ( 0.306 -3.828 -2.033) 4.346 5.054 ( 4.315 4.273 -7.119) 9.357 5.208 ( 5.226 -3.472 -7.879) 10.072 5.582 ( -3.580 3.514 1.204) 5.159 5.725 ( -0.687 0.598 0.931) 1.302 5.747 ( 0.327 -1.021 1.253) 1.650 6.033 ( -0.309 0.548 -2.400) 2.481 6.289 ( -13.700 9.120 25.205) 30.102 6.697 ( -6.716 -3.899 -1.412) 7.893 6.791 ( -11.244 0.633 10.460) 15.370 7.240 ( -1.163 0.397 -2.334) 2.637 7.466 ( -0.597 1.556 -2.676) 3.152 8.663 ( 2.214 5.546 2.865) 6.623 8.763 ( -3.438 3.656 13.124) 14.050 8.956 ( -4.496 -0.012 -12.311) 13.106 9.178 ( 4.871 0.453 -0.956) 4.985 9.266 ( 3.431 -1.428 0.311) 3.729 9.305 ( 3.634 -4.931 -3.159) 6.892 9.436 ( -8.745 1.011 -2.289) 9.096 10.065 ( -2.667 -4.512 -0.117) 5.242 10.395 ( -1.298 6.189 -2.450) 6.782 10.582 ( -1.249 0.429 -3.731) 3.958 10.819 ( 2.036 3.656 5.166) 6.648 11.112 ( 2.475 7.401 7.298) 10.684 11.174 ( 1.812 -2.013 4.593) 5.332 11.498 ( -3.874 -5.537 10.820) 12.757 11.759 ( -5.440 1.315 1.606) 5.822 12.603 ( -2.175 5.468 -1.967) 6.205 12.752 ( -0.221 0.443 -3.522) 3.556 12.795 ( -1.971 -4.730 3.681) 6.309 13.156 ( -9.545 -19.058 0.383) 21.318 14.074 ( 17.336 -0.774 10.257) 20.158 15.348 ( -2.258 -0.015 4.125) 4.703 15.847 ( 1.163 1.000 -1.332) 2.031 15.903 ( 22.010 9.708 -32.552) 40.476 ======================= Grid point 88 (29/160) ======================= q-point: ( 0.33 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( 9.307 -13.120 6.150) 17.222 1.466 ( 13.913 -12.971 10.531) 21.743 2.007 ( 5.336 -8.080 7.681) 12.360 2.281 ( 16.351 1.625 -2.568) 16.631 2.408 ( 13.899 0.629 1.589) 14.004 2.593 ( -5.310 1.224 -5.826) 7.978 2.643 ( 9.523 7.937 2.419) 12.630 2.709 ( 3.768 3.933 -0.142) 5.449 2.985 ( -0.111 0.034 10.531) 10.531 3.177 ( 1.536 -7.906 4.110) 9.042 3.386 ( -3.088 0.197 1.594) 3.481 3.637 ( -3.902 2.415 -3.583) 5.822 3.719 ( -6.770 7.892 -0.367) 10.405 3.877 ( -7.937 0.296 6.738) 10.415 4.009 ( -0.675 -0.550 0.509) 1.008 4.183 ( 2.463 0.315 3.552) 4.333 4.326 ( -1.544 1.650 -2.768) 3.574 4.528 ( -0.244 -5.432 -3.279) 6.350 4.678 ( 1.873 1.156 -1.747) 2.810 4.777 ( -1.544 -0.967 -2.542) 3.127 5.042 ( 0.702 5.848 -7.691) 9.687 5.260 ( -1.250 0.514 -1.811) 2.260 5.528 ( -0.680 -1.992 -3.911) 4.442 5.671 ( -3.314 2.028 3.408) 5.168 5.777 ( 2.105 0.875 3.677) 4.326 6.012 ( -3.358 -0.127 5.841) 6.739 6.048 ( -5.519 3.848 13.873) 15.419 6.622 ( -5.689 -2.844 1.897) 6.637 6.641 ( -6.227 0.609 0.946) 6.328 7.217 ( -0.937 0.429 -2.201) 2.430 7.450 ( -0.193 0.556 -4.131) 4.173 8.650 ( 2.666 5.212 4.072) 7.132 8.710 ( -2.024 0.777 10.209) 10.437 8.908 ( -0.949 -0.966 -14.335) 14.399 9.240 ( -0.709 1.783 -1.630) 2.518 9.270 ( -2.124 -1.386 0.461) 2.578 9.333 ( 0.884 1.023 -4.767) 4.955 9.436 ( 3.677 -6.422 3.040) 8.000 10.085 ( 0.091 -4.195 -4.798) 6.374 10.328 ( -0.831 4.159 -2.635) 4.993 10.571 ( -0.489 -0.939 -4.845) 4.959 10.812 ( 1.827 4.249 4.982) 6.798 11.075 ( 1.490 5.954 10.198) 11.903 11.246 ( 2.804 -1.978 3.456) 4.870 11.524 ( -1.126 -5.576 3.267) 6.560 11.682 ( -1.586 3.006 1.289) 3.635 12.550 ( 1.837 4.867 -2.143) 5.627 12.738 ( -1.293 -0.088 -5.097) 5.259 12.820 ( -0.412 -3.811 3.375) 5.107 13.171 ( -8.278 -15.070 1.257) 17.240 14.328 ( 11.380 -0.093 9.505) 14.828 15.316 ( -1.280 0.393 4.211) 4.419 15.805 ( -2.913 -0.149 0.764) 3.015 16.101 ( 12.599 8.718 -20.685) 25.741 ======================= Grid point 89 (30/160) ======================= q-point: ( 0.44 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( 6.423 -8.472 3.512) 11.197 1.732 ( 2.063 -8.982 8.554) 12.573 2.165 ( 4.430 -3.523 11.899) 13.176 2.380 ( -7.102 1.139 -2.925) 7.765 2.498 ( 10.334 1.084 -1.156) 10.455 2.542 ( 1.900 3.772 6.723) 7.939 2.678 ( 3.645 4.796 1.343) 6.172 2.851 ( 11.473 2.211 -3.997) 12.348 3.050 ( 4.610 -0.965 7.591) 8.933 3.190 ( -5.829 -2.929 3.796) 7.548 3.362 ( -1.811 -1.279 0.732) 2.335 3.572 ( 1.922 2.083 1.289) 3.114 3.636 ( -0.884 -0.752 -0.842) 1.434 3.717 ( -9.408 1.196 3.850) 10.235 4.013 ( -0.657 -2.055 -0.582) 2.235 4.179 ( -3.089 4.845 -4.402) 7.239 4.325 ( 1.988 -4.098 3.647) 5.835 4.572 ( -0.392 -5.140 -4.196) 6.646 4.688 ( 2.037 3.167 -1.295) 3.982 4.710 ( -2.504 6.650 -2.918) 7.681 4.999 ( -0.351 1.669 -7.675) 7.862 5.208 ( -2.142 1.059 -1.824) 3.006 5.527 ( -3.923 -1.722 8.057) 9.126 5.641 ( 1.573 -1.920 -0.594) 2.553 5.795 ( 1.562 1.927 4.383) 5.036 5.929 ( -3.296 -0.174 13.389) 13.789 6.026 ( 1.395 0.987 -2.979) 3.434 6.551 ( -3.019 0.386 0.820) 3.153 6.589 ( -1.797 -2.046 0.611) 2.791 7.202 ( -0.285 0.287 -2.028) 2.068 7.444 ( -0.323 -0.322 -4.639) 4.661 8.650 ( 2.451 4.267 4.241) 6.496 8.674 ( -1.734 -0.102 8.432) 8.609 8.936 ( 2.781 -1.464 -12.693) 13.076 9.133 ( -4.921 1.980 -3.951) 6.614 9.308 ( 0.632 -1.482 -0.058) 1.612 9.349 ( 1.017 -0.606 -2.793) 3.034 9.543 ( 2.658 -4.354 6.743) 8.455 10.136 ( 1.375 -2.917 -7.535) 8.196 10.278 ( -0.956 2.822 -2.759) 4.061 10.573 ( -0.777 -1.319 -5.041) 5.268 10.803 ( 1.617 3.975 4.432) 6.169 11.049 ( 1.085 4.827 9.812) 10.988 11.294 ( 0.349 -1.916 3.612) 4.103 11.554 ( -0.345 -3.365 0.837) 3.484 11.644 ( -0.461 1.532 2.777) 3.205 12.558 ( 2.988 2.615 -1.890) 4.398 12.708 ( -3.050 -1.692 -6.524) 7.398 12.849 ( 0.610 -1.068 2.563) 2.843 13.175 ( -2.718 -5.530 2.794) 6.765 14.446 ( 2.099 0.268 7.471) 7.765 15.302 ( 0.221 0.707 4.492) 4.553 15.769 ( -1.006 0.083 1.058) 1.462 16.192 ( 5.250 1.819 -13.838) 14.912 ======================= Grid point 90 (31/160) ======================= q-point: (-0.44 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.622 ( -4.195 -0.926 8.079) 9.150 1.684 ( -10.033 0.482 0.052) 10.045 2.064 ( -10.723 3.063 9.320) 14.533 2.362 ( -1.522 3.783 7.815) 8.815 2.556 ( 4.579 -8.072 -1.877) 9.468 2.693 ( 2.256 3.857 2.520) 5.129 2.711 ( 9.935 -2.006 8.924) 13.505 2.965 ( -1.156 -0.813 -0.483) 1.494 3.037 ( -3.455 -0.285 3.229) 4.737 3.190 ( 3.613 0.230 5.084) 6.241 3.345 ( 0.257 -0.830 -0.580) 1.045 3.554 ( -5.407 2.700 0.108) 6.045 3.628 ( 1.827 -2.316 4.087) 5.041 3.654 ( 0.725 -0.878 -0.730) 1.353 4.002 ( -9.805 4.173 -6.226) 12.341 4.027 ( 0.789 -1.351 -0.040) 1.565 4.397 ( 0.542 -3.167 0.867) 3.328 4.599 ( -0.718 3.661 -2.321) 4.394 4.627 ( -0.857 0.549 -2.919) 3.091 4.725 ( 8.390 4.655 -4.993) 10.816 5.004 ( -0.119 -4.134 -7.414) 8.489 5.182 ( -0.811 -0.450 -3.188) 3.320 5.478 ( -3.450 -2.406 13.499) 14.140 5.709 ( 2.492 -2.560 -0.139) 3.575 5.796 ( 0.914 1.935 3.608) 4.195 5.915 ( 0.607 -0.682 9.400) 9.444 6.060 ( 3.616 0.201 -0.283) 3.633 6.527 ( 0.182 -0.332 -0.223) 0.439 6.605 ( 2.033 -0.547 0.942) 2.307 7.203 ( 0.565 -0.026 -2.041) 2.118 7.442 ( -0.628 -1.045 -4.849) 5.000 8.639 ( 0.311 3.373 7.511) 8.239 8.670 ( 0.198 -1.475 4.656) 4.888 9.013 ( 4.616 -0.727 -6.079) 7.667 9.054 ( -1.767 1.369 -9.719) 9.973 9.306 ( -2.338 -1.831 -0.483) 3.008 9.378 ( 0.668 -1.863 -1.771) 2.655 9.611 ( 1.364 -2.067 8.934) 9.271 10.152 ( -1.071 1.221 -6.445) 6.646 10.264 ( 1.346 -0.772 -4.581) 4.836 10.563 ( -1.534 -0.819 -5.219) 5.502 10.787 ( 0.563 3.602 4.303) 5.639 11.019 ( 0.331 4.176 8.511) 9.486 11.298 ( -2.329 -2.493 4.700) 5.808 11.583 ( -0.524 -3.262 -0.805) 3.401 11.633 ( 1.119 1.337 4.488) 4.815 12.580 ( -0.876 -2.272 -0.748) 2.548 12.678 ( -1.066 -1.118 -7.167) 7.332 12.852 ( 0.150 1.778 2.047) 2.716 13.197 ( 5.682 6.450 3.348) 9.224 14.392 ( -8.095 0.406 5.109) 9.581 15.312 ( 1.665 0.812 4.961) 5.295 15.774 ( 1.610 0.143 1.298) 2.073 16.251 ( -0.500 -6.484 -11.507) 13.217 ======================= Grid point 91 (32/160) ======================= q-point: (-0.33 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.375 ( -18.441 3.622 14.519) 23.748 1.464 ( -13.311 8.162 -6.066) 16.751 1.873 ( -8.822 3.407 10.726) 14.300 2.292 ( -4.460 -2.132 -0.658) 4.986 2.539 ( -11.217 5.182 9.875) 15.818 2.707 ( -2.883 1.102 1.676) 3.512 2.842 ( -2.506 -1.856 7.902) 8.495 2.856 ( -7.000 -0.967 -0.930) 7.128 2.996 ( -0.353 -4.179 11.929) 12.645 3.236 ( 3.799 2.755 8.161) 9.414 3.410 ( 5.139 0.277 -1.175) 5.279 3.495 ( 1.305 1.239 -6.609) 6.849 3.611 ( -3.883 -2.518 -3.566) 5.842 3.766 ( 8.753 -5.161 2.063) 10.369 3.868 ( -2.281 0.925 -4.613) 5.228 4.084 ( 4.363 -1.289 0.176) 4.553 4.422 ( 0.862 -0.639 -1.929) 2.208 4.541 ( -1.155 3.166 -1.523) 3.698 4.598 ( -0.929 2.162 -1.365) 2.720 4.807 ( 5.075 4.672 -7.124) 9.916 5.068 ( 1.062 -4.901 -8.407) 9.789 5.181 ( -1.388 -3.183 -4.964) 6.058 5.475 ( -0.607 -3.601 11.266) 11.843 5.731 ( -0.584 1.524 4.910) 5.174 5.822 ( 2.500 -1.472 0.721) 2.989 5.949 ( 1.850 -0.573 6.592) 6.870 6.159 ( 7.552 -2.124 10.860) 13.397 6.564 ( 3.691 -0.732 -1.353) 3.999 6.660 ( 4.477 1.101 0.315) 4.621 7.220 ( 1.226 -0.419 -2.231) 2.580 7.441 ( -0.810 -1.541 -5.019) 5.312 8.602 ( -1.327 2.789 7.747) 8.340 8.702 ( 0.530 -3.319 4.615) 5.709 9.010 ( -0.115 1.313 -4.779) 4.957 9.130 ( 5.805 -1.422 -9.613) 11.319 9.276 ( -2.923 -2.224 0.365) 3.691 9.397 ( -0.987 -2.387 -1.837) 3.169 9.631 ( -0.155 0.006 8.873) 8.875 10.099 ( -1.192 3.601 -4.927) 6.218 10.319 ( 2.515 -2.875 -4.526) 5.922 10.540 ( -1.607 -0.673 -6.094) 6.338 10.756 ( -0.126 3.179 4.680) 5.659 10.984 ( 0.071 3.798 6.989) 7.955 11.272 ( -3.220 -2.206 7.108) 8.109 11.560 ( -5.083 -2.366 -0.065) 5.607 11.684 ( 5.055 0.229 3.611) 6.217 12.578 ( -1.119 -2.705 -1.540) 3.307 12.702 ( 1.609 -2.050 -4.032) 4.801 12.827 ( 0.523 4.156 1.775) 4.549 13.228 ( 9.136 13.772 2.902) 16.780 14.177 ( -16.152 1.017 2.829) 16.429 15.343 ( 2.687 0.884 5.459) 6.148 15.813 ( 2.908 0.293 1.174) 3.149 16.294 ( -6.323 -14.313 -13.262) 20.512 ======================= Grid point 92 (33/160) ======================= q-point: (-0.22 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.008 ( -19.139 5.672 14.497) 24.670 1.104 ( -19.115 7.207 0.829) 20.446 1.687 ( -8.957 5.415 2.674) 10.803 2.065 ( -24.519 10.859 17.886) 32.234 2.297 ( -7.814 -4.832 5.513) 10.714 2.542 ( -9.334 4.877 -0.859) 10.566 2.715 ( -6.476 -0.694 0.639) 6.544 2.805 ( -4.665 -0.869 3.526) 5.911 3.070 ( 0.945 -2.259 8.770) 9.105 3.235 ( -1.010 3.883 5.099) 6.488 3.478 ( 0.774 -3.371 -9.744) 10.340 3.572 ( 5.710 -3.437 3.159) 7.376 3.639 ( 6.207 -0.754 0.541) 6.276 3.858 ( 2.557 2.834 -4.987) 6.280 3.992 ( 8.269 -7.358 0.666) 11.088 4.185 ( 5.349 -1.373 1.326) 5.679 4.445 ( 1.828 0.189 -1.602) 2.438 4.498 ( -0.766 2.108 0.067) 2.244 4.572 ( 0.789 2.560 -3.476) 4.388 4.819 ( 1.759 3.291 -5.930) 7.007 5.078 ( -1.882 0.539 -8.417) 8.641 5.182 ( -4.475 -5.434 -8.257) 10.850 5.521 ( 1.386 -3.333 6.184) 7.161 5.695 ( -1.157 2.073 4.264) 4.881 5.876 ( 1.445 -1.559 3.513) 4.106 5.979 ( 1.155 -0.300 1.337) 1.793 6.383 ( 13.044 -7.578 27.224) 31.124 6.668 ( 8.832 -0.067 -0.161) 8.834 6.727 ( 5.419 2.742 -0.787) 6.124 7.248 ( 1.287 -0.629 -2.345) 2.747 7.441 ( -0.841 -1.504 -5.398) 5.666 8.548 ( -2.210 1.827 8.519) 8.989 8.753 ( 1.046 -4.748 4.984) 6.963 9.014 ( 1.505 0.269 -6.125) 6.313 9.162 ( -2.735 0.891 -4.414) 5.269 9.314 ( 1.197 -8.186 0.520) 8.290 9.387 ( -1.934 -1.159 -2.158) 3.121 9.624 ( 0.845 1.729 5.876) 6.184 10.061 ( 1.251 3.843 -2.159) 4.582 10.392 ( 2.378 -3.377 -3.691) 5.539 10.533 ( 0.088 -2.027 -5.610) 5.966 10.734 ( 1.250 3.115 4.768) 5.831 10.954 ( 0.819 3.784 6.139) 7.258 11.251 ( -1.308 -2.337 11.916) 12.213 11.472 ( -7.417 -1.980 -0.576) 7.698 11.779 ( 7.409 2.709 4.403) 9.034 12.613 ( 3.382 -0.106 -2.281) 4.081 12.742 ( 0.875 0.450 0.788) 1.260 12.815 ( 2.040 -0.056 -0.123) 2.045 13.236 ( 8.636 15.613 2.964) 18.087 13.849 ( -20.203 1.981 0.215) 20.302 15.380 ( 2.330 0.881 5.484) 6.023 15.857 ( 2.432 0.346 0.956) 2.636 16.284 ( -15.506 -19.674 -21.397) 32.944 ======================= Grid point 93 (34/160) ======================= q-point: (-0.11 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.651 ( -16.843 4.183 16.571) 23.995 0.721 ( -17.864 4.882 12.172) 22.161 1.316 ( -25.506 12.061 15.323) 32.106 1.712 ( -1.853 4.502 21.236) 21.786 2.195 ( -10.330 -4.962 1.850) 11.608 2.342 ( -8.216 3.437 -3.976) 9.753 2.650 ( -3.991 0.112 3.546) 5.340 2.743 ( -0.685 0.328 -0.729) 1.053 3.064 ( -2.358 -0.017 6.334) 6.758 3.162 ( -3.217 2.064 -0.818) 3.909 3.496 ( -1.047 -2.145 -7.406) 7.781 3.718 ( 7.107 -2.274 8.900) 11.614 3.772 ( 6.153 -0.814 4.006) 7.387 3.897 ( 5.770 2.510 -5.178) 8.149 4.142 ( 2.358 -5.006 0.806) 5.592 4.247 ( 1.527 3.101 1.862) 3.926 4.441 ( -1.922 0.960 4.107) 4.635 4.530 ( 5.311 -0.777 -4.656) 7.106 4.571 ( 1.651 1.761 -4.825) 5.395 4.818 ( 0.839 0.714 -3.309) 3.488 5.020 ( -2.682 1.557 -9.589) 10.078 5.097 ( -10.368 -2.653 -9.279) 14.164 5.581 ( 2.570 -2.093 2.660) 4.249 5.664 ( -0.414 1.417 3.066) 3.403 5.892 ( -1.000 -0.525 5.807) 5.915 5.999 ( 1.082 -0.252 -1.499) 1.866 6.650 ( 4.086 -9.326 6.573) 12.119 6.770 ( 3.229 3.250 -4.183) 6.204 7.001 ( 30.551 -3.442 29.478) 42.593 7.270 ( 0.725 -0.325 -2.186) 2.326 7.438 ( -0.652 -0.748 -6.103) 6.183 8.516 ( 0.460 0.283 9.605) 9.620 8.844 ( 4.289 -5.164 5.359) 8.590 9.038 ( 0.023 0.330 -3.664) 3.679 9.098 ( -0.476 1.538 -4.987) 5.240 9.330 ( -6.006 -4.013 -5.278) 8.946 9.438 ( -0.591 -13.348 5.466) 14.436 9.641 ( 3.491 3.758 -0.570) 5.161 10.066 ( 2.964 2.872 1.905) 4.546 10.458 ( 1.870 -3.161 -3.043) 4.770 10.605 ( 3.218 -7.409 0.164) 8.080 10.746 ( 3.934 4.187 2.960) 6.463 10.965 ( 4.729 2.456 5.612) 7.739 11.349 ( -1.824 -6.412 7.134) 9.764 11.395 ( 12.203 -7.477 18.801) 23.628 11.882 ( 15.125 13.170 7.470) 21.401 12.660 ( 0.991 -0.269 -1.051) 1.470 12.733 ( 4.530 7.918 0.261) 9.126 12.908 ( 2.482 -8.893 0.020) 9.233 13.220 ( 6.670 16.619 4.638) 18.499 13.504 ( -15.734 1.037 -2.590) 15.980 15.389 ( -2.189 0.402 1.679) 2.788 15.879 ( -3.616 -2.714 -1.314) 4.709 16.003 ( -42.409 -12.794 -37.873) 58.280 ======================= Grid point 95 (35/160) ======================= q-point: ( 0.11 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.792 ( 16.487 -0.000 5.151) 17.273 0.947 ( 16.659 -0.000 19.588) 25.714 1.657 ( 26.618 -0.000 2.485) 26.734 1.898 ( 14.111 -0.000 21.451) 25.676 2.204 ( 6.232 -0.000 -9.364) 11.249 2.603 ( 6.190 -0.000 -4.343) 7.562 2.743 ( -5.525 0.000 -4.778) 7.304 2.809 ( 8.440 -0.000 -2.078) 8.692 2.996 ( -2.632 0.000 5.677) 6.257 3.021 ( -1.106 0.000 0.857) 1.399 3.453 ( -2.381 0.000 -0.811) 2.515 3.863 ( -1.939 0.000 7.819) 8.056 3.864 ( -9.304 0.000 4.669) 10.410 4.049 ( -1.516 0.000 2.141) 2.623 4.098 ( 0.936 -0.000 2.694) 2.852 4.106 ( -2.426 0.000 -1.717) 2.972 4.315 ( 0.051 -0.000 0.437) 0.440 4.461 ( -7.410 0.000 -3.197) 8.070 4.662 ( 1.691 -0.000 -6.841) 7.047 4.724 ( 1.572 -0.000 3.882) 4.188 5.120 ( 5.364 -0.000 -6.284) 8.262 5.148 ( 6.546 -0.000 -9.998) 11.951 5.629 ( -7.525 0.000 3.958) 8.502 5.721 ( 1.026 -0.000 -2.705) 2.893 5.735 ( 2.233 -0.000 1.327) 2.598 6.038 ( -0.563 0.000 -1.517) 1.618 6.415 ( -19.132 0.000 21.932) 29.104 6.633 ( -4.831 0.000 -0.857) 4.906 6.799 ( -11.099 0.000 10.885) 15.546 7.244 ( -1.193 0.000 -2.463) 2.736 7.484 ( -1.556 0.000 -1.502) 2.163 8.714 ( 1.787 -0.000 1.519) 2.345 8.854 ( -7.682 0.000 20.364) 21.765 8.954 ( -5.190 0.000 -12.505) 13.539 9.141 ( 5.446 -0.000 -2.770) 6.110 9.219 ( 2.580 -0.000 -0.658) 2.662 9.280 ( 2.671 -0.000 -4.436) 5.178 9.450 ( -8.173 0.000 -2.999) 8.706 10.016 ( -2.073 0.000 0.676) 2.181 10.485 ( -2.102 0.000 -1.275) 2.459 10.564 ( -5.137 0.000 -3.801) 6.390 10.865 ( 2.433 -0.000 6.670) 7.100 11.135 ( 5.107 -0.000 1.918) 5.455 11.275 ( 3.311 -0.000 -4.650) 5.709 11.365 ( -13.298 0.000 26.647) 29.781 11.774 ( -1.924 0.000 2.494) 3.150 12.732 ( -3.342 0.000 -6.149) 6.998 12.732 ( 0.670 -0.000 3.987) 4.043 12.787 ( 2.430 -0.000 2.524) 3.503 12.869 ( -7.327 0.000 -0.362) 7.336 14.068 ( 17.945 -0.000 10.718) 20.902 15.346 ( -2.253 0.000 5.036) 5.517 15.848 ( -2.719 0.000 0.665) 2.799 16.023 ( 25.084 -0.000 -43.559) 50.265 ======================= Grid point 96 (36/160) ======================= q-point: ( 0.22 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.104 ( 15.805 -5.182 0.300) 16.636 1.268 ( 16.137 -6.132 14.717) 22.685 1.890 ( 7.326 -3.379 5.779) 9.924 2.318 ( 18.856 2.236 1.877) 19.081 2.371 ( 17.062 -2.900 1.263) 17.352 2.613 ( -7.569 0.558 -4.275) 8.711 2.739 ( 9.509 1.775 -3.624) 10.330 2.856 ( 2.638 9.482 3.639) 10.493 2.988 ( -1.296 -0.179 5.318) 5.476 3.028 ( 1.302 -7.365 4.401) 8.678 3.407 ( -1.571 1.269 1.408) 2.462 3.672 ( -9.325 1.454 0.847) 9.476 3.807 ( -6.900 0.286 1.028) 6.982 3.970 ( -3.579 8.690 2.397) 9.699 4.010 ( -3.664 0.826 2.500) 4.512 4.134 ( -1.275 -4.901 5.659) 7.594 4.342 ( -1.124 -0.308 -3.560) 3.746 4.385 ( -2.876 -6.543 -2.215) 7.482 4.702 ( 3.345 0.957 -6.231) 7.137 4.752 ( 0.798 -0.819 3.909) 4.073 5.153 ( 1.999 4.309 -7.377) 8.774 5.248 ( 2.242 -1.602 -4.995) 5.705 5.504 ( -5.363 -0.526 -2.141) 5.798 5.709 ( -2.279 1.372 0.302) 2.677 5.786 ( 3.046 0.092 2.517) 3.953 6.012 ( -3.127 0.029 4.737) 5.676 6.126 ( -10.580 3.098 17.532) 20.710 6.569 ( -3.848 -1.955 -0.375) 4.333 6.653 ( -6.812 0.370 2.224) 7.176 7.222 ( -1.196 0.111 -2.263) 2.561 7.458 ( -1.262 0.289 -3.176) 3.429 8.717 ( -1.131 0.627 5.804) 5.947 8.772 ( 0.661 5.055 12.777) 13.757 8.889 ( -2.142 -0.790 -13.980) 14.165 9.246 ( 2.076 -0.974 -0.043) 2.294 9.258 ( -2.733 0.123 -1.112) 2.953 9.293 ( 1.757 -5.410 -1.750) 5.952 9.363 ( 0.354 0.877 -5.454) 5.536 10.014 ( 0.515 -2.368 -2.182) 3.261 10.413 ( -2.602 4.043 -2.368) 5.359 10.526 ( -2.219 -3.147 -5.217) 6.485 10.877 ( 0.479 1.938 6.960) 7.241 11.181 ( -1.078 2.650 12.198) 12.529 11.247 ( 5.203 4.016 2.901) 7.184 11.390 ( 0.953 -7.534 2.217) 7.911 11.724 ( -3.215 1.137 0.509) 3.448 12.656 ( -1.644 5.129 -4.284) 6.882 12.719 ( -3.996 -1.748 -4.516) 6.279 12.784 ( 2.032 0.097 3.282) 3.861 12.942 ( 5.870 -7.779 3.522) 10.362 14.328 ( 11.837 0.037 10.183) 15.615 15.317 ( -1.302 -0.083 5.087) 5.251 15.802 ( -2.594 -0.082 1.068) 2.806 16.235 ( 6.509 4.114 -26.733) 27.819 ======================= Grid point 97 (37/160) ======================= q-point: ( 0.33 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.401 ( 13.134 -4.688 -0.416) 13.951 1.563 ( 8.700 -7.649 10.642) 15.730 2.073 ( 10.114 -4.574 7.595) 13.450 2.388 ( -9.154 0.400 -5.411) 10.641 2.547 ( 7.852 2.810 4.545) 9.498 2.605 ( 1.734 1.539 5.707) 6.160 2.797 ( 1.383 7.226 1.438) 7.496 2.892 ( 9.405 1.797 -3.857) 10.322 3.020 ( 3.499 -1.589 6.172) 7.271 3.095 ( -2.264 -6.167 4.908) 8.200 3.389 ( 0.888 3.592 1.858) 4.140 3.570 ( -1.779 -2.804 -0.694) 3.392 3.677 ( -3.460 4.172 -0.099) 5.421 3.806 ( -5.230 7.999 3.741) 10.264 3.967 ( -2.329 -1.947 -0.924) 3.173 4.182 ( -0.041 -7.304 6.395) 9.708 4.265 ( -6.746 1.022 -6.624) 9.509 4.437 ( -1.071 -8.222 -0.466) 8.305 4.734 ( 0.132 1.617 2.043) 2.609 4.762 ( 1.664 0.679 -3.836) 4.236 5.111 ( 0.147 7.027 -9.383) 11.724 5.228 ( -3.029 0.818 -2.417) 3.960 5.488 ( -0.602 -2.441 -1.762) 3.070 5.629 ( -3.785 0.828 7.109) 8.096 5.826 ( 2.192 1.125 3.867) 4.585 5.930 ( -3.867 0.236 13.467) 14.013 6.045 ( 0.257 0.946 -1.709) 1.970 6.550 ( -0.341 -1.618 0.097) 1.656 6.560 ( -3.648 0.306 0.266) 3.670 7.204 ( -0.760 -0.051 -2.028) 2.166 7.436 ( -1.392 -0.412 -3.985) 4.242 8.682 ( -1.865 0.850 6.874) 7.173 8.755 ( 2.639 5.846 8.815) 10.901 8.900 ( 1.996 -1.982 -13.242) 13.538 9.152 ( -5.568 0.082 -3.051) 6.350 9.287 ( 0.414 -0.724 -1.201) 1.462 9.346 ( 0.444 -0.051 -3.163) 3.195 9.432 ( 3.237 -5.940 2.365) 7.166 10.071 ( 2.650 -3.151 -4.819) 6.338 10.335 ( -2.657 2.843 -2.473) 4.610 10.526 ( -1.433 -3.060 -5.439) 6.403 10.859 ( -0.535 1.712 6.731) 6.966 11.140 ( 0.065 3.836 12.642) 13.212 11.289 ( 1.796 1.805 1.142) 2.791 11.467 ( 0.733 -5.124 0.908) 5.255 11.661 ( -2.726 0.234 1.406) 3.076 12.582 ( -4.092 -0.121 -1.542) 4.374 12.676 ( -2.307 -1.116 -7.712) 8.127 12.834 ( 2.714 -0.727 3.008) 4.117 13.157 ( 15.752 2.511 2.613) 16.163 14.450 ( 2.050 0.117 8.000) 8.259 15.307 ( -0.052 -0.065 5.263) 5.264 15.772 ( -0.690 0.164 1.505) 1.664 16.223 ( -3.128 1.255 -17.185) 17.512 ======================= Grid point 98 (38/160) ======================= q-point: (-0.56 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.595 ( 2.495 -1.261 10.713) 11.071 1.677 ( 1.722 -1.737 -2.948) 3.830 2.135 ( -12.076 4.498 2.245) 13.081 2.354 ( 11.167 -6.730 6.987) 14.792 2.490 ( -8.014 3.148 2.030) 8.846 2.670 ( 4.215 -1.549 11.075) 11.951 2.778 ( 2.663 4.283 2.462) 5.612 2.938 ( -5.521 -1.913 0.855) 5.905 3.026 ( -3.253 -0.666 3.210) 4.619 3.165 ( 5.840 -2.671 2.673) 6.956 3.370 ( 2.201 3.084 -1.709) 4.157 3.593 ( -1.312 0.446 1.862) 2.321 3.639 ( 0.591 1.738 -1.062) 2.121 3.689 ( 2.703 6.620 1.952) 7.412 3.972 ( -0.508 -3.668 -0.749) 3.778 4.075 ( -12.267 3.231 -6.712) 14.352 4.266 ( -0.720 -9.237 3.702) 9.977 4.519 ( 1.396 -8.076 -1.812) 8.393 4.674 ( -3.996 1.481 2.935) 5.175 4.806 ( 4.852 1.918 -5.762) 7.773 5.040 ( 0.675 7.579 -11.204) 13.543 5.179 ( -2.144 -0.062 -3.160) 3.819 5.455 ( -3.303 0.103 13.547) 13.945 5.641 ( 1.809 -4.064 0.006) 4.449 5.837 ( 0.698 1.979 4.864) 5.297 5.905 ( 0.278 -0.328 8.387) 8.398 6.066 ( 2.714 0.284 -1.016) 2.912 6.526 ( -0.051 0.172 -0.229) 0.291 6.590 ( 3.443 -0.885 0.061) 3.555 7.199 ( -0.044 -0.378 -1.999) 2.035 7.418 ( -1.611 -1.296 -4.387) 4.850 8.651 ( -1.246 0.022 6.277) 6.400 8.736 ( 1.347 5.815 7.573) 9.642 8.978 ( 4.662 -2.480 -11.536) 12.687 9.075 ( -3.257 0.430 -4.782) 5.802 9.283 ( -1.323 -0.618 -1.539) 2.121 9.349 ( -0.466 -0.987 -2.316) 2.561 9.532 ( 1.456 -5.662 5.958) 8.347 10.143 ( 2.617 -1.426 -5.778) 6.501 10.271 ( -2.209 1.004 -2.737) 3.658 10.529 ( -1.433 -2.379 -5.278) 5.964 10.828 ( -1.994 0.759 6.639) 6.974 11.107 ( 0.330 4.415 10.596) 11.484 11.276 ( -1.413 0.426 1.913) 2.416 11.509 ( -1.200 -3.955 -0.397) 4.152 11.641 ( 0.133 -0.581 3.340) 3.392 12.530 ( -2.960 -2.172 -0.368) 3.690 12.661 ( -0.480 -0.747 -7.103) 7.158 12.879 ( 2.406 0.823 2.744) 3.741 13.395 ( 19.872 12.350 0.857) 23.413 14.398 ( -7.817 0.184 5.219) 9.401 15.319 ( 1.239 -0.135 5.604) 5.741 15.779 ( 1.717 0.371 1.473) 2.292 16.127 ( -9.950 -5.879 -12.114) 16.743 ======================= Grid point 99 (39/160) ======================= q-point: (-0.44 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( -11.913 4.992 14.617) 19.506 1.655 ( -6.154 10.696 -5.620) 13.560 1.898 ( -8.786 -0.379 2.087) 9.039 2.301 ( -9.635 2.521 3.704) 10.626 2.572 ( 2.093 -2.296 9.704) 10.190 2.699 ( -0.740 -1.455 4.147) 4.456 2.809 ( -2.657 -1.062 7.770) 8.280 2.843 ( -3.362 -0.719 1.466) 3.738 2.936 ( -5.002 -2.001 8.350) 9.937 3.283 ( 4.775 1.572 3.938) 6.386 3.428 ( 7.406 -0.308 -0.427) 7.425 3.527 ( -2.593 2.326 -4.524) 5.710 3.604 ( -5.260 4.701 -2.628) 7.528 3.727 ( 5.294 0.771 3.127) 6.197 3.869 ( -4.159 -0.468 -5.642) 7.025 4.038 ( 2.892 -3.723 -1.054) 4.830 4.329 ( -1.310 -7.903 0.410) 8.021 4.583 ( -0.896 -0.386 -0.101) 0.981 4.607 ( -2.076 -0.795 0.213) 2.233 4.900 ( 5.229 -3.038 -8.484) 10.419 4.989 ( 1.243 5.921 -11.382) 12.890 5.150 ( -2.050 -0.915 -3.598) 4.241 5.426 ( -0.634 -1.164 14.775) 14.834 5.715 ( 1.726 -3.494 1.999) 4.380 5.822 ( 0.063 1.579 3.619) 3.949 5.934 ( 1.643 -0.856 8.068) 8.278 6.131 ( 4.642 -0.913 5.268) 7.080 6.558 ( 4.143 0.041 -1.382) 4.367 6.672 ( 5.640 0.315 -0.026) 5.649 7.209 ( 0.643 -0.733 -2.247) 2.449 7.406 ( -1.568 -2.005 -4.666) 5.315 8.642 ( -0.695 -1.097 6.509) 6.637 8.689 ( -1.005 4.518 5.775) 7.401 9.030 ( -1.497 0.470 -5.407) 5.630 9.084 ( 3.982 -3.241 -10.031) 11.269 9.259 ( -1.695 0.303 -0.644) 1.838 9.352 ( -0.795 -2.176 -2.355) 3.304 9.590 ( -0.107 -3.980 7.159) 8.192 10.160 ( 0.494 2.597 -4.331) 5.074 10.268 ( 1.139 -2.275 -3.256) 4.132 10.519 ( -1.684 -1.354 -5.821) 6.209 10.781 ( -3.157 -0.330 6.705) 7.419 11.071 ( 0.606 4.756 8.154) 9.459 11.248 ( -1.774 -0.295 4.612) 4.950 11.495 ( -4.891 -3.606 -1.376) 6.230 11.683 ( 4.014 -0.929 4.206) 5.887 12.536 ( 1.797 -1.430 0.182) 2.304 12.669 ( 0.281 -1.381 -6.021) 6.183 12.900 ( 2.515 3.304 3.190) 5.236 13.554 ( 15.838 18.529 -0.188) 24.376 14.202 ( -13.749 1.676 2.633) 14.099 15.354 ( 2.621 -0.011 5.947) 6.499 15.818 ( 2.971 0.110 0.651) 3.043 16.006 ( -15.552 -14.286 -10.412) 23.545 ======================= Grid point 100 (40/160) ======================= q-point: (-0.33 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.173 ( -12.977 9.990 14.073) 21.592 1.298 ( -18.154 13.008 1.809) 22.407 1.797 ( -4.339 4.207 -1.652) 6.266 2.132 ( -10.159 -1.335 1.131) 10.308 2.394 ( -14.773 11.155 18.823) 26.401 2.639 ( -10.824 4.450 1.840) 11.847 2.695 ( -3.056 -0.758 3.528) 4.729 2.779 ( -4.183 -1.646 5.014) 6.734 3.024 ( 5.467 -2.584 7.702) 9.792 3.312 ( 0.275 3.479 6.335) 7.233 3.447 ( -4.370 1.322 -10.472) 11.424 3.494 ( 1.171 -4.015 -0.720) 4.244 3.594 ( 6.374 -3.481 0.379) 7.273 3.842 ( 4.632 -3.748 1.581) 6.164 3.920 ( 7.637 -0.649 -5.204) 9.264 4.138 ( 4.603 -3.426 0.730) 5.784 4.385 ( 0.053 -6.216 -0.953) 6.289 4.544 ( -0.877 2.277 2.335) 3.377 4.593 ( -0.745 0.169 -2.711) 2.817 4.946 ( 2.801 8.448 -13.073) 15.815 4.998 ( -2.095 -8.492 -8.037) 11.878 5.117 ( -2.855 -0.712 -5.606) 6.332 5.461 ( 1.961 -2.476 11.362) 11.793 5.733 ( -0.833 1.231 4.814) 5.038 5.838 ( 1.268 -2.021 2.086) 3.169 5.967 ( 0.923 -0.969 5.154) 5.325 6.253 ( 6.230 -5.264 19.304) 20.956 6.666 ( 8.570 -0.096 -1.485) 8.698 6.767 ( 6.635 1.470 -0.087) 6.796 7.231 ( 0.927 -1.013 -2.535) 2.883 7.403 ( -1.087 -2.323 -5.027) 5.644 8.606 ( -2.303 4.099 7.597) 8.935 8.666 ( -0.728 -3.731 4.013) 5.527 9.015 ( 0.071 -0.289 -6.250) 6.257 9.134 ( -3.665 -5.530 -7.330) 9.886 9.219 ( -2.611 0.334 0.640) 2.709 9.370 ( 1.079 -0.810 -2.326) 2.689 9.620 ( 0.814 -1.672 5.346) 5.660 10.146 ( 2.454 4.231 -2.503) 5.494 10.322 ( 1.704 -3.154 -1.884) 4.050 10.504 ( -0.964 -1.097 -7.091) 7.240 10.743 ( -2.143 -1.560 6.490) 7.010 11.042 ( 1.128 4.691 7.094) 8.579 11.226 ( -1.134 -0.245 8.479) 8.558 11.423 ( -6.489 -2.596 -1.629) 7.176 11.796 ( 7.914 -1.320 4.261) 9.085 12.616 ( 6.371 0.335 -0.520) 6.401 12.694 ( 0.977 -2.562 -4.643) 5.392 12.904 ( 3.291 5.925 3.939) 7.839 13.566 ( 5.879 16.134 -0.072) 17.172 13.923 ( -13.748 6.976 0.215) 15.418 15.400 ( 2.780 0.969 5.820) 6.522 15.855 ( -11.904 -9.723 -2.577) 15.584 15.880 ( -6.917 -11.114 -10.190) 16.589 ======================= Grid point 101 (41/160) ======================= q-point: (-0.22 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.863 ( -13.051 16.296 9.220) 22.823 0.873 ( -11.793 10.366 15.018) 21.727 1.627 ( -8.451 15.094 -1.184) 17.339 1.884 ( -10.760 12.263 19.052) 25.083 2.100 ( -8.773 -2.253 10.710) 14.026 2.414 ( -10.158 3.725 -3.755) 11.453 2.649 ( -3.919 -0.213 6.222) 7.356 2.750 ( 0.668 0.277 -0.012) 0.723 3.076 ( 0.389 1.427 5.066) 5.278 3.220 ( -5.020 3.588 0.748) 6.215 3.430 ( -0.394 -4.060 -9.791) 10.607 3.629 ( 5.706 -6.753 8.325) 12.143 3.726 ( 5.682 -3.368 3.699) 7.570 3.936 ( 4.553 0.074 -6.958) 8.316 4.062 ( 4.937 -3.536 -0.278) 6.079 4.248 ( 4.095 -2.723 -0.323) 4.928 4.445 ( 0.598 -2.123 1.653) 2.756 4.529 ( 2.238 0.724 0.223) 2.362 4.583 ( -0.214 0.095 -4.399) 4.406 4.892 ( -0.456 6.399 -8.777) 10.872 4.990 ( -6.754 -5.816 -7.053) 11.366 5.071 ( -1.622 1.448 -10.460) 10.684 5.528 ( 2.324 -2.949 7.002) 7.945 5.699 ( -0.791 2.000 3.679) 4.261 5.870 ( -0.279 -1.777 3.904) 4.299 5.989 ( 0.798 -0.865 0.933) 1.502 6.434 ( 3.869 -11.202 23.673) 26.474 6.800 ( 4.446 0.257 -2.437) 5.076 6.936 ( 16.228 -2.323 11.890) 20.252 7.256 ( 0.841 -1.049 -2.302) 2.666 7.411 ( -0.361 -1.943 -5.643) 5.979 8.537 ( -1.480 2.140 7.923) 8.339 8.716 ( 1.324 -6.326 5.606) 8.556 9.026 ( -1.447 -2.335 -3.213) 4.227 9.087 ( -6.393 -6.711 -5.981) 11.031 9.170 ( -2.775 0.152 0.808) 2.894 9.373 ( -1.604 0.184 -1.961) 2.540 9.660 ( 2.131 -0.456 1.595) 2.700 10.158 ( 4.101 5.646 0.217) 6.982 10.374 ( 0.273 -4.173 -2.296) 4.771 10.516 ( 0.634 -2.552 -5.178) 5.807 10.752 ( 0.560 -2.646 4.940) 5.632 11.025 ( 1.373 3.162 6.705) 7.539 11.229 ( -0.153 -2.179 14.473) 14.637 11.353 ( -2.346 -1.304 0.066) 2.685 11.979 ( 12.098 -1.979 4.367) 13.013 12.677 ( 1.537 1.166 -3.254) 3.783 12.786 ( 3.485 -3.581 -1.108) 5.118 12.926 ( 11.681 10.281 3.492) 15.948 13.480 ( -3.039 4.438 0.099) 5.379 13.625 ( -7.386 15.371 -1.107) 17.090 15.400 ( -5.022 0.446 -0.625) 5.080 15.616 ( -28.819 -16.514 -12.104) 35.352 15.914 ( 1.279 -0.112 -2.765) 3.048 ======================= Grid point 102 (42/160) ======================= q-point: (-0.11 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.614 ( 6.367 16.733 13.869) 22.647 0.672 ( 1.867 12.874 20.363) 24.163 1.204 ( -9.602 25.142 22.874) 35.321 1.798 ( 3.098 3.020 16.696) 17.248 2.110 ( 6.277 -7.470 1.649) 9.896 2.255 ( -3.032 1.649 -6.330) 7.210 2.577 ( -3.152 0.560 0.942) 3.337 2.786 ( 3.033 0.762 0.914) 3.258 3.045 ( -1.249 2.298 4.298) 5.031 3.117 ( -3.815 1.662 -1.149) 4.317 3.462 ( -0.002 -2.717 -5.527) 6.159 3.766 ( 2.874 -5.276 10.463) 12.065 3.859 ( 5.950 -2.725 6.471) 9.204 3.978 ( 0.316 -0.903 -9.847) 9.894 4.141 ( 1.337 -1.635 1.177) 2.418 4.295 ( 0.102 2.971 -3.837) 4.853 4.410 ( -3.540 1.454 2.747) 4.711 4.573 ( 0.225 -0.023 -3.575) 3.582 4.614 ( 3.567 -1.980 -1.742) 4.436 4.815 ( -4.265 1.589 -4.044) 6.089 4.919 ( -2.430 -1.109 -3.442) 4.357 5.041 ( 2.048 4.337 -12.687) 13.563 5.594 ( 1.616 -3.481 3.349) 5.094 5.682 ( 0.707 1.235 1.952) 2.416 5.855 ( -2.777 -0.220 4.973) 5.700 6.014 ( 1.161 -0.722 -1.706) 2.186 6.568 ( -1.972 -11.920 11.644) 16.780 6.823 ( 0.084 2.074 -4.355) 4.824 7.208 ( -0.381 -8.330 12.323) 14.879 7.285 ( -0.290 -1.770 3.399) 3.844 7.456 ( 4.192 -4.047 -0.688) 5.868 8.560 ( 4.238 -1.967 5.758) 7.415 8.879 ( 9.115 -8.844 4.700) 13.542 8.989 ( -7.081 -10.601 6.551) 14.333 9.085 ( -4.220 -5.682 -4.403) 8.335 9.146 ( 2.436 1.031 -2.676) 3.763 9.319 ( -4.308 -0.220 -0.486) 4.341 9.668 ( -2.322 -0.129 -1.427) 2.728 10.149 ( 0.800 5.900 2.285) 6.377 10.425 ( 0.017 -6.600 -1.794) 6.839 10.576 ( 1.602 -6.053 -0.827) 6.315 10.788 ( 0.428 -1.171 2.169) 2.502 11.034 ( 1.340 0.088 4.188) 4.398 11.223 ( -4.076 -4.049 4.944) 7.579 11.474 ( 7.523 -12.610 20.758) 25.427 12.228 ( 3.288 -14.710 6.580) 16.447 12.677 ( 0.572 1.321 -1.865) 2.356 12.786 ( -2.930 -0.723 0.657) 3.088 13.100 ( 1.807 8.090 0.802) 8.328 13.419 ( 16.056 2.822 -1.353) 16.358 13.517 ( 2.540 3.976 1.648) 4.998 14.876 ( -30.901 23.207 -32.331) 50.385 15.449 ( -2.972 0.472 7.214) 7.817 15.916 ( -0.269 1.135 -1.301) 1.747 ======================= Grid point 105 (43/160) ======================= q-point: ( 0.22 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.358 ( 16.043 -0.000 -5.710) 17.029 1.478 ( 10.939 -0.000 14.647) 18.282 2.025 ( 10.800 -0.000 5.978) 12.344 2.394 ( -7.718 0.000 -5.430) 9.437 2.581 ( 6.087 -0.000 7.090) 9.344 2.611 ( 3.530 -0.000 4.826) 5.979 2.892 ( 2.184 -0.000 -2.286) 3.161 2.940 ( 6.309 -0.000 -3.057) 7.011 2.972 ( -2.171 0.000 5.253) 5.684 3.013 ( 3.263 -0.000 7.956) 8.599 3.455 ( 5.598 -0.000 0.327) 5.608 3.515 ( -6.869 0.000 0.674) 6.902 3.729 ( -3.256 0.000 -0.426) 3.283 3.948 ( -3.377 0.000 -0.798) 3.470 3.974 ( -3.079 0.000 1.816) 3.575 4.022 ( -4.826 0.000 6.729) 8.281 4.282 ( -4.642 0.000 -6.449) 7.946 4.329 ( -1.916 0.000 3.839) 4.290 4.744 ( -1.849 0.000 5.134) 5.456 4.775 ( 4.487 -0.000 -7.026) 8.336 5.190 ( 0.369 -0.000 -7.475) 7.484 5.235 ( -2.875 0.000 -2.901) 4.085 5.456 ( 0.680 -0.000 -7.384) 7.415 5.645 ( -6.036 0.000 8.976) 10.817 5.837 ( 2.548 -0.000 3.577) 4.392 5.934 ( -4.195 0.000 13.610) 14.242 6.056 ( -0.788 0.000 -0.523) 0.946 6.531 ( 0.348 -0.000 -0.701) 0.783 6.564 ( -3.771 0.000 0.512) 3.806 7.203 ( -0.977 0.000 -1.950) 2.181 7.431 ( -1.879 0.000 -3.517) 3.988 8.693 ( -1.779 0.000 7.300) 7.513 8.829 ( 2.241 -0.000 11.651) 11.865 8.875 ( 1.577 -0.000 -13.864) 13.953 9.149 ( -5.897 0.000 -3.229) 6.724 9.280 ( 0.396 -0.000 -1.622) 1.670 9.323 ( 2.735 -0.000 -2.541) 3.733 9.383 ( 1.415 -0.000 -1.852) 2.331 10.037 ( 3.490 -0.000 -2.782) 4.463 10.371 ( -4.375 0.000 -1.786) 4.725 10.485 ( -0.514 0.000 -6.442) 6.462 10.874 ( -1.711 0.000 7.811) 7.996 11.175 ( -0.928 0.000 14.135) 14.165 11.361 ( 0.103 -0.000 -2.714) 2.716 11.369 ( 4.498 -0.000 3.420) 5.650 11.661 ( -3.919 0.000 0.907) 4.022 12.576 ( -6.624 0.000 -1.299) 6.750 12.667 ( -1.178 0.000 -8.143) 8.227 12.825 ( 3.144 -0.000 3.303) 4.560 13.195 ( 22.332 -0.000 1.876) 22.411 14.451 ( 1.972 -0.000 8.248) 8.480 15.305 ( -0.171 0.000 5.436) 5.439 15.774 ( -0.492 0.000 1.785) 1.852 16.236 ( -6.788 0.000 -18.595) 19.795 ======================= Grid point 106 (44/160) ======================= q-point: ( 0.33 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.588 ( 6.244 0.746 8.356) 10.458 1.628 ( 8.501 -2.700 -2.049) 9.152 2.216 ( -9.739 2.901 -1.246) 10.238 2.247 ( 11.624 -3.159 1.773) 12.175 2.534 ( -8.570 0.836 8.526) 12.118 2.652 ( 0.693 -0.401 12.927) 12.952 2.852 ( -1.811 3.051 0.598) 3.598 2.899 ( -6.708 -1.974 1.744) 7.207 3.024 ( -2.881 0.581 7.160) 7.740 3.106 ( 8.168 -2.600 -0.107) 8.572 3.450 ( 2.474 4.530 -3.241) 6.094 3.555 ( 2.523 -3.445 -1.763) 4.620 3.710 ( 0.887 3.642 0.144) 3.751 3.856 ( 0.348 9.611 1.395) 9.718 3.910 ( -1.594 -1.915 -0.614) 2.566 4.055 ( -2.933 -9.754 -0.454) 10.195 4.161 ( -6.814 3.987 -1.284) 7.999 4.329 ( -2.441 -9.704 2.816) 10.395 4.689 ( -4.188 0.297 4.122) 5.884 4.841 ( 3.920 1.316 -6.492) 7.697 5.169 ( -2.092 2.312 -6.944) 7.612 5.182 ( -0.465 1.951 -6.680) 6.975 5.475 ( -0.257 1.545 1.452) 2.136 5.566 ( -2.201 -3.074 8.825) 9.600 5.866 ( 1.052 0.853 4.854) 5.040 5.901 ( -0.312 -0.140 8.511) 8.518 6.069 ( 2.123 0.047 -0.938) 2.322 6.530 ( -0.079 0.184 -0.193) 0.279 6.576 ( 4.414 -0.469 -0.626) 4.483 7.191 ( -0.429 -0.261 -1.817) 1.885 7.398 ( -2.206 -0.594 -3.795) 4.430 8.659 ( -2.021 0.491 5.826) 6.186 8.843 ( 1.291 4.092 11.403) 12.184 8.934 ( 4.226 -1.595 -13.007) 13.769 9.069 ( -3.899 -0.765 -4.997) 6.384 9.280 ( 0.028 0.245 -2.388) 2.401 9.334 ( -1.421 -0.784 -2.851) 3.281 9.429 ( 1.746 -3.478 3.160) 5.013 10.119 ( 5.309 -0.749 -3.723) 6.528 10.289 ( -4.501 0.607 -2.001) 4.963 10.488 ( -0.193 -1.344 -5.928) 6.081 10.831 ( -3.532 -0.094 8.016) 8.760 11.163 ( -0.180 1.187 13.980) 14.032 11.317 ( -1.744 3.120 -2.312) 4.257 11.437 ( 0.152 -3.207 0.713) 3.289 11.622 ( -0.880 -0.863 2.516) 2.802 12.504 ( -1.980 -0.580 -0.167) 2.070 12.650 ( -0.673 -0.278 -7.544) 7.580 12.888 ( 4.035 0.199 3.017) 5.042 13.593 ( 26.286 6.197 -0.786) 27.018 14.400 ( -7.450 0.045 5.322) 9.156 15.311 ( 0.376 -0.427 5.785) 5.813 15.787 ( 1.898 0.295 2.124) 2.864 16.041 ( -16.140 -2.525 -12.825) 20.770 ======================= Grid point 107 (45/160) ======================= q-point: (-0.56 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.549 ( -6.396 3.488 13.731) 15.544 1.779 ( 5.351 0.265 -8.037) 9.659 1.966 ( -13.076 9.426 0.827) 16.141 2.314 ( -10.289 -3.072 -0.863) 10.773 2.527 ( 9.330 -0.341 12.529) 15.625 2.651 ( -2.760 -2.924 7.087) 8.148 2.787 ( -5.411 -2.318 6.048) 8.440 2.819 ( -2.581 -1.016 3.679) 4.608 2.925 ( -5.633 0.786 9.557) 11.122 3.275 ( 8.048 -1.732 0.588) 8.253 3.456 ( 2.843 3.874 -3.687) 6.057 3.586 ( -2.785 2.817 -0.856) 4.053 3.671 ( 1.647 0.635 -2.133) 2.768 3.835 ( 2.471 6.977 1.452) 7.543 3.882 ( -10.716 3.846 -5.975) 12.858 3.954 ( 2.436 -3.237 -0.217) 4.057 4.161 ( -0.566 -8.277 1.249) 8.390 4.435 ( 0.772 -12.175 0.590) 12.214 4.620 ( -2.943 0.779 3.714) 4.802 4.872 ( 1.221 1.036 -6.560) 6.752 5.116 ( -1.769 0.603 -7.095) 7.337 5.154 ( 1.059 5.094 -9.472) 10.807 5.434 ( -0.737 2.024 13.498) 13.669 5.622 ( 1.479 -5.727 1.165) 6.028 5.858 ( -0.357 1.744 5.339) 5.628 5.918 ( 1.105 -0.793 7.503) 7.625 6.118 ( 3.138 -0.444 2.999) 4.363 6.563 ( 4.307 0.297 -1.341) 4.520 6.675 ( 6.685 0.047 -0.562) 6.708 7.194 ( 0.245 -0.696 -2.035) 2.165 7.370 ( -2.070 -1.459 -4.121) 4.837 8.625 ( -1.888 -0.423 4.835) 5.208 8.796 ( -1.355 5.586 8.909) 10.603 9.014 ( 1.580 -2.985 -15.073) 15.447 9.025 ( -2.488 -1.399 -1.906) 3.432 9.280 ( 0.544 1.631 -1.701) 2.419 9.318 ( -0.385 -1.217 -2.308) 2.637 9.497 ( 1.226 -4.969 5.800) 7.736 10.199 ( 1.119 1.368 -3.397) 3.829 10.234 ( 1.385 -1.124 -2.856) 3.367 10.494 ( -0.428 -1.002 -5.608) 5.713 10.765 ( -4.820 -0.942 7.651) 9.091 11.148 ( 0.199 2.609 12.634) 12.903 11.263 ( -1.389 1.934 -0.503) 2.434 11.435 ( -3.537 -2.577 -0.842) 4.456 11.649 ( 2.173 -2.154 3.311) 4.508 12.522 ( 3.629 -0.147 0.273) 3.642 12.648 ( -0.035 -0.764 -6.641) 6.685 12.952 ( 4.603 1.940 3.644) 6.183 13.872 ( 13.197 12.179 -1.208) 17.998 14.254 ( -4.533 4.018 1.258) 6.187 15.329 ( -0.039 -2.694 5.895) 6.481 15.761 ( -18.891 -7.668 -9.523) 22.502 15.835 ( 0.652 -0.799 1.885) 2.149 ======================= Grid point 108 (46/160) ======================= q-point: (-0.44 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( -11.197 7.244 12.291) 18.136 1.595 ( -13.897 16.460 2.290) 21.663 1.804 ( -3.289 -2.529 -4.094) 5.828 2.166 ( -6.238 3.791 2.598) 7.748 2.534 ( -7.184 2.629 10.214) 12.761 2.639 ( -4.374 -2.162 4.704) 6.778 2.726 ( -4.582 0.138 8.639) 9.780 2.763 ( -3.565 0.598 1.324) 3.849 2.971 ( 8.452 -2.530 8.241) 12.073 3.354 ( 1.319 0.949 4.541) 4.823 3.452 ( -6.978 0.807 -4.057) 8.113 3.506 ( 0.063 0.397 -2.282) 2.318 3.598 ( -1.763 8.679 -1.503) 8.983 3.768 ( 4.580 -3.982 1.799) 6.330 3.898 ( 2.626 -2.521 -5.214) 6.359 4.059 ( 4.374 -4.030 0.495) 5.968 4.245 ( 1.843 -7.285 -1.924) 7.757 4.539 ( 0.206 -6.590 -0.401) 6.605 4.581 ( -0.655 1.433 4.047) 4.343 4.871 ( -2.006 -3.067 -6.993) 7.895 5.093 ( -2.852 -1.930 -4.436) 5.616 5.113 ( 2.712 8.178 -14.166) 16.581 5.434 ( 1.401 -0.146 12.094) 12.176 5.700 ( 1.102 -4.813 3.053) 5.805 5.831 ( -0.789 1.343 4.505) 4.767 5.945 ( 0.729 -1.144 7.357) 7.481 6.181 ( 2.594 -2.403 11.427) 11.962 6.665 ( 7.756 0.061 -2.163) 8.052 6.788 ( 7.036 0.809 -0.470) 7.098 7.211 ( 0.649 -1.045 -2.456) 2.747 7.358 ( -1.273 -2.152 -4.607) 5.242 8.608 ( -1.570 -2.084 4.038) 4.808 8.704 ( -3.041 5.456 6.860) 9.278 8.991 ( -4.138 -2.982 -2.224) 5.564 9.028 ( -3.236 -3.823 -12.146) 13.138 9.253 ( -1.022 2.301 -0.741) 2.625 9.357 ( 2.728 -0.462 -2.339) 3.622 9.571 ( 2.806 -3.132 5.527) 6.945 10.180 ( -0.610 -1.070 -2.146) 2.474 10.311 ( 5.807 2.127 -2.777) 6.779 10.490 ( -0.525 -0.311 -6.387) 6.416 10.702 ( -4.164 -2.196 7.063) 8.488 11.124 ( 0.266 3.654 10.402) 11.028 11.233 ( -0.588 0.985 3.839) 4.006 11.381 ( -4.784 -1.815 -1.809) 5.427 11.739 ( 4.883 -3.977 3.327) 7.123 12.624 ( 8.298 0.491 -0.566) 8.332 12.660 ( 0.463 -1.109 -5.837) 5.959 13.009 ( 6.054 4.585 4.876) 9.025 13.762 ( -11.572 4.521 0.415) 12.430 14.181 ( 3.772 18.646 -2.141) 19.144 15.369 ( -2.469 -9.198 3.736) 10.230 15.522 ( -17.311 -9.518 -7.325) 21.070 15.877 ( 2.887 0.404 0.947) 3.065 ======================= Grid point 109 (47/160) ======================= q-point: (-0.33 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.059 ( -12.164 8.905 12.903) 19.843 1.241 ( -5.211 20.446 5.820) 21.888 1.763 ( -2.632 -1.247 -3.050) 4.217 2.039 ( -2.330 6.861 3.575) 8.080 2.275 ( -13.815 14.898 17.479) 26.802 2.481 ( -10.721 2.856 -2.501) 11.374 2.645 ( -4.321 0.057 8.282) 9.341 2.756 ( 2.193 0.213 0.309) 2.225 3.112 ( 5.337 1.788 8.191) 9.938 3.284 ( -5.766 2.172 1.182) 6.274 3.382 ( -3.718 0.496 -7.131) 8.058 3.487 ( 4.527 -6.342 4.048) 8.781 3.660 ( 4.326 -2.919 1.329) 5.386 3.895 ( 3.770 -3.894 -2.605) 6.014 3.979 ( 2.730 -5.451 -2.822) 6.718 4.163 ( 2.285 -5.750 -0.595) 6.216 4.366 ( 5.283 -4.510 -0.616) 6.973 4.558 ( -0.072 1.503 3.793) 4.081 4.575 ( -0.594 -1.352 -3.275) 3.592 4.864 ( -3.550 -5.272 -4.795) 7.961 5.017 ( -4.102 3.204 -5.913) 7.877 5.111 ( 3.369 4.189 -14.789) 15.736 5.477 ( 1.850 -2.051 8.628) 9.059 5.728 ( -0.667 0.080 4.543) 4.592 5.825 ( -0.391 -2.202 3.387) 4.059 5.967 ( 0.485 -1.260 4.913) 5.095 6.261 ( 1.319 -6.431 21.255) 22.246 6.793 ( 5.564 -0.635 -1.420) 5.778 6.911 ( 8.572 -0.538 2.319) 8.897 7.233 ( 0.674 -1.256 -2.579) 2.947 7.368 ( -0.055 -2.310 -5.230) 5.717 8.594 ( -3.516 1.711 4.129) 5.686 8.627 ( 0.118 -1.142 5.914) 6.024 8.920 ( -8.427 -5.799 0.018) 10.230 9.025 ( 0.226 -1.656 -11.042) 11.168 9.208 ( -1.463 2.233 -0.816) 2.792 9.382 ( -0.069 0.566 -1.990) 2.070 9.643 ( 2.433 -1.202 2.914) 3.982 10.205 ( 1.457 -2.196 -1.651) 3.110 10.367 ( 4.157 4.452 -1.054) 6.182 10.487 ( -0.113 -0.626 -6.873) 6.902 10.682 ( -1.543 -3.824 6.225) 7.467 11.084 ( -1.595 2.984 8.401) 9.057 11.224 ( 0.118 0.796 8.607) 8.645 11.332 ( -1.426 -0.844 -1.061) 1.967 11.884 ( 5.497 -6.629 2.842) 9.069 12.679 ( 0.706 -0.885 -5.166) 5.289 12.764 ( 7.102 0.752 -1.351) 7.268 13.103 ( 14.151 7.843 4.887) 16.901 13.526 ( -10.650 1.746 -0.313) 10.797 13.943 ( -11.083 15.997 -0.449) 19.467 15.297 ( -18.389 -12.147 -12.253) 25.216 15.451 ( 1.913 0.119 5.804) 6.112 15.918 ( 2.151 0.288 -0.828) 2.322 ======================= Grid point 110 (48/160) ======================= q-point: (-0.22 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.883 ( 5.863 11.390 17.805) 21.934 1.036 ( 5.006 21.919 6.777) 23.483 1.700 ( -3.049 17.844 0.565) 18.111 1.896 ( -2.917 9.895 16.931) 19.826 2.010 ( 0.379 -0.508 8.664) 8.688 2.299 ( -6.389 2.846 -6.042) 9.242 2.582 ( -2.937 -0.025 3.426) 4.512 2.803 ( 3.045 0.684 0.646) 3.187 3.114 ( -1.416 4.522 7.296) 8.700 3.160 ( -3.081 3.143 -0.909) 4.494 3.397 ( 1.100 -3.545 -5.942) 7.006 3.639 ( 3.792 -7.583 7.666) 11.430 3.775 ( 5.034 -4.888 4.771) 8.485 3.928 ( -4.028 -4.520 -8.579) 10.500 4.085 ( 3.041 -4.412 0.577) 5.390 4.248 ( 0.443 -6.224 -3.592) 7.200 4.432 ( -2.352 0.407 2.199) 3.246 4.563 ( -1.691 -1.084 -3.523) 4.055 4.580 ( 3.704 -1.202 0.833) 3.982 4.851 ( -1.607 -0.914 -3.587) 4.035 4.921 ( -2.044 2.863 -5.435) 6.474 5.129 ( 4.105 4.681 -15.115) 16.347 5.527 ( 0.703 -3.162 5.674) 6.533 5.707 ( -0.357 1.292 3.682) 3.919 5.834 ( -1.765 -2.133 3.366) 4.359 5.992 ( 0.845 -1.466 1.070) 2.001 6.342 ( -2.242 -9.938 24.676) 26.697 6.843 ( 0.431 0.199 -2.198) 2.249 7.058 ( 1.778 -5.636 10.078) 11.683 7.256 ( 0.345 -1.448 -0.999) 1.793 7.400 ( 1.455 -2.339 -5.005) 5.713 8.540 ( -0.200 0.384 5.176) 5.194 8.700 ( 3.988 -6.413 8.189) 11.140 8.855 ( -3.618 -4.073 0.389) 5.462 9.049 ( 0.253 -1.677 -10.022) 10.165 9.173 ( 0.012 1.459 -1.382) 2.010 9.350 ( -1.519 2.256 -1.836) 3.281 9.655 ( -2.612 -0.880 0.492) 2.800 10.248 ( 1.059 -0.165 -0.821) 1.350 10.357 ( -0.305 3.402 -2.118) 4.019 10.503 ( 0.800 -2.148 -3.840) 4.472 10.718 ( 0.095 -4.964 4.596) 6.765 11.029 ( -2.484 0.190 7.355) 7.766 11.208 ( -0.799 1.609 6.967) 7.195 11.377 ( 4.893 -1.708 7.088) 8.780 12.011 ( -1.799 -9.806 2.138) 10.196 12.697 ( 0.885 0.171 -4.387) 4.479 12.797 ( -1.314 1.651 -0.288) 2.130 13.280 ( -1.474 9.466 1.358) 9.676 13.458 ( 13.919 2.192 2.729) 14.352 13.612 ( -6.965 5.465 0.327) 8.859 15.088 ( -7.844 3.340 -19.219) 21.025 15.459 ( -1.035 0.592 5.957) 6.075 15.933 ( -0.104 0.561 -1.658) 1.753 ======================= Grid point 111 (49/160) ======================= q-point: (-0.11 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.956 ( 12.085 16.833 11.873) 23.882 1.022 ( 13.620 17.577 12.855) 25.684 1.465 ( 12.560 22.040 13.344) 28.663 1.876 ( 2.846 4.616 11.999) 13.167 2.128 ( 3.191 -4.146 -4.147) 6.676 2.289 ( 8.218 -6.615 -1.295) 10.628 2.567 ( 1.165 -1.016 -1.289) 2.013 2.819 ( -0.974 0.653 -1.729) 2.089 3.037 ( -2.408 1.312 8.062) 8.516 3.114 ( 0.700 5.036 -0.088) 5.085 3.441 ( 0.489 -2.152 -2.769) 3.541 3.744 ( 0.402 -5.525 6.024) 8.184 3.880 ( -5.114 -5.748 -5.993) 9.752 3.915 ( 4.406 -5.345 7.083) 9.907 4.145 ( 0.403 -1.089 1.568) 1.952 4.229 ( -8.535 -0.531 -2.664) 8.957 4.366 ( -2.106 -1.127 -0.679) 2.483 4.547 ( -1.690 -1.207 -1.870) 2.795 4.634 ( 1.084 -0.506 0.450) 1.278 4.808 ( -0.084 5.306 -7.258) 8.991 4.945 ( 4.263 -2.143 -4.015) 6.236 5.157 ( 5.313 4.929 -12.075) 14.083 5.566 ( -0.329 -4.205 2.824) 5.076 5.705 ( 1.025 0.262 2.392) 2.615 5.801 ( -3.439 -0.140 2.840) 4.462 6.020 ( 0.689 -1.295 -2.020) 2.497 6.367 ( -7.846 -11.114 23.433) 27.096 6.810 ( -3.397 1.305 -3.153) 4.816 7.006 ( -12.921 -3.201 15.226) 20.224 7.255 ( -1.204 -0.632 -1.441) 1.981 7.447 ( 0.460 -2.910 -2.512) 3.871 8.579 ( 1.700 -4.170 3.785) 5.883 8.776 ( -3.472 -5.766 10.605) 12.561 8.984 ( 7.613 -4.869 -3.105) 9.555 9.049 ( 1.349 -1.762 -6.833) 7.184 9.196 ( 3.284 -0.479 -1.368) 3.589 9.308 ( 0.918 4.104 -1.856) 4.597 9.573 ( -7.689 -0.894 -0.816) 7.784 10.186 ( -3.949 6.665 1.732) 7.938 10.352 ( -0.884 -5.261 -3.084) 6.162 10.552 ( 1.284 -3.638 -2.576) 4.638 10.766 ( 0.373 -3.670 3.469) 5.064 11.026 ( 0.344 -3.885 7.045) 8.053 11.181 ( -0.002 2.291 5.256) 5.733 11.492 ( 3.974 -3.325 12.681) 13.699 11.949 ( -14.797 -5.280 2.816) 15.961 12.666 ( -5.101 1.205 -3.245) 6.165 12.752 ( -1.030 -0.588 -3.003) 3.228 12.962 ( -12.535 8.341 5.182) 15.923 13.475 ( -5.125 11.002 0.709) 12.158 13.798 ( 17.872 4.938 6.405) 19.617 15.224 ( 27.600 -2.781 -31.274) 41.803 15.429 ( 1.281 1.318 4.575) 4.930 15.906 ( -2.083 0.697 -1.173) 2.490 ======================= Grid point 115 (50/160) ======================= q-point: (-0.67 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.585 ( -4.396 0.000 13.223) 13.935 1.768 ( 3.956 -0.000 -6.952) 7.999 2.127 ( -0.966 0.000 -1.584) 1.855 2.222 ( -14.525 0.000 -3.214) 14.876 2.535 ( 8.637 -0.000 13.703) 16.198 2.617 ( -3.014 0.000 7.989) 8.538 2.753 ( -7.724 0.000 6.361) 10.007 2.810 ( -4.515 0.000 3.297) 5.590 2.939 ( -4.625 0.000 11.839) 12.710 3.254 ( 8.689 -0.000 -0.907) 8.736 3.522 ( 1.636 -0.000 -3.825) 4.161 3.588 ( 3.702 -0.000 -2.833) 4.661 3.702 ( -5.012 0.000 -2.201) 5.474 3.831 ( -4.087 0.000 1.367) 4.309 3.934 ( -3.970 0.000 -7.544) 8.525 3.991 ( 6.671 -0.000 -2.092) 6.992 4.136 ( -9.386 0.000 8.002) 12.334 4.218 ( 6.179 -0.000 0.215) 6.182 4.628 ( -2.840 0.000 4.057) 4.953 4.890 ( 0.815 -0.000 -6.706) 6.756 5.106 ( -3.904 0.000 -4.209) 5.741 5.222 ( 1.778 -0.000 -9.200) 9.370 5.503 ( -1.032 0.000 16.575) 16.607 5.514 ( 1.230 -0.000 -5.464) 5.600 5.879 ( -0.240 0.000 5.654) 5.659 5.907 ( 0.756 -0.000 7.300) 7.339 6.114 ( 2.707 -0.000 2.478) 3.670 6.566 ( 4.305 -0.000 -1.322) 4.503 6.676 ( 7.158 -0.000 -0.824) 7.205 7.187 ( 0.116 -0.000 -1.888) 1.891 7.355 ( -2.232 0.000 -3.874) 4.470 8.622 ( -2.568 0.000 4.652) 5.314 8.864 ( -1.724 0.000 12.390) 12.509 8.979 ( 1.107 -0.000 -12.143) 12.193 9.003 ( -3.253 0.000 -7.884) 8.529 9.305 ( 2.524 -0.000 -2.702) 3.697 9.306 ( -0.591 0.000 -2.124) 2.204 9.436 ( 1.738 -0.000 5.718) 5.977 10.211 ( -4.457 0.000 -1.665) 4.758 10.225 ( 7.303 -0.000 -4.215) 8.432 10.484 ( 0.311 -0.000 -5.524) 5.533 10.754 ( -5.226 0.000 7.838) 9.421 11.170 ( 0.056 -0.000 14.628) 14.628 11.297 ( -1.696 0.000 -3.386) 3.787 11.402 ( -2.765 0.000 0.363) 2.788 11.623 ( 1.389 -0.000 2.711) 3.046 12.522 ( 4.237 -0.000 0.259) 4.245 12.640 ( -0.160 0.000 -6.802) 6.804 12.971 ( 5.482 -0.000 3.684) 6.605 13.985 ( 5.138 -0.000 -0.205) 5.142 14.316 ( 7.767 -0.000 -0.874) 7.816 15.287 ( -5.276 0.000 5.207) 7.413 15.683 ( -21.182 0.000 -8.005) 22.644 15.833 ( 2.974 -0.000 2.083) 3.631 ======================= Grid point 117 (51/160) ======================= q-point: (-0.56 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.444 ( -10.980 2.765 11.518) 16.151 1.744 ( -5.371 -1.566 -0.907) 5.668 1.889 ( -12.997 10.513 0.304) 16.719 2.210 ( 4.137 0.117 -3.171) 5.214 2.526 ( -8.356 -1.963 8.056) 11.771 2.589 ( -2.091 -2.134 4.487) 5.391 2.722 ( -1.730 0.620 8.452) 8.649 2.750 ( -2.044 -1.769 6.323) 6.877 2.949 ( 7.489 0.085 8.983) 11.695 3.345 ( 0.955 -1.032 -0.932) 1.686 3.525 ( -8.338 4.833 -2.073) 9.858 3.538 ( 2.534 2.877 -1.549) 4.135 3.688 ( 2.928 -3.361 -0.729) 4.516 3.801 ( -2.512 -5.001 -1.974) 5.935 3.817 ( -5.171 9.622 -0.861) 10.957 3.999 ( -3.101 -3.692 3.327) 5.858 4.145 ( 8.362 -1.740 -3.986) 9.425 4.382 ( 5.686 -7.111 0.273) 9.109 4.599 ( -0.511 0.478 4.914) 4.963 4.861 ( -3.363 0.638 -6.976) 7.771 5.053 ( -3.045 -1.574 -4.566) 5.709 5.234 ( 1.986 3.501 -9.171) 10.015 5.468 ( 0.874 4.128 8.260) 9.275 5.582 ( 1.021 -6.685 2.619) 7.252 5.859 ( -1.331 1.101 6.111) 6.350 5.926 ( 0.743 -0.723 7.046) 7.122 6.152 ( 1.228 -0.731 8.007) 8.134 6.667 ( 7.185 0.059 -2.426) 7.583 6.799 ( 7.220 0.302 -0.924) 7.285 7.195 ( 0.557 -0.476 -2.241) 2.358 7.327 ( -1.341 -0.877 -4.352) 4.637 8.582 ( -2.481 -0.681 3.831) 4.615 8.799 ( -3.498 3.601 9.128) 10.417 8.922 ( -7.030 -2.618 -2.045) 7.775 8.985 ( -0.798 -1.343 -15.146) 15.227 9.292 ( -1.287 1.242 -1.560) 2.373 9.356 ( 3.447 0.320 -1.565) 3.799 9.513 ( 5.378 -2.207 5.686) 8.132 10.152 ( -2.646 -0.971 -0.991) 2.988 10.351 ( 8.143 1.268 -5.388) 9.846 10.490 ( 0.467 0.111 -5.073) 5.096 10.670 ( -4.993 -0.875 6.937) 8.592 11.170 ( 0.109 1.013 15.100) 15.134 11.269 ( -0.341 2.336 -1.622) 2.864 11.347 ( -4.165 -1.692 -1.137) 4.637 11.670 ( 2.819 -2.321 2.324) 4.328 12.634 ( 7.691 0.500 -1.646) 7.881 12.645 ( 1.642 -0.565 -5.024) 5.316 13.072 ( 7.543 1.757 4.929) 9.180 13.805 ( -15.893 0.788 1.093) 15.951 14.550 ( 13.287 16.840 -4.944) 22.013 15.065 ( -22.318 -15.757 -2.006) 27.393 15.481 ( -3.263 0.080 1.343) 3.530 15.882 ( 2.833 0.156 1.190) 3.077 ======================= Grid point 118 (52/160) ======================= q-point: (-0.44 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.198 ( -11.356 5.247 12.473) 17.666 1.603 ( -3.959 15.278 2.725) 16.016 1.694 ( -4.060 -3.670 0.565) 5.502 2.189 ( -1.259 7.989 4.399) 9.206 2.454 ( -2.097 1.679 4.691) 5.406 2.512 ( -9.186 0.468 0.441) 9.209 2.663 ( -4.737 1.772 6.011) 7.855 2.739 ( 0.666 -2.011 1.088) 2.382 3.125 ( 9.938 -0.215 9.973) 14.081 3.342 ( -4.787 4.455 1.597) 6.731 3.351 ( -2.726 -2.735 2.448) 4.572 3.505 ( -2.675 5.172 -1.639) 6.049 3.657 ( 0.836 4.005 -0.554) 4.129 3.802 ( 0.475 -5.083 -1.610) 5.353 3.854 ( 2.431 -6.674 -2.126) 7.414 4.032 ( -0.927 -7.763 0.886) 7.869 4.304 ( 8.261 -1.673 -1.713) 8.601 4.510 ( 2.127 -4.253 -3.025) 5.637 4.590 ( -0.206 1.114 4.843) 4.974 4.797 ( -3.363 -1.739 -5.335) 6.542 5.021 ( -2.579 -1.065 -4.780) 5.535 5.222 ( 2.235 5.297 -11.002) 12.414 5.462 ( 1.143 1.028 6.507) 6.686 5.663 ( 0.916 -5.909 3.957) 7.170 5.821 ( -1.839 1.100 5.986) 6.358 5.945 ( 0.401 -0.950 6.603) 6.683 6.177 ( -0.125 -2.533 14.474) 14.694 6.783 ( 5.557 -0.388 -1.952) 5.903 6.906 ( 5.693 -0.041 -0.500) 5.715 7.211 ( 0.566 -0.883 -2.555) 2.762 7.329 ( 0.215 -1.558 -5.054) 5.293 8.557 ( -1.946 -1.920 3.138) 4.162 8.699 ( -3.235 4.551 6.123) 8.286 8.831 ( -6.427 -3.463 -0.008) 7.300 8.991 ( 0.061 -1.779 -13.590) 13.706 9.244 ( -2.456 1.319 -1.052) 2.980 9.395 ( 1.451 0.728 -0.738) 1.783 9.617 ( 3.621 -1.300 3.293) 5.064 10.145 ( -0.390 -2.742 -0.140) 2.773 10.452 ( 4.910 2.164 -6.165) 8.173 10.497 ( 2.048 2.277 -4.182) 5.183 10.620 ( -2.623 -2.425 6.105) 7.074 11.139 ( -2.987 2.502 11.749) 12.378 11.247 ( 0.668 1.526 3.708) 4.065 11.316 ( -0.662 -1.009 -1.242) 1.732 11.758 ( 2.536 -5.566 1.571) 6.315 12.660 ( 0.957 -0.825 -4.810) 4.973 12.785 ( 7.927 0.980 -2.149) 8.272 13.223 ( 15.308 4.369 4.834) 16.637 13.553 ( -11.240 0.974 0.196) 11.284 14.224 ( -25.047 12.337 -0.120) 27.921 15.072 ( -0.510 -10.256 -8.621) 13.408 15.467 ( 0.841 0.839 4.362) 4.521 15.923 ( 2.042 0.200 -0.166) 2.059 ======================= Grid point 119 (53/160) ======================= q-point: (-0.33 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.068 ( 5.077 7.404 16.832) 19.077 1.441 ( 4.662 19.018 2.472) 19.736 1.722 ( 2.576 -4.783 1.357) 5.600 2.084 ( -2.971 5.624 11.841) 13.441 2.254 ( -9.306 15.004 -2.056) 17.775 2.375 ( -3.130 6.946 -0.616) 7.644 2.580 ( -2.779 -0.059 3.677) 4.609 2.792 ( 1.544 -2.449 0.302) 2.911 3.182 ( -5.055 1.949 9.884) 11.271 3.266 ( 4.376 7.454 3.861) 9.467 3.350 ( 0.986 -0.989 -0.211) 1.412 3.505 ( 3.210 -4.586 1.249) 5.735 3.694 ( 3.246 -2.907 1.039) 4.480 3.814 ( -5.317 -6.682 -5.961) 10.413 3.975 ( 3.207 -6.488 -0.933) 7.297 4.103 ( -0.232 -8.330 0.324) 8.339 4.424 ( 1.626 -0.855 1.473) 2.354 4.527 ( -2.152 -2.776 -6.002) 6.954 4.576 ( 0.496 0.653 3.414) 3.511 4.805 ( 1.263 -2.822 -2.640) 4.066 4.977 ( -1.680 2.149 -5.082) 5.768 5.218 ( 3.216 4.209 -12.497) 13.573 5.481 ( 0.540 -1.233 4.571) 4.765 5.711 ( -0.430 -2.207 3.723) 4.349 5.790 ( -1.636 -1.033 5.342) 5.681 5.963 ( 0.370 -1.381 4.469) 4.692 6.203 ( -1.626 -4.687 20.678) 21.265 6.840 ( 0.738 -0.305 -1.099) 1.359 6.985 ( 1.266 -2.319 2.325) 3.519 7.229 ( 0.287 -1.294 -2.117) 2.497 7.359 ( 1.350 -1.833 -5.277) 5.747 8.545 ( -1.919 -1.143 2.355) 3.246 8.646 ( 1.607 1.128 6.491) 6.782 8.792 ( -1.104 -2.683 0.306) 2.918 9.012 ( 0.124 -2.077 -13.107) 13.271 9.197 ( -1.256 0.997 -1.301) 2.065 9.392 ( 0.195 2.006 -0.408) 2.056 9.638 ( -2.548 -0.804 1.195) 2.927 10.180 ( 0.219 -4.034 -0.629) 4.089 10.474 ( 0.614 1.546 -4.131) 4.453 10.497 ( 1.613 5.225 -3.960) 6.752 10.629 ( -0.447 -3.833 4.991) 6.309 11.044 ( -4.974 1.341 8.240) 9.718 11.250 ( 1.075 2.380 5.074) 5.706 11.355 ( 4.019 -1.032 3.696) 5.557 11.836 ( -2.048 -8.059 0.462) 8.328 12.687 ( 1.159 -0.903 -4.149) 4.401 12.835 ( -0.631 1.938 -1.456) 2.504 13.424 ( -2.945 4.563 0.045) 5.431 13.525 ( 17.662 4.936 4.744) 18.942 13.713 ( -13.494 4.669 0.127) 14.279 15.096 ( -2.304 -1.328 -11.838) 12.133 15.472 ( 0.022 0.748 5.065) 5.120 15.940 ( -0.020 0.230 -1.105) 1.129 ======================= Grid point 120 (54/160) ======================= q-point: (-0.22 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.210 ( 17.248 9.828 17.014) 26.145 1.394 ( 11.266 19.666 6.335) 23.534 1.830 ( 4.590 6.632 1.168) 8.150 1.943 ( 0.848 4.635 7.743) 9.064 2.086 ( 2.516 5.085 2.276) 6.113 2.297 ( 2.682 5.600 -2.056) 6.541 2.551 ( -1.144 -0.267 -0.022) 1.175 2.811 ( -2.169 -1.989 -1.874) 3.489 3.071 ( -4.217 2.164 11.372) 12.320 3.249 ( 3.270 8.924 1.686) 9.653 3.406 ( 2.964 -1.085 -0.961) 3.299 3.613 ( 1.279 -7.499 3.383) 8.326 3.761 ( -7.352 -6.208 -6.391) 11.551 3.810 ( 4.997 -5.197 4.210) 8.349 4.074 ( 1.278 -5.735 -1.056) 5.970 4.165 ( -1.948 -5.683 -0.165) 6.010 4.350 ( -6.666 -0.025 0.424) 6.680 4.518 ( -1.494 -2.011 -2.130) 3.288 4.621 ( 2.282 -1.052 2.424) 3.491 4.855 ( 1.182 -1.327 -5.081) 5.383 4.943 ( 1.286 2.652 -5.747) 6.459 5.239 ( 3.380 3.106 -10.384) 11.354 5.503 ( 0.259 -2.010 1.802) 2.712 5.709 ( -0.466 -0.258 3.105) 3.150 5.777 ( -2.312 -1.852 4.076) 5.039 5.987 ( 0.460 -1.934 0.789) 2.139 6.207 ( -4.718 -5.464 24.253) 25.305 6.819 ( -3.220 -0.094 -0.863) 3.335 6.957 ( -7.574 -1.825 6.212) 9.964 7.237 ( -0.812 -1.177 -1.467) 2.049 7.400 ( 1.270 -2.035 -4.485) 5.086 8.533 ( -0.008 -0.948 2.281) 2.470 8.699 ( 1.095 -2.519 8.114) 8.566 8.891 ( 8.914 -4.336 -1.740) 10.064 9.019 ( -0.384 -1.546 -11.931) 12.037 9.195 ( 1.928 0.283 -1.866) 2.698 9.378 ( 1.501 3.059 -0.189) 3.412 9.555 ( -7.739 -0.891 0.249) 7.794 10.215 ( -0.875 -3.328 -2.626) 4.329 10.385 ( -4.581 7.120 -0.533) 8.483 10.506 ( 1.604 -0.861 -4.353) 4.718 10.678 ( 1.036 -4.717 3.820) 6.157 10.980 ( -2.279 -1.137 7.886) 8.287 11.240 ( 1.193 3.353 4.211) 5.513 11.452 ( 5.277 -1.532 7.252) 9.098 11.825 ( -7.909 -6.870 0.001) 10.477 12.696 ( -3.329 1.030 -4.121) 5.396 12.744 ( -4.871 0.218 -2.704) 5.576 13.131 ( -13.821 8.611 6.057) 17.374 13.593 ( 7.330 2.515 2.609) 8.177 13.951 ( 19.431 9.965 0.484) 21.843 15.136 ( 8.632 -5.872 -17.610) 20.472 15.458 ( 0.774 1.565 4.891) 5.193 15.916 ( -2.316 0.373 -0.801) 2.479 ======================= Grid point 121 (55/160) ======================= q-point: (-0.11 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.336 ( 7.724 19.191 6.428) 21.663 1.362 ( 11.693 15.559 17.171) 25.955 1.943 ( 22.091 6.433 -0.834) 23.024 2.005 ( 5.479 7.431 6.927) 11.542 2.186 ( 8.712 -3.669 0.025) 9.453 2.395 ( 10.540 -2.999 1.008) 11.004 2.563 ( 1.020 -3.559 -4.341) 5.705 2.755 ( -5.871 -1.096 -1.521) 6.164 3.008 ( -2.369 0.409 12.204) 12.439 3.215 ( 2.848 8.590 1.964) 9.261 3.434 ( -0.898 0.245 0.049) 0.932 3.661 ( -3.304 -5.069 -1.907) 6.344 3.726 ( -4.408 -8.566 -1.328) 9.724 3.932 ( 2.851 -3.625 5.730) 7.355 4.076 ( -8.240 1.320 0.893) 8.393 4.135 ( 0.695 -2.926 1.712) 3.460 4.312 ( -0.959 -3.778 -1.556) 4.196 4.532 ( 1.150 -0.842 -2.678) 3.033 4.649 ( 1.035 -0.258 1.833) 2.121 4.836 ( -2.310 2.082 -7.997) 8.580 4.979 ( 2.342 -2.251 -5.531) 6.415 5.260 ( 1.741 1.538 -5.075) 5.581 5.530 ( 0.651 -1.312 -2.139) 2.593 5.705 ( -1.823 -1.399 1.856) 2.954 5.753 ( -0.764 -0.351 4.143) 4.227 6.011 ( 0.202 -1.766 -2.681) 3.217 6.149 ( -8.450 -4.598 26.098) 27.814 6.741 ( -5.592 0.281 -0.938) 5.677 6.791 ( -10.903 1.095 7.208) 13.116 7.229 ( -1.095 -0.792 -1.985) 2.401 7.435 ( 0.704 -1.607 -4.105) 4.464 8.569 ( 1.755 -3.226 2.828) 4.635 8.721 ( -0.658 -1.481 8.974) 9.119 8.950 ( -2.950 -0.875 -13.346) 13.696 9.149 ( 8.044 -2.270 -1.477) 8.488 9.256 ( 4.464 -1.268 -2.102) 5.094 9.381 ( -1.423 1.360 -0.919) 2.173 9.433 ( -3.094 1.187 1.315) 3.566 10.163 ( -4.058 4.463 -2.302) 6.457 10.302 ( -0.929 -2.356 -2.150) 3.323 10.550 ( 1.767 -1.880 -4.198) 4.928 10.743 ( 1.343 -4.167 3.527) 5.622 10.996 ( 0.893 -4.192 8.585) 9.596 11.233 ( 1.949 3.457 3.981) 5.621 11.543 ( 3.338 -0.128 7.388) 8.108 11.723 ( -7.800 -2.559 0.305) 8.215 12.554 ( -6.169 -0.227 -2.749) 6.757 12.739 ( 0.067 -0.896 -4.182) 4.277 12.915 ( -4.419 7.009 5.556) 9.976 13.518 ( -7.894 17.084 -1.523) 18.881 14.112 ( 13.893 3.914 8.507) 16.754 15.327 ( -0.405 -3.226 -0.882) 3.369 15.675 ( 23.162 -9.819 -16.711) 30.202 15.862 ( -3.343 0.316 -0.128) 3.360 ======================= Grid point 126 (56/160) ======================= q-point: (-0.56 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.251 ( -11.361 0.000 11.999) 16.524 1.650 ( -3.723 0.000 2.267) 4.359 1.770 ( -5.164 0.000 1.373) 5.344 2.340 ( -9.704 0.000 12.100) 15.511 2.373 ( 10.331 -0.000 -7.146) 12.562 2.515 ( -7.049 0.000 3.010) 7.665 2.691 ( 0.252 -0.000 0.996) 1.028 2.709 ( -4.062 0.000 5.332) 6.703 3.123 ( 10.507 -0.000 9.910) 14.443 3.320 ( -2.004 0.000 2.901) 3.526 3.411 ( -6.032 0.000 -0.356) 6.043 3.566 ( -2.347 0.000 -2.057) 3.121 3.721 ( -2.434 0.000 -1.592) 2.908 3.731 ( 3.113 -0.000 -1.712) 3.553 3.859 ( -0.940 0.000 -4.306) 4.408 3.866 ( -2.460 0.000 8.837) 9.173 4.293 ( 8.318 -0.000 -2.280) 8.625 4.456 ( 4.869 -0.000 -3.568) 6.036 4.601 ( -0.139 0.000 5.180) 5.182 4.783 ( -4.760 0.000 -5.447) 7.234 5.008 ( -1.073 0.000 -5.315) 5.422 5.275 ( 1.024 -0.000 -5.323) 5.421 5.514 ( -0.769 0.000 -3.155) 3.248 5.561 ( 3.011 -0.000 9.665) 10.123 5.835 ( -2.150 0.000 6.758) 7.091 5.934 ( 0.495 -0.000 6.560) 6.579 6.154 ( -0.499 0.000 12.112) 12.122 6.779 ( 5.453 -0.000 -2.235) 5.894 6.906 ( 4.912 -0.000 -1.152) 5.046 7.202 ( 0.547 -0.000 -2.483) 2.543 7.313 ( 0.326 -0.000 -5.018) 5.028 8.538 ( -2.109 0.000 3.172) 3.809 8.762 ( -3.101 0.000 8.729) 9.263 8.785 ( -6.272 0.000 -1.190) 6.384 8.969 ( 0.059 -0.000 -15.974) 15.974 9.256 ( -3.030 0.000 -1.295) 3.295 9.404 ( 1.924 -0.000 0.200) 1.934 9.602 ( 4.450 -0.000 3.208) 5.485 10.117 ( -0.788 0.000 0.455) 0.910 10.465 ( 2.684 -0.000 -8.704) 9.108 10.532 ( 5.460 -0.000 -2.788) 6.131 10.594 ( -3.333 0.000 6.171) 7.014 11.166 ( -2.750 0.000 14.144) 14.409 11.275 ( -1.344 0.000 0.900) 1.618 11.295 ( 1.213 -0.000 -1.142) 1.666 11.698 ( 1.669 -0.000 0.974) 1.933 12.652 ( 0.951 -0.000 -4.501) 4.600 12.795 ( 8.156 -0.000 -2.449) 8.516 13.266 ( 15.641 -0.000 4.634) 16.313 13.563 ( -11.181 0.000 0.445) 11.189 14.363 ( -37.635 0.000 0.278) 37.636 14.954 ( 12.864 -0.000 -7.993) 15.145 15.476 ( 0.536 -0.000 4.042) 4.077 15.925 ( 1.970 -0.000 0.040) 1.971 ======================= Grid point 128 (57/160) ======================= q-point: (-0.44 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.164 ( 4.217 2.501 15.693) 16.441 1.646 ( 2.254 -2.220 3.596) 4.790 1.722 ( 4.162 8.300 -0.339) 9.291 2.186 ( -5.173 4.091 13.488) 15.014 2.355 ( -9.561 1.072 -4.400) 10.579 2.542 ( 7.326 2.411 -4.850) 9.111 2.592 ( -6.646 3.071 0.705) 7.355 2.717 ( -1.024 -3.699 2.019) 4.337 3.206 ( -2.338 0.947 9.196) 9.536 3.311 ( 1.194 -1.557 7.194) 7.457 3.402 ( 8.007 3.815 6.088) 10.758 3.512 ( -0.963 2.905 -2.654) 4.051 3.680 ( -2.704 -1.291 -2.919) 4.183 3.720 ( -2.383 1.707 -2.896) 4.121 3.865 ( 3.081 -3.636 -0.340) 4.778 3.930 ( -0.599 -9.093 2.661) 9.494 4.411 ( 4.366 -0.368 1.882) 4.768 4.474 ( -3.659 -1.937 -8.524) 9.476 4.590 ( -0.709 0.497 4.165) 4.254 4.761 ( 1.939 -1.342 -2.354) 3.332 5.003 ( 0.469 0.649 -5.614) 5.671 5.274 ( 0.113 1.299 -5.041) 5.207 5.490 ( 0.284 1.799 -1.251) 2.210 5.633 ( 1.582 -3.964 5.401) 6.884 5.796 ( -2.136 0.586 6.662) 7.021 5.943 ( 0.112 -0.559 5.669) 5.697 6.148 ( -1.196 -1.296 15.771) 15.870 6.835 ( 0.944 -0.135 -0.968) 1.359 6.958 ( 0.699 -0.641 -0.674) 1.164 7.210 ( 0.153 -0.533 -2.451) 2.513 7.333 ( 1.499 -0.731 -5.229) 5.489 8.517 ( -1.047 -0.973 2.371) 2.769 8.698 ( -0.888 3.004 5.203) 6.073 8.747 ( -0.622 -2.143 1.779) 2.854 8.977 ( 0.246 -1.202 -16.136) 16.182 9.210 ( -1.691 0.341 -1.381) 2.210 9.422 ( 0.873 0.864 0.942) 1.548 9.626 ( -2.272 -0.386 1.219) 2.607 10.122 ( 0.217 -1.654 0.859) 1.876 10.480 ( 0.377 0.270 -7.985) 7.999 10.568 ( -0.016 -0.840 4.611) 4.687 10.600 ( 1.949 2.035 -1.934) 3.417 11.073 ( -6.468 1.173 8.500) 10.745 11.293 ( 2.728 1.994 4.753) 5.831 11.331 ( 2.979 -1.400 2.212) 3.966 11.717 ( -1.785 -3.580 -0.329) 4.014 12.672 ( 1.126 -0.474 -3.580) 3.783 12.862 ( -0.318 0.750 -2.138) 2.288 13.471 ( 1.086 1.019 0.890) 1.735 13.610 ( 17.501 2.666 3.447) 18.036 13.779 ( -19.086 1.862 0.297) 19.179 15.068 ( -0.213 -1.023 -8.643) 8.706 15.484 ( 0.373 0.350 4.579) 4.608 15.943 ( -0.028 0.064 -0.710) 0.713 ======================= Grid point 129 (58/160) ======================= q-point: (-0.33 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.344 ( 18.222 4.188 17.354) 25.509 1.740 ( 10.790 14.705 1.461) 18.297 1.775 ( 8.814 -4.109 4.582) 10.751 2.084 ( -2.759 5.929 9.868) 11.839 2.196 ( -4.243 3.779 -6.963) 8.987 2.434 ( -3.171 4.975 -1.991) 6.226 2.588 ( 0.560 4.608 -0.332) 4.653 2.728 ( -3.474 -6.427 0.337) 7.313 3.115 ( -5.237 2.096 11.456) 12.770 3.393 ( 5.500 -0.025 6.245) 8.322 3.458 ( 4.908 10.604 4.061) 12.370 3.504 ( 0.817 -1.724 -1.221) 2.265 3.654 ( -4.861 -4.342 -5.833) 8.747 3.718 ( 3.273 -4.057 -0.563) 5.242 3.956 ( 1.660 -5.790 -0.253) 6.029 4.024 ( 1.567 -8.361 1.949) 8.727 4.357 ( -6.913 0.628 -1.767) 7.163 4.463 ( -2.964 -3.413 -1.683) 4.824 4.603 ( 2.393 -0.477 4.022) 4.704 4.819 ( 1.774 -1.624 -4.173) 4.816 4.997 ( 0.700 2.374 -5.600) 6.123 5.267 ( -0.112 -0.107 -4.560) 4.562 5.495 ( 1.892 0.918 -2.666) 3.395 5.676 ( -0.549 -2.714 3.235) 4.258 5.761 ( -1.475 0.251 6.230) 6.407 5.954 ( 0.101 -1.277 3.503) 3.730 6.140 ( -2.267 -1.885 18.641) 18.873 6.814 ( -3.517 -0.288 0.266) 3.538 6.933 ( -4.671 -0.699 1.123) 4.855 7.215 ( -0.541 -1.007 -1.953) 2.263 7.368 ( 1.484 -1.274 -4.599) 4.997 8.518 ( -0.091 -0.861 1.136) 1.429 8.684 ( 0.975 0.841 7.165) 7.280 8.820 ( 6.242 -3.009 -1.590) 7.109 8.991 ( 0.891 -1.241 -14.551) 14.631 9.203 ( 1.286 0.416 -2.037) 2.445 9.426 ( 1.349 1.797 1.404) 2.650 9.540 ( -7.820 -0.600 0.527) 7.860 10.151 ( 0.487 -2.717 -0.789) 2.870 10.466 ( -2.703 0.884 -6.236) 6.853 10.552 ( -1.723 4.693 -1.745) 5.296 10.603 ( 1.508 -2.769 3.822) 4.954 10.972 ( -4.096 0.116 7.939) 8.934 11.305 ( 1.918 3.279 3.299) 5.031 11.421 ( 4.921 -1.831 5.685) 7.739 11.703 ( -4.799 -5.173 -0.863) 7.108 12.694 ( 0.662 -0.655 -3.570) 3.690 12.765 ( -9.293 1.240 -2.980) 9.838 13.277 ( -15.246 5.921 7.044) 17.808 13.610 ( 10.906 -0.150 2.875) 11.280 14.137 ( 28.850 8.239 -3.795) 30.243 15.018 ( -4.742 -5.632 -10.393) 12.737 15.484 ( 0.860 1.041 4.751) 4.939 15.921 ( -2.287 0.169 -0.366) 2.323 ======================= Grid point 130 (59/160) ======================= q-point: (-0.22 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( 16.293 8.911 15.815) 24.392 1.719 ( 3.333 18.821 11.535) 22.325 2.016 ( 14.298 -1.396 -1.141) 14.411 2.044 ( 8.718 0.647 -3.594) 9.452 2.181 ( 4.475 4.019 4.272) 7.377 2.426 ( 5.115 0.591 -3.169) 6.046 2.529 ( -1.372 1.992 -1.025) 2.627 2.706 ( -5.503 -4.290 -0.367) 6.987 3.019 ( -4.370 0.494 13.440) 14.141 3.398 ( 0.970 8.224 4.460) 9.405 3.449 ( 0.448 2.288 -1.476) 2.759 3.547 ( 0.043 -3.642 0.647) 3.700 3.627 ( -1.344 -2.331 -4.351) 5.116 3.855 ( 6.062 -4.803 1.908) 7.966 4.025 ( -0.226 -5.435 -1.045) 5.540 4.100 ( -1.482 -1.857 3.213) 3.996 4.245 ( -4.114 -2.043 0.152) 4.596 4.466 ( -0.432 -5.718 -2.989) 6.467 4.642 ( 1.239 -0.401 4.479) 4.664 4.824 ( -3.156 -1.427 -6.233) 7.131 4.991 ( 1.425 2.039 -6.563) 7.018 5.261 ( -1.534 -1.231 -1.692) 2.594 5.534 ( 3.811 1.287 -5.524) 6.834 5.674 ( -2.123 -1.669 2.578) 3.733 5.745 ( -0.575 -0.274 5.666) 5.702 5.972 ( 0.088 -1.916 1.183) 2.254 6.102 ( -4.444 -0.874 19.421) 19.942 6.731 ( -6.606 -0.740 1.564) 6.829 6.819 ( -7.724 1.383 2.214) 8.153 7.210 ( -0.965 -1.019 -1.769) 2.258 7.405 ( 1.385 -1.448 -4.226) 4.677 8.534 ( 1.175 -0.852 0.672) 1.599 8.701 ( 0.549 -0.519 8.458) 8.492 8.917 ( -0.106 -2.495 -13.154) 13.389 9.099 ( 10.011 -2.455 -3.372) 10.845 9.236 ( 2.479 -0.554 -2.966) 3.905 9.388 ( -7.391 0.122 -0.049) 7.393 9.459 ( 2.474 1.024 3.243) 4.205 10.181 ( 0.104 -1.629 -3.799) 4.135 10.332 ( -6.994 3.679 -1.239) 7.999 10.535 ( 1.630 0.540 -4.427) 4.748 10.665 ( 1.844 -3.597 2.721) 4.873 10.942 ( -0.630 -1.689 8.200) 8.395 11.303 ( 1.913 3.733 3.472) 5.445 11.520 ( 4.334 -1.857 6.014) 7.642 11.661 ( -5.073 -3.649 -0.302) 6.256 12.570 ( -8.893 1.301 -2.852) 9.429 12.720 ( 0.546 -0.981 -3.770) 3.933 13.046 ( -6.608 6.119 6.752) 11.257 13.761 ( 4.290 7.224 -0.410) 8.411 14.267 ( 4.150 12.687 2.985) 13.678 15.181 ( 8.111 -11.758 -9.231) 17.007 15.560 ( 11.993 -2.302 -0.818) 12.239 15.869 ( -3.343 0.305 0.483) 3.391 ======================= Grid point 131 (60/160) ======================= q-point: (-0.11 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.575 ( 2.318 15.502 9.234) 18.192 1.725 ( 11.172 12.913 9.297) 19.442 2.167 ( 2.864 7.279 10.688) 13.245 2.256 ( 13.683 -0.805 -4.527) 14.435 2.309 ( 10.038 -7.401 1.837) 12.606 2.535 ( 0.789 -3.733 -1.265) 4.019 2.571 ( 4.978 -2.233 -2.553) 6.024 2.665 ( 3.395 -0.310 -1.483) 3.717 2.983 ( 0.601 -0.599 12.658) 12.687 3.314 ( -4.024 4.029 3.679) 6.779 3.416 ( -0.438 4.463 0.172) 4.488 3.548 ( -2.303 -3.624 -1.685) 4.613 3.644 ( 0.303 -0.589 -1.235) 1.401 3.892 ( -7.923 1.326 4.591) 9.252 4.023 ( 0.478 0.345 0.242) 0.638 4.114 ( 2.020 -6.079 -1.405) 6.558 4.282 ( 2.480 -2.941 1.507) 4.131 4.546 ( 2.458 -4.887 -3.531) 6.511 4.665 ( 1.037 -0.317 3.097) 3.281 4.746 ( -6.914 -2.246 -7.351) 10.338 4.996 ( 0.905 1.060 -6.991) 7.129 5.237 ( -2.620 -1.504 -0.420) 3.050 5.575 ( 2.095 2.491 -4.567) 5.608 5.643 ( -2.221 -0.796 3.783) 4.458 5.756 ( 0.963 -1.174 5.004) 5.229 5.990 ( -1.434 -2.290 6.624) 7.154 6.021 ( -4.114 0.808 10.359) 11.175 6.623 ( -6.260 -0.743 2.173) 6.669 6.679 ( -5.833 2.574 1.053) 6.462 7.205 ( -0.660 -0.814 -1.947) 2.211 7.436 ( 0.917 -0.857 -4.458) 4.632 8.577 ( 2.190 -2.285 1.998) 3.743 8.702 ( -1.204 -0.054 9.210) 9.289 8.919 ( 0.390 0.009 -14.950) 14.955 9.194 ( -3.289 -2.469 -2.149) 4.640 9.298 ( 0.800 0.363 -1.486) 1.726 9.315 ( 3.130 -0.044 -1.655) 3.541 9.516 ( 4.287 1.813 5.682) 7.345 10.157 ( -0.827 2.946 -6.264) 6.971 10.263 ( -1.009 -2.444 -1.812) 3.205 10.567 ( 1.530 -0.819 -5.101) 5.388 10.730 ( 1.647 -3.978 3.188) 5.358 10.980 ( 1.415 -3.778 8.986) 9.850 11.300 ( 1.746 3.445 3.771) 5.398 11.587 ( 0.603 0.722 3.716) 3.833 11.621 ( -1.281 -2.865 1.530) 3.491 12.486 ( -0.460 -1.736 -1.990) 2.680 12.733 ( 0.066 -0.411 -4.433) 4.452 12.909 ( -3.597 4.886 4.447) 7.522 13.494 ( -15.082 17.202 -1.992) 22.964 14.337 ( 9.392 1.093 8.416) 12.658 15.290 ( -0.127 -2.603 1.739) 3.133 15.806 ( -2.888 -0.028 -0.138) 2.892 15.934 ( 18.317 -7.785 -11.756) 23.116 ======================= Grid point 137 (61/160) ======================= q-point: ( 0.56 -0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.382 ( 17.855 -0.000 16.808) 24.522 1.732 ( 8.990 -0.000 5.361) 10.467 1.897 ( 11.505 -0.000 -2.191) 11.712 2.150 ( -1.118 0.000 14.808) 14.850 2.232 ( -4.955 0.000 -8.384) 9.739 2.483 ( -8.032 0.000 -5.390) 9.673 2.628 ( -3.287 0.000 3.496) 4.799 2.650 ( -0.213 0.000 -1.196) 1.215 3.139 ( -6.088 0.000 11.163) 12.716 3.381 ( 7.938 -0.000 6.303) 10.136 3.506 ( -3.409 0.000 -3.286) 4.735 3.587 ( 9.273 -0.000 5.528) 10.796 3.620 ( 0.495 -0.000 -5.151) 5.175 3.706 ( -2.686 0.000 -2.360) 3.575 3.849 ( -0.093 0.000 5.920) 5.920 3.927 ( 4.864 -0.000 -1.102) 4.988 4.369 ( -5.710 0.000 -7.307) 9.273 4.419 ( -4.246 0.000 3.123) 5.271 4.600 ( 1.940 -0.000 4.391) 4.800 4.802 ( 2.289 -0.000 -4.438) 4.994 5.022 ( 0.851 -0.000 -5.313) 5.380 5.260 ( -1.762 0.000 -2.000) 2.666 5.512 ( 1.819 -0.000 -4.906) 5.232 5.642 ( 0.934 -0.000 4.424) 4.522 5.766 ( -1.743 0.000 6.335) 6.570 5.941 ( -0.036 0.000 4.225) 4.225 6.123 ( -1.446 0.000 16.396) 16.460 6.811 ( -3.687 0.000 0.466) 3.717 6.927 ( -3.716 0.000 -0.369) 3.734 7.204 ( -0.506 0.000 -2.180) 2.238 7.355 ( 1.516 -0.000 -4.521) 4.768 8.507 ( 0.374 -0.000 1.153) 1.212 8.702 ( -0.651 0.000 7.651) 7.678 8.785 ( 5.728 -0.000 -2.343) 6.189 8.978 ( 1.644 -0.000 -15.678) 15.764 9.207 ( 1.171 -0.000 -2.086) 2.392 9.444 ( 1.314 -0.000 2.216) 2.577 9.534 ( -7.930 0.000 0.428) 7.941 10.123 ( 0.860 -0.000 0.206) 0.884 10.473 ( -1.918 0.000 -8.793) 9.000 10.573 ( 1.383 -0.000 5.404) 5.578 10.605 ( -2.471 0.000 -2.077) 3.228 10.975 ( -5.066 0.000 7.879) 9.367 11.353 ( 2.028 -0.000 1.303) 2.410 11.388 ( 4.949 -0.000 7.005) 8.577 11.648 ( -3.723 0.000 -1.083) 3.877 12.686 ( 1.002 -0.000 -3.247) 3.398 12.778 ( -9.666 0.000 -3.136) 10.162 13.339 ( -16.617 0.000 7.816) 18.364 13.605 ( 12.350 -0.000 2.314) 12.565 14.226 ( 35.867 -0.000 -5.735) 36.323 14.955 ( -12.269 0.000 -7.532) 14.396 15.495 ( 0.929 -0.000 4.669) 4.761 15.922 ( -2.251 0.000 -0.209) 2.261 ======================= Grid point 139 (62/160) ======================= q-point: (-0.33 0.56 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.695 ( 17.690 1.847 18.001) 25.305 1.937 ( 13.081 -1.703 6.726) 14.807 2.044 ( 5.379 11.709 8.771) 15.587 2.139 ( 5.771 4.898 -9.557) 12.192 2.216 ( 3.653 -0.952 -0.700) 3.839 2.390 ( -0.307 -1.874 -4.832) 5.192 2.580 ( -2.610 -1.605 4.524) 5.464 2.601 ( -6.245 -2.581 0.567) 6.781 3.022 ( -7.097 -0.052 13.023) 14.831 3.408 ( -6.853 -0.952 -2.106) 7.232 3.536 ( 8.677 1.629 2.214) 9.102 3.626 ( 1.079 4.168 -4.391) 6.149 3.647 ( 2.099 8.426 2.464) 9.026 3.743 ( 6.397 -6.053 -2.248) 9.089 3.906 ( 0.668 -6.773 4.062) 7.926 4.044 ( 6.336 -2.307 1.037) 6.822 4.255 ( -7.584 2.716 0.205) 8.058 4.342 ( -4.999 -6.107 -1.425) 8.020 4.637 ( 1.665 -0.137 5.426) 5.678 4.809 ( -1.800 -0.280 -6.725) 6.967 5.024 ( 0.512 1.117 -5.864) 5.991 5.232 ( -2.043 -1.172 -1.201) 2.644 5.558 ( 4.213 0.856 -5.990) 7.373 5.648 ( -0.903 -0.782 2.818) 3.061 5.743 ( -1.065 0.017 5.933) 6.028 5.946 ( 0.045 -0.737 2.848) 2.942 6.097 ( -2.408 -0.014 16.029) 16.209 6.720 ( -6.728 -0.288 1.560) 6.913 6.838 ( -6.243 0.520 0.718) 6.306 7.194 ( -0.826 -0.517 -1.826) 2.069 7.383 ( 1.598 -0.653 -3.914) 4.278 8.524 ( 1.345 -0.225 -0.233) 1.383 8.700 ( 0.431 0.178 8.242) 8.255 8.870 ( 2.310 -1.639 -11.738) 12.074 9.067 ( 9.046 -0.817 -6.195) 10.995 9.232 ( 0.690 -0.033 -3.249) 3.322 9.391 ( -7.194 0.100 0.569) 7.217 9.471 ( 2.115 0.293 4.069) 4.595 10.151 ( 1.736 -1.010 -1.717) 2.642 10.381 ( -7.907 1.160 -4.983) 9.418 10.562 ( -0.300 1.610 -3.872) 4.204 10.613 ( 1.800 -1.734 3.403) 4.222 10.923 ( -1.520 -0.428 8.029) 8.183 11.373 ( 2.273 3.034 2.584) 4.587 11.479 ( 3.883 -2.199 5.960) 7.446 11.601 ( -2.901 -1.885 -0.496) 3.495 12.590 ( -9.994 0.643 -2.816) 10.403 12.705 ( 1.022 -0.435 -3.426) 3.601 13.133 ( -8.021 2.480 7.538) 11.283 13.829 ( 11.609 1.102 1.534) 11.762 14.562 ( -4.453 15.891 -3.148) 16.800 14.913 ( 15.472 -14.806 -8.365) 22.991 15.544 ( 6.768 -0.097 3.448) 7.596 15.873 ( -3.330 0.111 0.638) 3.392 ======================= Grid point 140 (63/160) ======================= q-point: (-0.22 0.56 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( -0.740 9.988 16.548) 19.343 1.947 ( 7.222 10.252 3.084) 12.914 2.164 ( 4.444 -4.588 4.824) 8.004 2.253 ( 10.997 1.599 -0.440) 11.121 2.297 ( 5.877 2.263 4.167) 7.551 2.473 ( -3.257 -2.565 -3.194) 5.233 2.516 ( 7.218 -1.885 0.130) 7.461 2.656 ( 5.345 -2.338 -1.237) 5.964 2.951 ( -0.937 -2.158 12.642) 12.859 3.304 ( -7.147 -2.039 -0.152) 7.434 3.568 ( -0.496 9.244 2.166) 9.507 3.577 ( 1.946 5.046 -3.459) 6.420 3.657 ( 3.288 1.661 1.255) 3.891 3.900 ( 2.290 -2.916 -1.935) 4.182 3.963 ( -2.213 -4.742 2.697) 5.887 4.042 ( -4.161 -0.151 -0.113) 4.166 4.213 ( 4.309 -4.309 1.687) 6.323 4.377 ( -1.289 -9.310 -0.721) 9.427 4.658 ( 0.551 -0.301 4.494) 4.538 4.751 ( -3.607 1.441 -7.965) 8.862 5.027 ( 1.444 1.409 -7.504) 7.771 5.210 ( -1.949 -1.208 -0.889) 2.459 5.614 ( 0.944 1.368 -1.711) 2.385 5.636 ( 1.362 -0.027 -0.713) 1.537 5.736 ( -0.118 -0.733 5.799) 5.847 5.956 ( -0.321 -1.242 4.515) 4.694 6.042 ( -3.364 1.181 11.693) 12.224 6.612 ( -5.789 -0.394 1.690) 6.043 6.720 ( -6.051 1.520 1.416) 6.398 7.189 ( -0.438 -0.744 -1.722) 1.926 7.418 ( 1.638 -0.861 -4.040) 4.443 8.554 ( 1.757 -0.440 -0.068) 1.813 8.707 ( 0.067 0.454 8.990) 9.002 8.907 ( 1.641 -1.014 -15.037) 15.160 9.156 ( -5.000 -1.411 -2.176) 5.633 9.267 ( 6.716 -1.945 -3.329) 7.744 9.346 ( 1.752 1.782 0.411) 2.532 9.521 ( 3.439 -0.770 6.585) 7.469 10.189 ( 1.415 0.286 -5.211) 5.407 10.240 ( -5.579 0.095 -2.179) 5.990 10.559 ( 0.732 0.124 -5.689) 5.737 10.664 ( 1.583 -2.706 2.675) 4.121 10.928 ( 0.595 -1.624 8.569) 8.742 11.376 ( 2.067 4.196 3.384) 5.773 11.557 ( 2.265 -2.778 5.082) 6.219 11.583 ( -1.374 -1.567 0.484) 2.139 12.472 ( -2.870 -0.077 -2.038) 3.521 12.725 ( 0.840 -0.320 -3.953) 4.054 12.992 ( -5.749 3.312 5.575) 8.666 13.780 ( -14.360 10.866 -4.298) 18.513 14.381 ( 2.544 3.409 6.518) 7.783 15.213 ( 5.124 -4.898 -1.558) 7.258 15.795 ( 9.729 -1.679 -3.939) 10.630 15.829 ( 7.649 -2.257 -0.381) 7.984 ======================= Grid point 141 (64/160) ======================= q-point: (-0.11 -0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( -2.349 7.892 2.140) 8.508 1.887 ( -6.354 6.767 9.680) 13.411 2.171 ( -5.414 -2.844 16.770) 17.850 2.326 ( 0.604 -2.614 -2.022) 3.359 2.489 ( 13.619 -0.823 4.076) 14.240 2.543 ( 6.518 1.940 0.909) 6.861 2.616 ( 3.033 -0.559 0.321) 3.100 2.811 ( 11.665 -1.973 -4.276) 12.580 3.042 ( 5.578 -1.576 7.827) 9.740 3.202 ( -6.231 -0.936 2.468) 6.767 3.440 ( -4.497 6.449 -0.523) 7.879 3.580 ( 2.487 2.935 1.582) 4.160 3.663 ( -0.402 1.763 1.141) 2.138 3.740 ( -10.341 3.369 2.824) 11.237 4.001 ( -0.648 -4.798 -2.742) 5.564 4.081 ( -1.498 -3.662 -0.820) 4.041 4.360 ( 6.994 -0.507 2.311) 7.383 4.450 ( -0.906 -14.580 -4.811) 15.379 4.655 ( -1.871 -0.350 0.056) 1.904 4.687 ( 0.222 3.994 -4.462) 5.992 5.032 ( 1.260 2.888 -7.669) 8.291 5.193 ( -0.847 -0.466 -1.767) 2.014 5.563 ( -3.648 1.853 8.219) 9.181 5.681 ( 3.337 1.825 -3.317) 5.047 5.758 ( 1.006 -1.772 4.709) 5.131 5.936 ( -2.483 0.368 12.954) 13.195 6.014 ( 1.365 -0.036 -1.446) 1.989 6.546 ( -2.369 -0.100 0.811) 2.506 6.624 ( -3.031 1.506 1.520) 3.711 7.193 ( 0.204 -0.581 -1.846) 1.946 7.445 ( 0.790 -0.190 -4.574) 4.645 8.593 ( 1.643 -1.699 2.502) 3.442 8.691 ( -0.689 1.543 8.031) 8.207 8.950 ( 3.290 0.040 -11.964) 12.408 9.086 ( -4.308 -2.484 -4.807) 6.916 9.342 ( 1.053 1.615 -0.657) 2.037 9.367 ( 2.387 1.372 -1.106) 2.967 9.585 ( 2.635 -0.088 8.821) 9.206 10.161 ( -1.459 -0.764 -5.952) 6.176 10.241 ( 1.554 -0.493 -4.485) 4.772 10.574 ( 0.233 -0.864 -5.717) 5.786 10.722 ( 1.666 -3.860 2.889) 5.101 10.970 ( 1.042 -3.146 8.921) 9.517 11.354 ( -0.084 4.209 4.267) 5.994 11.585 ( 0.625 -0.002 0.659) 0.909 11.608 ( 0.715 -2.268 4.131) 4.767 12.504 ( 4.798 -2.339 -1.655) 5.588 12.729 ( -0.728 0.596 -5.451) 5.531 12.883 ( -3.668 2.154 3.312) 5.391 13.346 ( -17.428 10.519 -0.210) 20.358 14.440 ( 1.735 -0.235 7.019) 7.234 15.278 ( 1.073 -1.652 3.090) 3.664 15.770 ( -1.209 0.177 1.103) 1.646 16.157 ( 13.837 -1.639 -10.300) 17.327 ======================= Grid point 148 (65/160) ======================= q-point: ( 0.67 -0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.927 ( 4.730 -0.000 22.431) 22.924 2.081 ( -3.699 0.000 -5.314) 6.475 2.118 ( 4.411 -0.000 2.214) 4.936 2.281 ( 10.438 -0.000 5.458) 11.779 2.299 ( 8.367 -0.000 3.104) 8.924 2.437 ( -10.007 0.000 -0.954) 10.053 2.540 ( 12.983 -0.000 -3.308) 13.398 2.584 ( 6.021 -0.000 1.696) 6.255 2.930 ( -1.557 0.000 12.394) 12.491 3.284 ( -6.680 0.000 -0.798) 6.728 3.649 ( -0.014 0.000 -4.917) 4.917 3.680 ( 4.844 -0.000 4.266) 6.455 3.724 ( -2.266 0.000 1.773) 2.877 3.778 ( 4.569 -0.000 -4.704) 6.558 3.928 ( 6.321 -0.000 2.327) 6.736 4.085 ( -12.897 0.000 0.310) 12.900 4.116 ( -0.131 0.000 0.625) 0.639 4.284 ( 3.135 -0.000 2.600) 4.073 4.655 ( 0.314 -0.000 4.784) 4.794 4.768 ( -1.818 0.000 -8.602) 8.793 5.042 ( 1.456 -0.000 -7.315) 7.459 5.197 ( -1.284 0.000 -1.429) 1.921 5.625 ( -1.589 0.000 2.674) 3.110 5.639 ( 4.664 -0.000 -5.816) 7.455 5.729 ( -0.604 0.000 6.032) 6.062 5.943 ( -0.061 0.000 3.988) 3.989 6.055 ( -2.850 0.000 12.235) 12.563 6.608 ( -5.610 0.000 1.544) 5.819 6.735 ( -6.104 0.000 1.444) 6.272 7.181 ( -0.331 0.000 -1.666) 1.698 7.409 ( 1.885 -0.000 -3.760) 4.206 8.551 ( 1.711 -0.000 -0.866) 1.917 8.712 ( 0.774 -0.000 8.920) 8.953 8.894 ( 2.186 -0.000 -14.815) 14.975 9.142 ( -5.682 0.000 -2.072) 6.048 9.246 ( 7.719 -0.000 -3.448) 8.455 9.366 ( 2.649 -0.000 -0.039) 2.649 9.509 ( 2.111 -0.000 7.094) 7.402 10.187 ( 3.039 -0.000 -3.284) 4.475 10.245 ( -7.994 0.000 -3.816) 8.858 10.564 ( -0.303 0.000 -6.750) 6.757 10.635 ( 1.723 -0.000 3.556) 3.951 10.913 ( 0.264 -0.000 8.466) 8.470 11.437 ( 3.339 -0.000 2.299) 4.054 11.509 ( 0.976 -0.000 5.756) 5.838 11.566 ( -0.501 0.000 0.737) 0.892 12.473 ( -3.664 0.000 -2.052) 4.200 12.722 ( 1.145 -0.000 -3.782) 3.952 13.026 ( -6.565 0.000 6.024) 8.910 13.885 ( -11.015 0.000 -4.386) 11.857 14.430 ( -4.952 0.000 4.573) 6.740 15.151 ( 10.466 -0.000 -2.663) 10.799 15.771 ( 20.232 -0.000 -2.544) 20.392 15.817 ( -3.200 0.000 1.246) 3.434 ======================= Grid point 150 (66/160) ======================= q-point: (-0.22 -0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.810 ( -10.135 3.028 -3.800) 11.240 1.990 ( -12.631 3.660 11.526) 17.487 2.094 ( -5.112 -3.673 22.865) 23.716 2.322 ( -0.129 1.369 -4.423) 4.631 2.461 ( 9.305 -1.792 0.553) 9.492 2.541 ( 14.349 -0.703 10.306) 17.681 2.661 ( 5.715 3.127 -3.929) 7.608 2.765 ( 11.281 -2.736 -4.616) 12.492 3.021 ( 8.705 -0.206 9.647) 12.995 3.182 ( -5.773 -0.726 1.777) 6.084 3.584 ( -6.139 6.964 -3.176) 9.812 3.648 ( -0.659 3.217 1.728) 3.711 3.685 ( -4.073 0.073 3.812) 5.579 3.821 ( -7.285 -0.646 0.098) 7.314 3.901 ( 1.532 1.867 -2.941) 3.805 4.030 ( -1.163 -1.682 2.136) 2.957 4.153 ( 2.251 -13.216 -2.043) 13.561 4.361 ( 4.158 -0.443 0.054) 4.182 4.645 ( -1.754 -0.271 2.625) 3.169 4.759 ( 1.800 2.358 -7.383) 7.956 5.071 ( 2.346 0.965 -8.307) 8.685 5.190 ( 0.543 0.014 -1.983) 2.056 5.590 ( -2.257 0.825 4.792) 5.361 5.703 ( 2.568 0.410 -2.057) 3.315 5.734 ( 1.428 -0.571 3.732) 4.037 5.937 ( -1.137 -0.130 9.127) 9.199 6.024 ( 0.423 0.685 4.154) 4.232 6.546 ( -1.767 0.029 0.833) 1.954 6.644 ( -4.001 0.510 2.015) 4.509 7.184 ( 0.535 -0.301 -1.684) 1.793 7.440 ( 1.532 -0.217 -4.139) 4.419 8.577 ( 1.090 -0.269 0.901) 1.440 8.723 ( 0.708 1.230 8.502) 8.620 8.943 ( 3.534 -0.532 -11.622) 12.159 9.050 ( -4.229 -1.061 -5.122) 6.726 9.354 ( 3.835 0.047 -2.018) 4.333 9.408 ( 2.524 2.126 0.285) 3.312 9.555 ( 2.076 -2.035 9.601) 10.032 10.134 ( -5.103 -1.069 -3.884) 6.501 10.245 ( 3.684 0.274 -5.019) 6.232 10.558 ( -0.308 -0.483 -7.178) 7.201 10.668 ( 1.126 -1.560 2.646) 3.272 10.929 ( 0.706 -1.027 8.855) 8.943 11.448 ( 0.029 5.206 4.374) 6.800 11.545 ( 1.037 -4.312 4.228) 6.127 11.577 ( 1.645 -0.344 0.990) 1.950 12.476 ( 3.785 -0.634 -1.576) 4.149 12.736 ( 0.342 0.157 -5.003) 5.017 12.916 ( -5.679 1.002 4.236) 7.155 13.512 ( -23.733 5.126 -2.987) 24.463 14.438 ( 0.920 -0.024 6.767) 6.829 15.249 ( 2.529 -1.026 1.983) 3.373 15.774 ( -1.434 0.157 1.477) 2.065 16.133 ( 19.255 -0.700 -8.097) 20.900 ======================= Grid point 151 (67/160) ======================= q-point: (-0.11 -0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.616 ( -10.914 -0.908 -7.191) 13.101 1.688 ( -18.890 0.683 11.025) 21.883 1.998 ( -9.716 -3.558 22.675) 24.924 2.328 ( 0.490 0.492 -0.704) 0.988 2.593 ( 1.157 -3.770 -0.166) 3.947 2.709 ( 4.442 4.585 -0.201) 6.387 2.752 ( 10.407 1.759 8.464) 13.529 2.965 ( 5.286 -0.846 -2.196) 5.786 3.051 ( -3.595 1.714 6.167) 7.341 3.162 ( 1.161 -2.316 8.686) 9.064 3.408 ( -4.372 5.215 -0.555) 6.828 3.520 ( -7.352 -0.798 -0.039) 7.395 3.671 ( 0.707 0.920 0.067) 1.163 3.728 ( 0.626 6.206 1.349) 6.382 3.910 ( -4.264 -4.423 -5.620) 8.327 4.030 ( 1.556 -0.862 1.441) 2.289 4.349 ( 3.827 -9.536 -5.469) 11.640 4.451 ( 5.268 -4.205 -0.939) 6.805 4.609 ( -2.872 -1.191 1.491) 3.448 4.756 ( 1.956 4.135 -4.780) 6.616 5.085 ( 1.420 2.621 -8.531) 9.037 5.203 ( 1.387 1.700 -3.295) 3.959 5.534 ( -2.354 2.787 8.453) 9.207 5.722 ( 0.106 -0.967 4.322) 4.430 5.782 ( 3.284 0.541 -0.618) 3.385 5.927 ( 0.537 0.417 9.033) 9.058 6.065 ( 4.673 0.688 3.170) 5.689 6.538 ( 0.891 0.785 -0.242) 1.212 6.608 ( 0.349 -0.249 1.725) 1.778 7.201 ( 1.150 -0.155 -1.911) 2.236 7.456 ( 0.382 0.421 -4.723) 4.757 8.593 ( -0.095 -1.322 4.819) 4.998 8.717 ( 0.850 2.750 6.489) 7.098 8.998 ( 0.421 -1.529 -0.137) 1.591 9.041 ( 3.883 -0.213 -15.261) 15.749 9.353 ( -2.120 2.711 -0.166) 3.446 9.416 ( 1.267 2.161 -0.938) 2.675 9.608 ( 1.206 -2.122 10.485) 10.765 10.097 ( -2.425 -3.628 -4.972) 6.615 10.294 ( 3.232 1.705 -5.865) 6.910 10.559 ( -0.623 -0.939 -6.396) 6.495 10.708 ( 0.851 -3.600 2.691) 4.574 10.955 ( 0.139 -2.282 8.401) 8.706 11.366 ( -3.708 4.114 5.671) 7.927 11.592 ( 0.369 -2.505 5.162) 5.750 11.626 ( 3.274 0.941 -0.696) 3.476 12.591 ( 6.780 -0.813 -1.175) 6.929 12.705 ( -3.299 1.387 -7.644) 8.440 12.829 ( -3.665 -0.316 2.494) 4.445 13.155 ( -10.222 0.853 3.506) 10.840 14.384 ( -8.291 -0.392 5.103) 9.744 15.293 ( 2.025 -0.902 4.183) 4.734 15.773 ( 1.339 -0.010 1.470) 1.988 16.361 ( 8.562 4.415 -11.199) 14.772 ======================= Grid point 159 (68/160) ======================= q-point: (-0.22 -0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.607 ( -14.041 0.000 -11.175) 17.946 1.696 ( -20.915 0.000 9.955) 23.163 1.957 ( -9.969 0.000 30.405) 31.998 2.345 ( 1.848 -0.000 -1.328) 2.276 2.546 ( 0.830 -0.000 -3.252) 3.356 2.755 ( 1.947 -0.000 -0.497) 2.010 2.768 ( 10.135 -0.000 8.362) 13.139 2.952 ( 8.401 -0.000 -2.117) 8.663 3.091 ( -2.597 0.000 3.609) 4.446 3.120 ( 0.006 -0.000 13.982) 13.982 3.487 ( -6.591 0.000 -1.387) 6.735 3.510 ( -9.408 0.000 1.421) 9.514 3.682 ( 0.104 -0.000 -1.188) 1.193 3.768 ( -0.167 0.000 -3.059) 3.063 3.907 ( -2.705 0.000 -1.206) 2.962 4.008 ( 5.454 -0.000 0.004) 5.454 4.204 ( 7.667 -0.000 -2.171) 7.968 4.420 ( 3.215 -0.000 -1.672) 3.623 4.598 ( -3.532 0.000 1.384) 3.794 4.803 ( 1.145 -0.000 -4.822) 4.956 5.105 ( 0.996 -0.000 -8.788) 8.844 5.225 ( 2.984 -0.000 -3.231) 4.398 5.564 ( -1.404 0.000 4.610) 4.819 5.707 ( -0.696 0.000 5.462) 5.506 5.791 ( 3.981 -0.000 -1.147) 4.143 5.930 ( 0.458 -0.000 7.867) 7.880 6.075 ( 5.116 -0.000 5.882) 7.796 6.549 ( 1.806 -0.000 -0.391) 1.848 6.603 ( -0.983 0.000 2.225) 2.432 7.199 ( 1.399 -0.000 -1.824) 2.299 7.460 ( 0.840 -0.000 -4.522) 4.600 8.582 ( -0.388 0.000 4.090) 4.108 8.750 ( 1.282 -0.000 6.986) 7.103 8.981 ( -0.023 0.000 -0.578) 0.579 9.038 ( 5.103 -0.000 -14.734) 15.593 9.384 ( -0.753 0.000 -0.435) 0.870 9.454 ( 1.286 -0.000 -1.630) 2.076 9.565 ( 0.584 -0.000 12.178) 12.192 10.053 ( -3.151 0.000 -4.013) 5.102 10.313 ( 3.970 -0.000 -5.636) 6.893 10.546 ( -0.420 0.000 -7.586) 7.598 10.671 ( 0.223 -0.000 2.278) 2.289 10.933 ( 0.031 -0.000 8.606) 8.606 11.421 ( -5.340 0.000 5.938) 7.986 11.555 ( 1.622 -0.000 5.535) 5.768 11.633 ( 4.521 -0.000 -0.845) 4.600 12.579 ( 8.293 -0.000 -1.318) 8.397 12.720 ( -3.051 0.000 -7.676) 8.260 12.829 ( -4.975 0.000 3.133) 5.879 13.173 ( -16.297 0.000 2.528) 16.492 14.379 ( -8.379 0.000 5.128) 9.824 15.284 ( 2.253 -0.000 3.844) 4.455 15.773 ( 1.178 -0.000 1.584) 1.974 16.406 ( 12.504 -0.000 -11.143) 16.748 ======================= Grid point 160 (69/160) ======================= q-point: (-0.11 -0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.333 ( -21.886 -0.823 11.469) 24.722 1.356 ( -16.639 -2.801 -7.455) 18.447 1.802 ( -9.748 -2.636 19.369) 21.843 2.355 ( -2.172 3.384 -1.066) 4.160 2.431 ( -15.997 -4.669 7.827) 18.411 2.675 ( -9.688 -1.275 -0.334) 9.777 2.853 ( -0.895 0.007 2.011) 2.201 2.885 ( -8.808 1.008 1.994) 9.087 3.080 ( 0.815 3.583 13.841) 14.321 3.183 ( 3.671 -2.469 10.313) 11.221 3.445 ( 3.983 2.850 -1.032) 5.005 3.478 ( 4.713 -0.735 -4.723) 6.713 3.638 ( -3.662 0.622 -4.364) 5.731 3.796 ( 1.464 -2.902 -4.798) 5.796 3.932 ( 7.445 6.870 -0.871) 10.168 4.101 ( 5.507 0.547 1.180) 5.659 4.355 ( 5.329 -5.688 -3.924) 8.727 4.482 ( 2.723 -2.140 -2.261) 4.136 4.542 ( -3.137 -1.741 2.024) 4.119 4.800 ( 0.218 1.450 -3.114) 3.442 5.101 ( -0.923 0.123 -9.074) 9.121 5.251 ( 0.663 2.389 -4.751) 5.359 5.542 ( -0.139 2.411 3.591) 4.328 5.698 ( -1.194 -1.281 5.303) 5.585 5.849 ( 3.105 0.890 1.461) 3.545 5.953 ( 1.792 0.007 4.074) 4.451 6.202 ( 10.591 1.621 16.207) 19.428 6.588 ( 3.426 1.686 -1.247) 4.017 6.629 ( 3.220 -1.991 0.423) 3.810 7.226 ( 1.687 0.133 -2.083) 2.684 7.462 ( -0.171 0.577 -5.023) 5.059 8.568 ( -1.660 -0.789 7.282) 7.510 8.764 ( 1.490 2.268 5.364) 6.012 8.988 ( 0.827 -0.695 -4.687) 4.810 9.143 ( 5.822 0.233 -8.570) 10.363 9.335 ( -2.010 2.708 0.660) 3.437 9.447 ( -0.485 2.845 -2.210) 3.635 9.590 ( -0.116 -3.583 11.231) 11.789 10.032 ( -1.014 -2.549 -4.228) 5.040 10.367 ( 3.373 1.620 -5.518) 6.668 10.543 ( -0.011 -0.138 -6.339) 6.341 10.685 ( 0.129 -2.806 2.617) 3.840 10.934 ( -0.716 -1.349 7.294) 7.452 11.322 ( -4.486 2.126 8.059) 9.465 11.566 ( -2.083 -0.972 4.406) 4.970 11.693 ( 3.046 0.726 -0.138) 3.134 12.627 ( -3.868 1.919 -5.876) 7.292 12.734 ( 7.931 -0.207 -2.126) 8.214 12.761 ( -3.365 -1.028 2.220) 4.160 13.049 ( -0.401 -4.693 5.616) 7.330 14.163 ( -16.966 -0.410 2.858) 17.210 15.328 ( 2.671 -0.435 5.120) 5.791 15.809 ( 2.686 -0.128 1.271) 2.974 16.510 ( 2.300 6.555 -15.825) 17.282 ======================= Grid point 169 (70/160) ======================= q-point: (-0.11 -0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.961 ( -21.314 0.000 12.591) 24.755 1.030 ( -19.561 0.000 0.881) 19.581 1.630 ( -11.268 0.000 3.790) 11.888 1.932 ( -29.426 0.000 26.472) 39.581 2.396 ( -1.123 0.000 0.658) 1.302 2.463 ( -13.785 0.000 -4.545) 14.515 2.720 ( -7.174 0.000 -0.502) 7.191 2.813 ( -5.071 0.000 2.374) 5.599 3.101 ( -1.212 0.000 10.663) 10.732 3.186 ( -1.053 0.000 3.874) 4.015 3.527 ( 0.834 -0.000 -8.081) 8.124 3.614 ( 3.673 -0.000 5.886) 6.938 3.634 ( 10.679 -0.000 -0.236) 10.682 3.809 ( 2.607 -0.000 -5.142) 5.765 4.107 ( 6.760 -0.000 -1.947) 7.035 4.186 ( 3.647 -0.000 3.046) 4.751 4.423 ( 5.752 -0.000 -2.994) 6.485 4.480 ( -2.262 0.000 1.828) 2.908 4.520 ( 2.784 -0.000 -3.065) 4.141 4.806 ( 0.251 -0.000 -1.995) 2.011 5.065 ( -2.816 0.000 -9.629) 10.032 5.238 ( -4.039 0.000 -7.531) 8.546 5.561 ( 0.921 -0.000 0.945) 1.319 5.670 ( -1.181 0.000 4.676) 4.823 5.892 ( 1.231 -0.000 4.404) 4.573 5.981 ( 1.340 -0.000 -0.108) 1.344 6.483 ( 21.291 -0.000 32.196) 38.599 6.662 ( 3.418 -0.000 0.593) 3.469 6.689 ( 6.085 -0.000 -4.097) 7.336 7.254 ( 1.449 -0.000 -2.209) 2.642 7.457 ( -0.717 0.000 -5.553) 5.599 8.532 ( -2.079 0.000 9.091) 9.326 8.810 ( 2.459 -0.000 4.971) 5.546 9.010 ( 2.067 -0.000 -5.867) 6.221 9.150 ( -4.142 0.000 -3.743) 5.583 9.381 ( 2.209 -0.000 -0.064) 2.210 9.477 ( 3.710 -0.000 -6.494) 7.479 9.558 ( -0.566 0.000 12.540) 12.553 10.019 ( 0.972 -0.000 -2.228) 2.431 10.429 ( 3.013 -0.000 -4.870) 5.727 10.571 ( 3.851 -0.000 -2.227) 4.449 10.668 ( 0.033 -0.000 2.443) 2.443 10.916 ( -0.262 0.000 6.081) 6.086 11.287 ( 0.001 -0.000 13.534) 13.534 11.489 ( -6.574 0.000 0.968) 6.645 11.738 ( 2.530 -0.000 3.490) 4.311 12.618 ( 2.289 -0.000 -4.199) 4.782 12.701 ( -2.412 0.000 2.063) 3.174 12.880 ( 7.452 -0.000 -1.413) 7.585 13.042 ( 3.176 -0.000 6.503) 7.237 13.830 ( -21.082 0.000 0.026) 21.082 15.371 ( 2.244 -0.000 5.417) 5.864 15.854 ( 2.500 -0.000 0.822) 2.632 16.506 ( -9.130 0.000 -27.662) 29.130 ======================= Grid point 170 (71/160) ======================= q-point: ( 0.00 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.884 ( -4.559 0.000 19.952) 20.466 0.983 ( 6.358 -0.000 22.963) 23.827 1.365 ( 0.324 -0.000 10.477) 10.482 2.061 ( -8.993 0.000 -5.552) 10.569 2.171 ( 10.980 -0.000 -0.708) 11.003 2.388 ( -6.092 0.000 32.281) 32.850 2.397 ( -5.106 0.000 -15.321) 16.149 2.721 ( 1.559 -0.000 -3.679) 3.995 2.998 ( -2.232 0.000 -5.696) 6.117 3.263 ( -0.242 0.000 14.452) 14.454 3.504 ( -0.060 0.000 5.159) 5.159 3.797 ( 3.653 -0.000 -4.971) 6.169 4.012 ( 3.906 -0.000 0.597) 3.951 4.124 ( 6.391 -0.000 8.125) 10.337 4.217 ( -1.686 0.000 11.528) 11.651 4.303 ( -1.194 0.000 3.464) 3.664 4.435 ( -0.002 0.000 -6.286) 6.286 4.470 ( 0.969 -0.000 -5.706) 5.788 4.522 ( 2.688 -0.000 -1.944) 3.317 4.754 ( -1.891 0.000 -7.110) 7.357 4.761 ( -4.615 0.000 -2.588) 5.291 4.838 ( -0.485 0.000 -5.895) 5.914 5.606 ( 1.142 -0.000 -2.636) 2.873 5.765 ( 0.363 -0.000 6.580) 6.590 5.931 ( -2.852 0.000 -0.054) 2.853 5.980 ( -0.061 0.000 -1.154) 1.156 6.695 ( -0.602 0.000 -0.223) 0.642 6.722 ( -0.586 0.000 -0.196) 0.618 7.202 ( -0.216 0.000 -4.387) 4.393 7.285 ( -0.941 0.000 -5.901) 5.976 7.761 ( 5.334 -0.000 13.904) 14.892 8.683 ( 1.180 -0.000 5.396) 5.524 8.805 ( -2.483 0.000 -20.630) 20.779 8.965 ( 0.045 -0.000 -3.763) 3.763 9.008 ( 3.936 -0.000 1.750) 4.308 9.146 ( -3.469 0.000 -1.978) 3.993 9.470 ( -6.526 0.000 0.798) 6.575 9.594 ( 0.846 -0.000 -2.596) 2.731 10.189 ( 0.077 -0.000 6.559) 6.560 10.517 ( 1.954 -0.000 1.577) 2.511 10.757 ( -1.022 0.000 0.808) 1.303 10.757 ( 3.485 -0.000 0.194) 3.490 11.073 ( 1.773 -0.000 2.166) 2.799 11.192 ( -3.897 0.000 -4.303) 5.805 11.992 ( -0.941 0.000 9.547) 9.593 12.468 ( 4.670 -0.000 -7.043) 8.450 12.680 ( 1.611 -0.000 -1.509) 2.207 12.922 ( -0.943 0.000 -4.953) 5.042 13.055 ( -17.224 0.000 1.235) 17.268 13.126 ( 58.017 -0.000 -1.365) 58.033 13.593 ( 19.386 -0.000 6.405) 20.416 14.079 ( -64.952 0.000 -9.753) 65.680 15.629 ( -3.003 0.000 8.941) 9.432 15.903 ( 0.033 -0.000 -0.332) 0.334 ======================= Grid point 171 (72/160) ======================= q-point: ( 0.11 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.911 ( 2.823 -7.964 14.990) 17.207 1.178 ( 11.824 -5.429 22.042) 25.596 1.511 ( 12.918 -4.720 10.747) 17.454 1.961 ( -1.748 0.774 -7.496) 7.736 2.315 ( 3.443 1.800 9.358) 10.133 2.377 ( 0.426 -2.563 -4.016) 4.783 2.422 ( 13.481 2.860 4.550) 14.513 2.734 ( -0.689 -2.084 -2.055) 3.007 2.993 ( 0.814 -1.957 -4.005) 4.531 3.266 ( -0.796 -1.161 14.927) 14.993 3.495 ( -0.092 1.403 4.843) 5.043 3.848 ( 2.536 3.964 -5.396) 7.160 4.053 ( 1.278 -0.279 -4.192) 4.391 4.112 ( -4.524 6.945 8.932) 12.186 4.181 ( -0.220 1.719 6.499) 6.726 4.244 ( -5.867 -3.434 8.910) 11.207 4.412 ( -1.422 0.520 3.596) 3.902 4.481 ( -0.427 -1.464 -3.989) 4.270 4.608 ( -3.445 1.427 -2.705) 4.607 4.680 ( 5.015 -3.618 -8.310) 10.359 4.735 ( 0.631 0.149 -9.355) 9.377 4.900 ( 5.009 0.114 -6.382) 8.114 5.619 ( 0.885 1.119 -4.082) 4.324 5.783 ( 0.570 -0.315 4.936) 4.979 5.854 ( -5.221 0.133 2.743) 5.899 5.981 ( -0.197 -0.366 -1.841) 1.888 6.647 ( -3.161 2.259 2.258) 4.494 6.709 ( -2.915 -2.728 -0.566) 4.032 7.187 ( -0.799 1.015 -3.987) 4.191 7.259 ( -2.495 -0.061 -2.062) 3.237 7.691 ( -10.226 3.814 14.924) 18.489 8.686 ( -6.937 2.792 -19.950) 21.306 8.719 ( 1.308 0.695 1.561) 2.152 8.967 ( 2.793 4.512 -1.837) 5.615 9.093 ( 4.012 -2.481 0.464) 4.740 9.137 ( 2.587 0.421 -2.573) 3.673 9.357 ( -4.993 0.323 4.173) 6.515 9.549 ( -5.997 -0.159 -1.314) 6.141 10.176 ( -3.314 -2.147 6.144) 7.303 10.502 ( -1.288 5.216 1.748) 5.650 10.661 ( -4.548 5.131 2.045) 7.155 10.831 ( 3.368 0.152 -1.141) 3.560 11.111 ( 2.880 -0.204 1.286) 3.161 11.168 ( -0.172 -2.135 -2.348) 3.178 11.910 ( -4.772 4.685 7.422) 9.990 12.201 ( -26.858 6.410 2.764) 27.751 12.662 ( -1.505 4.577 -1.924) 5.188 12.750 ( -3.794 9.694 -1.833) 10.571 12.912 ( -8.503 -6.482 2.093) 10.895 13.249 ( -23.026 -14.358 6.674) 27.945 13.957 ( 24.223 0.757 10.948) 26.593 14.358 ( 54.292 -9.199 -30.606) 63.000 15.579 ( -2.903 -0.183 9.427) 9.865 15.893 ( -1.325 -0.213 -0.122) 1.348 ======================= Grid point 172 (73/160) ======================= q-point: ( 0.22 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.103 ( 5.644 -13.916 6.704) 16.446 1.464 ( 13.007 -8.741 17.891) 23.784 1.823 ( 14.522 -6.685 5.028) 16.759 1.993 ( 7.075 1.489 -7.147) 10.166 2.424 ( 8.252 0.077 -2.113) 8.518 2.439 ( 6.590 -0.291 10.148) 12.104 2.574 ( 9.237 6.306 1.575) 11.294 2.769 ( 2.860 -1.419 0.399) 3.217 3.070 ( 3.594 -6.446 1.136) 7.467 3.256 ( -2.203 -2.027 13.530) 13.857 3.482 ( -0.373 0.781 4.301) 4.387 3.760 ( -4.781 8.103 -0.685) 9.433 3.923 ( -8.689 7.249 1.437) 11.407 4.057 ( -4.159 -2.030 -1.141) 4.767 4.133 ( 0.612 5.903 2.490) 6.436 4.208 ( -2.125 0.118 7.903) 8.185 4.383 ( -0.569 1.552 1.648) 2.334 4.452 ( -4.187 -2.877 0.677) 5.125 4.566 ( -1.212 -4.385 -2.560) 5.221 4.739 ( 1.777 0.744 -2.079) 2.834 4.843 ( 6.490 -0.228 -14.276) 15.683 4.982 ( 5.150 -0.713 -10.600) 11.806 5.600 ( -1.379 2.938 -2.241) 3.944 5.705 ( -7.238 0.233 -2.016) 7.517 5.846 ( 1.778 -0.873 7.491) 7.749 5.977 ( -0.493 -0.132 -1.543) 1.625 6.563 ( -4.126 1.797 6.732) 8.098 6.674 ( -4.226 -2.935 0.152) 5.148 7.126 ( -8.103 2.794 8.259) 11.903 7.191 ( -4.043 -0.667 0.604) 4.142 7.451 ( -9.052 4.668 6.010) 11.826 8.527 ( -6.476 1.941 -24.727) 25.635 8.737 ( 2.400 3.657 3.865) 5.837 8.958 ( 1.091 4.696 3.314) 5.850 9.172 ( 4.603 0.597 -0.293) 4.651 9.208 ( 4.133 -0.740 -2.712) 4.999 9.350 ( 0.992 -6.777 2.981) 7.470 9.417 ( -8.571 0.473 0.497) 8.598 10.106 ( -7.183 -2.009 4.357) 8.638 10.391 ( -2.365 7.096 0.955) 7.540 10.578 ( -2.128 0.358 3.118) 3.792 10.865 ( 2.682 3.170 -0.655) 4.203 11.159 ( 3.950 3.119 -0.551) 5.063 11.222 ( 2.885 -3.261 0.885) 4.443 11.779 ( -11.269 0.852 11.962) 16.457 11.799 ( -7.530 2.819 1.896) 8.261 12.562 ( -2.236 5.724 -1.556) 6.339 12.671 ( -0.900 3.002 -4.007) 5.087 12.883 ( -3.636 -7.003 3.882) 8.794 13.177 ( -8.790 -15.804 1.422) 18.140 14.324 ( 18.913 0.395 14.114) 23.602 15.112 ( 31.308 2.770 -30.719) 43.949 15.558 ( 0.486 -1.237 6.791) 6.920 15.865 ( -2.116 -0.424 0.281) 2.176 ======================= Grid point 173 (74/160) ======================= q-point: ( 0.33 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.335 ( 5.306 -13.395 1.465) 14.482 1.779 ( 12.610 -9.450 14.233) 21.234 2.076 ( 6.754 -8.354 1.401) 10.834 2.164 ( 13.729 0.790 -5.772) 14.914 2.437 ( 0.660 5.169 -5.479) 7.562 2.667 ( 13.101 -0.647 10.253) 16.649 2.687 ( 8.043 0.607 4.661) 9.316 2.803 ( 4.190 6.526 6.163) 9.906 3.183 ( -0.603 -5.846 8.615) 10.429 3.296 ( 2.689 -6.429 8.039) 10.639 3.453 ( -1.375 2.265 2.910) 3.936 3.587 ( -6.841 4.868 0.385) 8.405 3.720 ( -5.823 5.046 0.914) 7.759 3.971 ( -6.954 0.583 2.689) 7.479 4.060 ( -3.004 3.702 4.120) 6.301 4.155 ( -1.694 3.841 -1.622) 4.501 4.380 ( 1.979 1.492 1.468) 2.881 4.446 ( -1.580 -4.921 -2.049) 5.560 4.598 ( -0.481 -3.506 -2.573) 4.375 4.757 ( 1.527 2.059 -1.683) 3.067 4.862 ( -0.379 4.505 -9.319) 10.358 5.085 ( 3.947 -1.900 -13.832) 14.509 5.502 ( -5.878 0.380 0.907) 5.960 5.627 ( -1.473 1.116 -6.504) 6.762 5.881 ( 1.493 0.326 6.349) 6.530 5.976 ( 0.606 -0.110 -0.190) 0.644 6.487 ( -3.630 0.616 13.524) 14.016 6.631 ( -3.782 -2.450 1.237) 4.673 6.866 ( -15.470 2.495 20.950) 26.162 7.159 ( -1.082 -0.084 -2.977) 3.168 7.346 ( -1.368 2.110 -5.118) 5.703 8.445 ( -1.388 -0.031 -27.224) 27.260 8.733 ( 2.178 4.920 3.334) 6.330 8.923 ( -0.711 2.763 7.607) 8.124 9.227 ( -0.622 1.487 0.096) 1.615 9.263 ( 2.034 -0.046 -2.373) 3.125 9.290 ( -2.365 -1.068 1.489) 2.991 9.496 ( 5.332 -8.958 1.641) 10.553 10.012 ( -4.702 -0.883 -0.187) 4.788 10.310 ( -1.396 4.376 -0.263) 4.600 10.562 ( -0.667 -1.273 3.608) 3.884 10.868 ( 2.174 4.299 0.231) 4.823 11.180 ( 2.997 4.794 1.085) 5.757 11.300 ( 2.795 -2.072 1.136) 3.660 11.643 ( -5.094 -1.946 6.152) 8.221 11.730 ( -1.328 0.954 3.763) 4.103 12.498 ( 0.272 3.793 -2.476) 4.537 12.629 ( -2.082 0.704 -4.990) 5.452 12.900 ( -1.675 -5.031 3.994) 6.638 13.193 ( -5.590 -11.785 0.558) 13.055 14.573 ( 10.527 1.089 14.177) 17.692 15.371 ( 7.645 4.815 -6.422) 11.084 15.658 ( 8.131 -0.528 -10.624) 13.389 15.846 ( 0.121 -0.848 -0.116) 0.865 ======================= Grid point 174 (75/160) ======================= q-point: ( 0.44 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.515 ( 2.825 -7.668 -1.074) 8.242 2.009 ( 2.671 -6.085 11.600) 13.368 2.228 ( 1.714 -2.651 -1.555) 3.519 2.334 ( 1.759 -5.364 -2.902) 6.347 2.457 ( 10.975 2.565 -4.198) 12.027 2.729 ( 3.091 5.399 6.387) 8.916 2.805 ( 3.119 1.707 12.325) 12.828 2.921 ( 12.788 1.209 9.670) 16.078 3.185 ( -4.878 -0.666 4.636) 6.763 3.295 ( -3.511 -2.854 5.179) 6.877 3.403 ( -3.616 2.706 3.392) 5.648 3.550 ( 3.791 -1.312 -3.285) 5.185 3.677 ( 1.719 -1.493 6.017) 6.434 3.796 ( -11.167 2.389 3.896) 12.066 3.997 ( -3.542 0.210 0.390) 3.570 4.106 ( 0.435 2.088 -1.234) 2.464 4.409 ( 2.080 1.940 -0.859) 2.971 4.469 ( -1.547 -6.098 -1.749) 6.530 4.583 ( -0.466 6.038 -3.502) 6.995 4.727 ( -1.127 3.136 -0.554) 3.378 4.816 ( -0.827 0.252 -9.156) 9.196 5.104 ( -1.743 -0.056 -8.702) 8.875 5.480 ( 1.342 -3.784 -4.640) 6.136 5.611 ( 1.034 1.104 -5.724) 5.921 5.892 ( 0.786 1.279 5.175) 5.389 6.001 ( 2.235 0.357 0.739) 2.381 6.427 ( -4.213 -0.723 25.694) 26.048 6.593 ( -3.141 -0.460 2.863) 4.274 6.657 ( -6.347 -0.465 9.986) 11.842 7.148 ( -0.399 -0.181 -2.921) 2.953 7.322 ( -0.260 0.756 -6.833) 6.880 8.464 ( 3.197 -1.245 -28.313) 28.520 8.722 ( 1.742 4.115 2.921) 5.338 8.892 ( -0.984 0.965 8.559) 8.669 9.138 ( -4.029 2.116 2.791) 5.339 9.285 ( 0.286 -0.360 -2.263) 2.309 9.332 ( 1.487 -2.004 1.075) 2.717 9.666 ( 4.342 -7.838 3.052) 9.466 9.975 ( -0.405 -0.278 -4.485) 4.512 10.246 ( -1.616 3.384 -1.400) 4.003 10.569 ( -0.698 -1.619 3.964) 4.338 10.860 ( 2.135 4.631 0.804) 5.163 11.166 ( 0.748 4.545 2.303) 5.150 11.353 ( 1.182 -2.148 1.001) 2.648 11.608 ( -2.031 -1.789 4.198) 4.995 11.720 ( 0.230 -0.119 4.323) 4.330 12.495 ( 2.409 1.632 -3.940) 4.898 12.582 ( -3.453 -1.064 -4.982) 6.154 12.916 ( -0.416 -1.459 3.697) 3.996 13.213 ( -1.148 -4.250 0.607) 4.444 14.655 ( -0.020 0.876 12.777) 12.807 15.410 ( 3.239 3.134 3.571) 5.750 15.736 ( 1.378 -0.677 -7.699) 7.851 15.906 ( 4.115 -1.891 -7.860) 9.072 ======================= Grid point 175 (76/160) ======================= q-point: (-0.44 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( -4.033 3.044 -3.488) 6.140 1.969 ( -11.391 0.282 13.610) 17.750 2.151 ( -5.369 -1.474 1.741) 5.834 2.395 ( -5.900 -2.450 -4.983) 8.102 2.617 ( 7.877 1.521 -7.592) 11.046 2.778 ( 5.121 -1.369 14.358) 15.305 2.825 ( 1.172 2.349 4.095) 4.864 3.084 ( -0.057 -1.580 1.843) 2.428 3.121 ( 3.581 -0.200 13.266) 13.742 3.303 ( -0.144 -3.036 3.282) 4.473 3.353 ( 2.142 1.352 2.275) 3.404 3.585 ( -6.157 2.304 2.481) 7.027 3.628 ( -0.916 -2.361 -1.094) 2.759 3.735 ( 1.305 -2.183 5.700) 6.242 3.930 ( -2.328 2.003 1.350) 3.355 4.075 ( -5.435 -1.506 5.873) 8.142 4.374 ( 0.857 5.246 -5.015) 7.308 4.506 ( 0.087 5.393 -6.242) 8.249 4.543 ( 3.206 -2.227 -1.023) 4.035 4.717 ( 0.907 0.253 1.259) 1.572 4.806 ( -1.124 -2.999 -10.960) 11.418 5.073 ( -1.620 -0.608 -7.289) 7.492 5.558 ( 2.398 -2.403 -3.666) 4.997 5.650 ( 4.135 -1.488 -5.132) 6.756 5.887 ( 0.309 1.968 4.331) 4.768 6.031 ( 1.679 1.350 1.009) 2.379 6.401 ( 0.961 -2.415 30.502) 30.612 6.559 ( -0.348 -0.546 3.488) 3.547 6.642 ( 1.177 -0.902 2.763) 3.136 7.148 ( 0.094 -0.446 -2.931) 2.967 7.313 ( -0.281 -0.124 -7.228) 7.234 8.547 ( 4.740 -1.669 -27.390) 27.847 8.724 ( 2.341 1.882 2.962) 4.218 8.875 ( -1.007 -0.484 8.194) 8.269 9.070 ( -1.160 2.991 3.814) 4.984 9.282 ( -1.429 -1.625 -1.820) 2.827 9.357 ( -0.881 -2.174 -0.278) 2.362 9.774 ( 0.347 -4.982 3.768) 6.256 9.984 ( 1.699 1.382 -5.013) 5.471 10.211 ( 0.834 0.765 -1.811) 2.135 10.562 ( -1.695 -0.869 4.192) 4.605 10.849 ( 1.681 4.689 1.222) 5.129 11.123 ( -1.197 3.318 2.645) 4.409 11.387 ( -0.216 -3.322 1.602) 3.694 11.592 ( -2.518 -1.883 2.696) 4.142 11.736 ( 1.878 0.409 4.924) 5.286 12.532 ( -0.678 -0.783 -5.861) 5.952 12.545 ( 1.095 -1.503 -2.823) 3.380 12.911 ( 0.121 2.254 3.371) 4.057 13.238 ( 4.182 4.494 0.397) 6.152 14.562 ( -10.488 0.291 11.317) 15.433 15.438 ( 3.144 2.353 5.738) 6.953 15.762 ( 0.831 -1.904 -5.095) 5.503 15.971 ( -0.720 -4.883 -11.436) 12.456 ======================= Grid point 176 (77/160) ======================= q-point: (-0.33 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( -9.096 9.674 -3.615) 13.762 1.681 ( -16.951 5.947 14.730) 23.231 2.072 ( -12.381 -4.310 7.168) 14.942 2.252 ( -6.563 0.597 -3.282) 7.362 2.612 ( -2.780 5.582 -4.969) 7.973 2.765 ( -4.969 1.907 -5.853) 7.911 2.875 ( -2.475 -2.200 5.750) 6.635 2.977 ( -8.742 0.124 5.325) 10.237 3.215 ( 0.247 -6.872 8.823) 11.186 3.343 ( 3.862 3.209 4.931) 7.038 3.470 ( 1.055 0.680 4.162) 4.348 3.510 ( 5.599 -0.463 11.636) 12.921 3.605 ( -1.561 -2.460 2.652) 3.940 3.756 ( 0.418 -0.247 -0.623) 0.790 3.920 ( 2.915 -1.992 9.284) 9.932 4.054 ( 2.993 -1.168 -2.861) 4.302 4.378 ( 3.099 2.432 -1.817) 4.338 4.458 ( 0.348 4.589 -7.075) 8.440 4.597 ( 0.427 -2.273 -0.668) 2.408 4.702 ( -1.553 0.673 -0.806) 1.875 4.857 ( 2.255 -3.221 -11.230) 11.898 5.053 ( -2.204 -1.677 -7.689) 8.172 5.588 ( 0.173 -0.418 0.930) 1.034 5.765 ( 5.544 -3.495 -4.498) 7.948 5.861 ( -0.780 2.622 4.336) 5.126 6.024 ( -0.422 1.536 2.147) 2.674 6.544 ( 9.065 -0.872 11.011) 14.289 6.599 ( 4.615 -3.812 14.833) 15.995 6.697 ( 5.971 -0.391 5.402) 8.062 7.158 ( 0.499 -0.805 -3.343) 3.474 7.310 ( -0.392 -0.714 -7.288) 7.334 8.617 ( 1.705 -2.174 -18.625) 18.828 8.773 ( 3.831 0.543 -1.240) 4.063 8.866 ( -1.366 -1.533 7.437) 7.715 9.047 ( 1.187 1.450 0.629) 1.977 9.278 ( -0.915 -2.177 -0.332) 2.384 9.349 ( -2.214 -2.054 -2.285) 3.787 9.763 ( -4.360 -0.816 -0.535) 4.468 10.015 ( 4.013 1.365 1.712) 4.572 10.264 ( 4.068 -2.052 -1.589) 4.826 10.535 ( -2.156 -0.745 4.372) 4.931 10.825 ( 0.856 4.517 1.544) 4.849 11.071 ( -1.272 2.821 2.695) 4.104 11.412 ( -1.135 -4.140 1.911) 4.699 11.549 ( -4.613 -1.619 2.633) 5.553 11.789 ( 5.100 0.683 5.115) 7.256 12.522 ( 0.870 0.186 -3.061) 3.188 12.619 ( 2.815 -4.559 -4.027) 6.703 12.881 ( 0.935 5.655 3.186) 6.558 13.261 ( 6.853 10.345 0.012) 12.409 14.307 ( -19.040 0.665 9.836) 21.441 15.470 ( 2.610 1.850 5.015) 5.949 15.797 ( 0.030 -3.652 -6.182) 7.180 15.961 ( -7.126 -6.921 -12.868) 16.256 ======================= Grid point 177 (78/160) ======================= q-point: (-0.22 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.097 ( -7.805 9.010 0.680) 11.940 1.334 ( -16.278 6.482 16.809) 24.281 1.805 ( -16.758 3.902 7.281) 18.683 2.169 ( -8.024 -4.595 -1.333) 9.342 2.488 ( -6.325 6.613 -1.313) 9.244 2.596 ( -8.844 -0.270 -6.937) 11.244 2.766 ( -8.649 1.679 1.896) 9.012 2.817 ( -9.774 2.739 10.628) 14.697 3.182 ( -6.616 2.431 3.164) 7.726 3.310 ( -2.602 -1.853 7.895) 8.517 3.463 ( 0.079 -1.717 8.844) 9.009 3.700 ( 12.778 -3.293 6.878) 14.880 3.720 ( 5.452 -0.606 2.207) 5.913 3.783 ( 4.387 -0.743 0.107) 4.451 4.056 ( 6.862 -4.949 7.770) 11.487 4.151 ( 6.266 -0.923 -5.777) 8.572 4.404 ( 1.492 0.594 -2.892) 3.309 4.435 ( 1.509 2.909 -4.285) 5.394 4.603 ( -0.971 0.569 4.572) 4.708 4.686 ( -0.892 -2.764 -5.436) 6.163 4.885 ( -0.107 1.748 -9.473) 9.634 5.018 ( -4.788 -2.990 -8.401) 10.121 5.587 ( -0.319 -0.220 1.852) 1.892 5.811 ( -1.405 2.088 5.874) 6.391 5.884 ( 3.885 -2.561 -3.602) 5.884 6.002 ( -0.486 1.168 1.307) 1.818 6.622 ( 2.874 -0.848 1.164) 3.214 6.698 ( 3.252 1.028 1.801) 3.857 7.008 ( 23.678 -5.377 23.024) 33.461 7.178 ( 0.761 -1.046 -3.998) 4.202 7.311 ( -0.246 -0.925 -6.557) 6.627 8.656 ( 0.208 -3.348 -7.237) 7.977 8.798 ( 1.071 2.549 -6.426) 6.996 8.874 ( -0.464 -3.799 5.998) 7.116 9.060 ( -0.699 -0.233 -3.928) 3.997 9.289 ( -3.362 -3.607 -2.425) 5.494 9.352 ( 3.356 -1.817 -0.428) 3.840 9.682 ( -4.135 1.153 -2.284) 4.863 10.091 ( 5.506 0.387 6.798) 8.756 10.362 ( 4.352 -2.371 -0.583) 4.990 10.534 ( 0.493 -3.949 4.246) 5.819 10.796 ( 0.851 4.157 1.284) 4.434 11.035 ( 0.778 3.441 2.847) 4.533 11.399 ( -6.032 -2.311 -4.763) 8.026 11.532 ( 3.288 -3.840 12.028) 13.047 11.895 ( 8.459 1.794 5.614) 10.309 12.558 ( 3.385 0.328 -2.317) 4.115 12.726 ( 3.174 -7.204 -2.949) 8.407 12.838 ( 1.914 8.113 2.576) 8.724 13.274 ( 7.813 11.719 0.494) 14.093 13.924 ( -24.317 2.149 7.194) 25.450 15.455 ( -5.864 0.296 -4.161) 7.196 15.791 ( -11.155 -9.197 -14.559) 20.518 15.885 ( -2.080 -0.168 -1.955) 2.859 ======================= Grid point 178 (79/160) ======================= q-point: (-0.11 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.951 ( -1.986 3.476 11.928) 12.582 1.047 ( -10.623 5.071 18.781) 22.165 1.500 ( -12.125 5.497 8.006) 15.535 2.086 ( -3.865 -3.242 3.072) 5.906 2.264 ( -11.836 3.145 -2.845) 12.573 2.495 ( -7.700 -1.649 1.727) 8.061 2.563 ( -10.095 4.158 12.562) 16.644 2.702 ( 0.003 1.904 -2.343) 3.019 3.065 ( -4.951 0.805 -4.466) 6.716 3.279 ( -1.758 0.315 12.530) 12.657 3.491 ( 0.235 -2.046 6.012) 6.355 3.757 ( 2.203 1.369 -4.101) 4.852 3.911 ( 6.651 -1.836 5.210) 8.646 3.950 ( 11.510 -3.113 7.657) 14.170 4.184 ( 2.469 -4.015 6.090) 7.701 4.261 ( 6.110 1.211 -5.554) 8.345 4.422 ( 1.006 0.170 -3.009) 3.178 4.445 ( 2.082 0.999 -4.593) 5.141 4.559 ( -2.748 1.638 5.895) 6.707 4.721 ( 0.460 -4.701 -5.605) 7.330 4.829 ( -1.881 4.349 -7.287) 8.691 4.936 ( -7.451 -1.799 -7.567) 10.771 5.590 ( 0.439 -0.234 -0.083) 0.504 5.774 ( -0.878 1.237 6.375) 6.553 5.943 ( 0.609 -1.407 -1.812) 2.373 5.987 ( -0.226 0.749 0.050) 0.784 6.673 ( 1.631 -1.536 0.440) 2.283 6.725 ( 1.734 1.921 -0.175) 2.594 7.196 ( 0.401 -0.918 -4.280) 4.395 7.295 ( 0.175 -0.251 -7.357) 7.363 7.494 ( 21.822 -4.036 18.683) 29.010 8.676 ( -0.920 -1.885 4.551) 5.011 8.800 ( 1.836 0.520 -16.462) 16.573 8.923 ( 1.321 -4.270 2.593) 5.167 9.016 ( -2.124 2.129 -2.747) 4.073 9.227 ( -5.996 -1.814 -3.623) 7.237 9.475 ( 3.201 -6.766 -0.246) 7.489 9.606 ( -1.917 3.893 -2.483) 5.000 10.167 ( 3.318 1.003 7.578) 8.333 10.452 ( 3.549 -2.687 0.608) 4.493 10.641 ( 3.304 -8.614 2.890) 9.668 10.779 ( 1.714 4.089 0.640) 4.480 11.040 ( 3.102 2.500 2.637) 4.778 11.289 ( -6.680 0.253 -4.840) 8.253 11.809 ( 18.033 -14.400 13.813) 26.895 12.046 ( 18.055 7.137 6.497) 20.473 12.616 ( 2.481 -1.899 -1.840) 3.626 12.787 ( 4.856 10.252 3.746) 11.946 12.866 ( 2.624 -7.612 -3.825) 8.914 13.321 ( 8.953 10.394 4.540) 14.450 13.489 ( -20.862 1.773 1.460) 20.989 15.079 ( -42.893 -0.888 -26.905) 50.641 15.680 ( -5.015 -1.805 4.088) 6.717 15.893 ( 1.181 0.264 -0.354) 1.261 ======================= Grid point 180 (80/160) ======================= q-point: ( 0.11 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.954 ( 6.840 -0.000 8.965) 11.277 1.373 ( 13.765 -0.000 19.805) 24.119 1.752 ( 14.755 -0.000 6.380) 16.075 2.012 ( 7.293 -0.000 -8.056) 10.867 2.423 ( 10.341 -0.000 20.981) 23.391 2.433 ( 6.803 -0.000 -10.489) 12.502 2.689 ( -2.223 0.000 -0.138) 2.227 2.706 ( 15.423 -0.000 -2.076) 15.562 3.012 ( 2.578 -0.000 -1.661) 3.067 3.232 ( -2.997 0.000 14.743) 15.045 3.491 ( -1.056 0.000 4.920) 5.032 3.883 ( -6.108 0.000 -2.891) 6.758 3.969 ( -7.693 0.000 -1.562) 7.850 4.041 ( -4.595 0.000 -0.278) 4.603 4.177 ( 1.237 -0.000 9.836) 9.914 4.219 ( 0.502 -0.000 7.222) 7.239 4.394 ( -0.972 0.000 5.827) 5.907 4.412 ( -7.834 0.000 -0.158) 7.836 4.522 ( -1.596 0.000 -5.664) 5.885 4.747 ( 1.582 -0.000 -2.666) 3.100 4.838 ( 10.553 -0.000 -17.070) 20.069 4.978 ( 3.584 -0.000 -7.633) 8.433 5.638 ( 0.581 -0.000 -5.790) 5.819 5.699 ( -9.925 0.000 0.969) 9.972 5.836 ( 2.497 -0.000 7.725) 8.119 5.976 ( -0.251 0.000 -2.383) 2.396 6.598 ( -4.398 0.000 4.442) 6.250 6.628 ( -4.103 0.000 0.771) 4.175 7.161 ( -10.699 0.000 11.636) 15.807 7.176 ( -1.020 0.000 -3.987) 4.116 7.502 ( -11.141 0.000 7.574) 13.472 8.547 ( -7.958 0.000 -24.803) 26.048 8.776 ( 3.107 -0.000 4.232) 5.250 9.077 ( 5.640 -0.000 -3.783) 6.791 9.110 ( 0.310 -0.000 5.345) 5.354 9.199 ( 3.992 -0.000 -3.658) 5.415 9.275 ( -2.763 0.000 4.328) 5.135 9.423 ( -8.326 0.000 0.348) 8.334 10.083 ( -6.081 0.000 5.769) 8.382 10.494 ( -3.034 0.000 1.460) 3.367 10.558 ( -6.730 0.000 2.622) 7.223 10.905 ( 3.403 -0.000 -2.545) 4.249 11.178 ( 5.160 -0.000 2.131) 5.583 11.197 ( 4.343 -0.000 -3.256) 5.428 11.779 ( -19.296 0.000 12.934) 23.230 11.833 ( -5.751 0.000 2.850) 6.418 12.631 ( -4.284 0.000 -2.968) 5.211 12.752 ( -5.701 0.000 -2.705) 6.310 12.829 ( 3.343 -0.000 1.270) 3.576 12.939 ( -5.789 0.000 6.759) 8.899 14.329 ( 19.342 -0.000 14.719) 24.306 15.138 ( 35.471 -0.000 -33.942) 49.094 15.545 ( -0.098 0.000 7.178) 7.179 15.861 ( -2.227 0.000 0.225) 2.238 ======================= Grid point 181 (81/160) ======================= q-point: ( 0.22 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.129 ( 9.239 -6.369 2.340) 11.463 1.638 ( 14.115 -4.150 17.490) 22.855 1.958 ( 7.938 -3.282 2.753) 9.020 2.182 ( 12.257 0.659 -7.303) 14.283 2.523 ( 2.561 2.916 -4.163) 5.691 2.656 ( 14.177 -0.449 11.818) 18.462 2.693 ( 5.974 0.082 0.212) 5.979 2.918 ( 9.355 4.379 1.756) 10.478 3.085 ( 3.803 -3.161 4.651) 6.788 3.188 ( -2.937 -4.085 12.753) 13.710 3.471 ( -0.833 0.203 4.679) 4.757 3.681 ( -11.340 3.483 -0.102) 11.863 3.811 ( -8.391 2.974 -0.632) 8.925 3.990 ( -3.211 1.258 0.716) 3.522 4.152 ( -6.415 4.837 9.621) 12.534 4.198 ( 0.336 1.243 -0.196) 1.303 4.307 ( -6.672 -6.698 2.744) 9.844 4.403 ( 2.094 -0.544 2.637) 3.411 4.540 ( 1.978 -1.639 -7.822) 8.233 4.774 ( 1.639 0.236 -2.511) 3.008 4.960 ( 3.813 4.668 -11.584) 13.058 5.038 ( 4.051 -3.018 -12.490) 13.473 5.509 ( -10.713 0.248 1.332) 10.798 5.640 ( -0.304 0.302 -6.523) 6.537 5.885 ( 2.736 0.122 6.312) 6.880 5.975 ( 0.513 0.022 -1.415) 1.505 6.512 ( -4.166 1.704 10.172) 11.123 6.581 ( -3.129 -2.372 2.079) 4.443 6.902 ( -16.966 1.024 22.527) 28.220 7.158 ( -0.968 -0.028 -3.698) 3.823 7.382 ( -3.202 1.213 -3.515) 4.907 8.444 ( -3.104 -0.073 -26.860) 27.039 8.812 ( 2.184 2.299 4.686) 5.658 9.024 ( -0.861 7.740 6.601) 10.209 9.207 ( -0.914 -5.414 -2.192) 5.912 9.250 ( 0.543 -0.633 -2.349) 2.493 9.282 ( 0.056 -1.053 1.155) 1.564 9.335 ( 2.082 -3.912 3.018) 5.361 9.997 ( -3.827 -0.469 1.838) 4.271 10.401 ( -3.260 4.592 0.580) 5.661 10.512 ( -2.499 -3.572 3.182) 5.397 10.934 ( 1.691 2.026 -1.267) 2.927 11.262 ( 3.801 2.605 -1.694) 4.910 11.273 ( 4.608 -0.503 1.552) 4.888 11.592 ( -5.978 -2.163 11.351) 13.010 11.746 ( -3.831 0.480 1.632) 4.192 12.553 ( -3.229 1.346 -4.212) 5.475 12.642 ( -6.013 0.311 -3.701) 7.067 12.870 ( 3.487 2.371 4.134) 5.905 13.000 ( 4.436 -7.878 2.104) 9.283 14.589 ( 10.624 0.500 15.091) 18.462 15.429 ( 3.785 1.299 -0.399) 4.021 15.663 ( 11.889 0.620 -20.398) 23.618 15.829 ( -1.294 -0.715 0.466) 1.550 ======================= Grid point 182 (82/160) ======================= q-point: ( 0.33 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.359 ( 9.266 -7.229 -1.099) 11.804 1.890 ( 7.673 -5.245 15.656) 18.207 2.118 ( 7.099 -5.565 -1.432) 9.134 2.313 ( -0.647 0.694 -1.860) 2.088 2.538 ( 8.864 4.709 -4.044) 10.821 2.811 ( 4.299 2.388 7.156) 8.683 2.848 ( 7.451 2.084 4.567) 8.985 2.958 ( 5.090 3.348 8.897) 10.783 3.130 ( -1.384 -3.864 6.173) 7.413 3.223 ( -2.924 -4.568 6.174) 8.218 3.463 ( -3.506 2.397 4.065) 5.879 3.523 ( -0.622 -1.153 -2.136) 2.506 3.694 ( -0.451 2.723 1.743) 3.264 3.884 ( -6.544 5.737 3.395) 9.341 3.994 ( -5.676 1.070 4.541) 7.347 4.152 ( -4.156 1.714 -2.813) 5.303 4.301 ( -3.285 -9.380 4.351) 10.849 4.445 ( 1.424 -0.134 0.439) 1.496 4.599 ( 3.325 -1.035 -7.110) 7.917 4.785 ( -0.286 0.615 -1.194) 1.374 4.904 ( -1.623 7.845 -9.865) 12.708 5.097 ( -0.939 -0.760 -10.810) 10.877 5.400 ( -2.418 -4.131 -2.869) 5.580 5.631 ( 0.428 0.893 -5.935) 6.017 5.918 ( 1.741 1.262 4.741) 5.205 6.002 ( 2.615 -0.163 0.099) 2.622 6.430 ( -4.859 0.821 22.503) 23.036 6.570 ( -0.578 -1.670 2.507) 3.067 6.660 ( -9.479 0.559 13.886) 16.822 7.144 ( -0.641 -0.136 -3.505) 3.565 7.337 ( -1.446 0.715 -5.516) 5.747 8.438 ( 2.045 -1.272 -27.938) 28.042 8.805 ( 0.303 3.541 4.339) 5.609 8.948 ( -0.730 5.310 6.685) 8.569 9.148 ( -4.409 -1.247 1.792) 4.920 9.283 ( 0.074 -0.294 -2.326) 2.346 9.299 ( 0.783 -1.256 1.525) 2.125 9.489 ( 4.953 -9.024 2.243) 10.535 9.972 ( 0.402 -0.127 -2.587) 2.621 10.310 ( -3.189 3.162 -0.711) 4.547 10.518 ( -1.082 -3.243 3.922) 5.203 10.933 ( 1.004 2.575 0.316) 2.781 11.258 ( 0.151 4.443 -0.147) 4.448 11.330 ( 1.545 -0.459 1.786) 2.406 11.563 ( -1.855 -2.380 7.278) 7.879 11.707 ( -1.046 -1.093 3.022) 3.380 12.508 ( -1.107 -0.005 -5.581) 5.690 12.554 ( -4.906 -1.572 -3.350) 6.145 12.914 ( 2.995 0.416 4.414) 5.351 13.181 ( 12.303 0.693 -0.327) 12.327 14.670 ( -0.732 0.622 13.321) 13.355 15.449 ( 1.307 0.891 7.130) 7.303 15.747 ( 1.051 1.770 -12.945) 13.107 15.860 ( 1.551 -2.804 -7.324) 7.994 ======================= Grid point 183 (83/160) ======================= q-point: (-0.56 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.542 ( 5.638 -1.992 -2.932) 6.660 1.951 ( -4.189 -1.474 13.968) 14.657 2.176 ( -10.418 2.924 3.505) 11.374 2.291 ( 3.562 -6.304 -6.065) 9.445 2.673 ( 7.959 3.559 -7.461) 11.475 2.794 ( -0.913 2.316 14.136) 14.353 2.863 ( 1.164 1.925 6.277) 6.668 3.059 ( -6.425 -1.550 3.073) 7.289 3.101 ( 5.435 -1.208 10.334) 11.738 3.249 ( 2.214 -2.762 3.172) 4.753 3.387 ( -0.868 1.729 3.627) 4.111 3.566 ( 1.887 -3.073 -3.370) 4.936 3.659 ( -6.460 4.146 2.821) 8.178 3.749 ( 2.124 4.006 2.912) 5.388 3.944 ( -1.776 -0.860 0.060) 1.974 4.047 ( -6.937 -0.397 5.239) 8.702 4.362 ( -2.074 -8.784 4.069) 9.901 4.455 ( 1.538 0.411 -4.038) 4.340 4.662 ( 3.487 0.816 -6.946) 7.815 4.735 ( -2.188 3.713 1.748) 4.651 4.799 ( -2.130 4.666 -11.372) 12.475 5.060 ( -2.398 -0.791 -8.065) 8.451 5.474 ( 3.211 -5.814 -5.238) 8.459 5.642 ( 1.837 0.335 -4.267) 4.658 5.927 ( 1.139 2.022 3.795) 4.448 6.052 ( 2.605 0.660 0.482) 2.730 6.364 ( -1.454 -1.168 31.444) 31.500 6.560 ( -0.787 0.466 3.556) 3.672 6.620 ( 2.269 -1.280 3.363) 4.254 7.139 ( -0.292 -0.446 -3.526) 3.566 7.311 ( -1.239 -0.141 -5.878) 6.008 8.509 ( 4.281 -2.155 -27.863) 28.272 8.768 ( -0.592 2.405 3.957) 4.668 8.897 ( -0.796 2.892 5.373) 6.153 9.113 ( -0.626 1.101 5.407) 5.553 9.260 ( -2.135 -0.569 -1.073) 2.456 9.316 ( -1.037 -2.013 -0.729) 2.379 9.638 ( 2.223 -8.125 3.339) 9.061 10.003 ( 3.234 0.623 -5.032) 6.014 10.236 ( -2.464 1.473 -1.504) 3.241 10.529 ( -1.167 -2.281 4.276) 4.985 10.917 ( -0.239 2.254 1.570) 2.758 11.197 ( -1.879 4.033 0.391) 4.467 11.347 ( -0.066 -1.001 1.775) 2.039 11.550 ( -2.546 -1.938 4.789) 5.759 11.724 ( 1.020 -1.730 4.343) 4.785 12.506 ( -0.895 -1.911 -3.258) 3.882 12.513 ( -0.748 -1.128 -5.133) 5.308 12.959 ( 3.505 2.046 4.849) 6.324 13.378 ( 15.839 9.092 -2.602) 18.448 14.567 ( -10.803 0.239 11.112) 15.500 15.471 ( 2.106 0.750 8.318) 8.613 15.722 ( -3.703 -1.973 -13.219) 13.869 15.886 ( -1.592 -3.464 -4.240) 5.702 ======================= Grid point 184 (84/160) ======================= q-point: (-0.44 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.530 ( -3.847 8.376 -3.540) 9.874 1.809 ( -10.564 6.442 15.614) 19.922 1.981 ( -10.510 -3.305 5.000) 12.099 2.280 ( -6.910 0.491 -4.478) 8.249 2.684 ( -3.199 2.087 -5.994) 7.108 2.789 ( -0.287 -0.027 2.520) 2.537 2.855 ( -1.911 1.070 4.347) 4.867 2.992 ( -7.731 1.080 6.725) 10.303 3.086 ( -1.152 -5.048 5.892) 7.844 3.373 ( 6.194 -1.123 5.276) 8.214 3.455 ( 8.964 -3.344 2.241) 9.826 3.532 ( -2.743 2.888 6.909) 7.975 3.595 ( -2.324 2.582 2.628) 4.356 3.761 ( 1.238 0.955 -1.090) 1.906 3.899 ( -2.136 0.296 10.519) 10.738 4.008 ( 1.780 -3.471 -0.562) 3.941 4.362 ( -3.729 -5.098 2.256) 6.708 4.505 ( 2.169 0.449 -6.302) 6.680 4.646 ( 1.948 6.136 -2.156) 6.789 4.725 ( -2.190 2.049 -5.992) 6.700 4.760 ( 1.891 -4.785 -8.154) 9.642 5.034 ( -2.004 -0.947 -7.501) 7.822 5.561 ( 1.138 -2.980 -0.499) 3.229 5.698 ( 3.876 -2.687 -4.140) 6.276 5.915 ( -0.072 2.733 3.851) 4.723 6.055 ( -0.571 1.456 2.723) 3.140 6.478 ( 10.432 -4.790 27.634) 29.923 6.569 ( 2.074 0.254 2.863) 3.544 6.692 ( 5.168 -0.248 2.141) 5.599 7.142 ( 0.026 -0.831 -3.889) 3.977 7.294 ( -1.160 -0.922 -6.004) 6.184 8.580 ( 1.614 -1.861 -23.756) 23.883 8.759 ( 0.190 -1.058 4.117) 4.255 8.870 ( -0.025 1.385 2.582) 2.930 9.077 ( -2.142 1.567 4.676) 5.377 9.253 ( 0.536 -0.491 -0.211) 0.757 9.305 ( -2.095 -2.271 -2.083) 3.727 9.706 ( -1.696 -4.567 2.839) 5.638 10.051 ( 3.991 2.014 -3.861) 5.907 10.224 ( 1.423 -1.890 -1.355) 2.726 10.519 ( -1.994 -0.921 4.573) 5.074 10.880 ( -2.209 1.156 2.273) 3.374 11.138 ( -0.374 3.759 0.882) 3.879 11.353 ( -0.881 -1.895 0.954) 2.297 11.512 ( -4.048 -1.750 4.746) 6.479 11.778 ( 3.497 -1.965 4.489) 6.020 12.522 ( 2.076 -0.259 -1.842) 2.788 12.538 ( 0.668 -3.228 -5.760) 6.637 12.993 ( 4.448 5.169 5.603) 8.826 13.513 ( 13.372 14.917 -3.797) 20.390 14.323 ( -17.124 0.978 9.090) 19.412 15.507 ( 2.750 1.520 7.294) 7.942 15.647 ( -11.922 -10.496 -16.666) 23.023 15.887 ( -0.734 -1.290 -0.048) 1.485 ======================= Grid point 185 (85/160) ======================= q-point: (-0.33 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.308 ( -8.500 11.635 1.177) 14.457 1.511 ( -12.823 11.296 16.113) 23.487 1.853 ( -9.267 -0.378 5.864) 10.973 2.132 ( -7.706 1.409 -1.323) 7.944 2.600 ( -3.539 1.823 -3.815) 5.514 2.612 ( -14.625 4.553 -3.754) 15.771 2.805 ( -5.020 1.619 2.152) 5.697 2.838 ( -7.380 0.308 0.383) 7.396 3.184 ( 3.205 -4.354 9.563) 10.986 3.342 ( -7.798 6.176 5.942) 11.587 3.478 ( -1.784 4.525 11.093) 12.112 3.600 ( 7.812 -6.515 8.436) 13.215 3.664 ( 8.689 -5.227 4.493) 11.091 3.775 ( 1.290 0.259 -4.937) 5.109 3.964 ( 5.297 -4.535 8.543) 11.027 4.119 ( 6.674 -2.537 -2.970) 7.733 4.367 ( -1.557 -5.168 -2.115) 5.797 4.498 ( 0.435 3.049 -3.412) 4.596 4.638 ( 2.327 4.664 -2.400) 5.739 4.677 ( -1.410 1.098 -5.100) 5.404 4.835 ( -0.052 -6.030 -7.866) 9.911 4.993 ( -3.537 -0.081 -6.941) 7.791 5.579 ( -0.411 -0.815 2.141) 2.327 5.801 ( 3.082 -4.124 -2.440) 5.698 5.878 ( -0.530 2.846 3.913) 4.868 6.029 ( -0.613 1.439 2.211) 2.708 6.605 ( 2.021 -1.024 5.193) 5.666 6.706 ( 6.337 -0.575 5.724) 8.558 6.883 ( 18.272 -6.367 17.869) 26.338 7.154 ( 0.343 -1.260 -4.489) 4.675 7.288 ( -0.843 -1.434 -6.020) 6.246 8.601 ( -0.279 -2.224 -15.055) 15.220 8.777 ( -1.111 -3.747 3.366) 5.158 8.853 ( -1.235 1.041 -0.099) 1.618 9.039 ( -2.291 -1.730 -1.036) 3.052 9.236 ( -3.583 -1.103 0.295) 3.760 9.328 ( 2.810 -0.762 -0.912) 3.051 9.688 ( -2.353 -0.533 0.469) 2.458 10.111 ( 5.386 1.476 0.069) 5.585 10.302 ( 3.579 -3.498 -0.570) 5.037 10.492 ( -1.559 -0.747 5.032) 5.321 10.832 ( -2.461 -0.065 1.959) 3.147 11.112 ( 1.473 4.014 1.771) 4.628 11.348 ( -2.768 -2.440 -2.647) 4.541 11.474 ( -1.104 -2.009 9.738) 10.004 11.889 ( 6.956 -2.667 4.117) 8.512 12.560 ( 1.695 -0.690 -4.542) 4.897 12.611 ( 4.317 -3.533 -3.179) 6.420 13.011 ( 5.601 8.705 6.142) 12.036 13.536 ( 6.471 14.183 -2.834) 15.845 13.990 ( -18.394 5.124 6.431) 20.148 15.425 ( -17.755 -6.090 -17.063) 25.367 15.600 ( -1.876 -6.812 3.185) 7.750 15.891 ( 0.790 0.495 0.573) 1.095 ======================= Grid point 186 (86/160) ======================= q-point: (-0.22 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.082 ( -4.994 9.523 11.431) 15.694 1.222 ( -6.807 12.190 17.099) 22.075 1.665 ( -7.116 9.312 5.062) 12.767 2.025 ( -4.138 -1.571 1.007) 4.540 2.322 ( -13.884 2.381 -5.191) 15.013 2.504 ( -6.539 2.182 3.526) 7.743 2.644 ( -9.030 3.893 0.552) 9.849 2.754 ( -0.760 2.523 2.960) 3.963 3.126 ( -4.708 6.425 3.908) 8.872 3.280 ( 0.656 -0.777 7.799) 7.865 3.443 ( -0.866 -1.463 9.571) 9.721 3.787 ( 1.443 1.042 -4.761) 5.083 3.829 ( 8.931 -8.248 7.329) 14.195 3.842 ( 5.513 -6.015 4.362) 9.252 4.096 ( 3.385 -4.851 5.518) 8.089 4.255 ( 6.248 -1.873 -1.276) 6.646 4.402 ( 1.021 -2.632 -8.146) 8.622 4.488 ( 1.730 2.355 -0.006) 2.922 4.612 ( -0.727 4.104 4.318) 6.001 4.660 ( 0.471 -0.397 -9.538) 9.558 4.857 ( -2.821 -3.896 -6.600) 8.167 4.911 ( -5.020 1.459 -6.329) 8.209 5.581 ( -0.021 -0.713 0.575) 0.916 5.813 ( -1.090 2.102 5.844) 6.306 5.898 ( 1.028 -2.790 -1.931) 3.545 6.008 ( -0.302 1.289 1.063) 1.698 6.645 ( 1.070 -1.269 3.734) 4.087 6.764 ( 2.493 1.818 -0.327) 3.102 7.166 ( 0.340 -2.047 -3.707) 4.248 7.281 ( 1.511 -1.408 -5.575) 5.945 7.347 ( 18.511 -10.312 18.431) 28.083 8.620 ( -0.298 -3.328 -5.789) 6.684 8.796 ( -1.416 -2.801 -6.600) 7.308 8.832 ( -0.216 -3.010 1.581) 3.406 9.021 ( -2.206 -2.620 -1.504) 3.740 9.176 ( -4.662 -1.513 -0.842) 4.973 9.379 ( 1.029 -2.094 2.334) 3.300 9.659 ( -0.500 1.693 -1.713) 2.460 10.195 ( 5.287 1.315 3.303) 6.372 10.373 ( 0.450 -3.809 0.567) 3.877 10.517 ( 2.170 -3.912 5.069) 6.761 10.808 ( -0.705 -0.537 0.939) 1.291 11.100 ( 0.955 3.086 2.238) 3.930 11.294 ( -4.158 0.138 -3.148) 5.217 11.580 ( 8.046 -8.448 14.065) 18.274 12.065 ( 9.893 -4.203 3.098) 11.186 12.591 ( 1.001 -1.171 -4.250) 4.520 12.732 ( 4.271 -4.220 -4.002) 7.216 13.032 ( 10.495 12.710 5.892) 17.504 13.482 ( -3.334 3.531 0.174) 4.859 13.641 ( -8.422 14.553 2.861) 17.056 15.039 ( -33.975 -3.384 -24.357) 41.940 15.633 ( -0.473 -2.321 7.408) 7.778 15.902 ( 1.020 0.610 -0.193) 1.204 ======================= Grid point 187 (87/160) ======================= q-point: (-0.11 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.968 ( 0.613 8.966 18.865) 20.896 1.094 ( 4.659 9.778 19.925) 22.679 1.484 ( -0.414 11.222 7.218) 13.349 2.023 ( -3.573 -3.250 -3.148) 5.765 2.164 ( 2.082 -0.592 -3.516) 4.129 2.378 ( -4.576 1.413 12.752) 13.621 2.466 ( -6.303 4.286 1.919) 7.860 2.748 ( 1.435 2.261 -1.847) 3.253 3.026 ( -1.617 3.568 -2.899) 4.873 3.281 ( 0.278 1.718 13.872) 13.981 3.467 ( 0.165 -3.274 5.364) 6.286 3.798 ( 0.990 -0.450 -6.147) 6.242 3.973 ( 4.217 -4.330 3.177) 6.828 4.037 ( 4.700 -8.238 9.007) 13.080 4.159 ( -0.126 -2.971 4.233) 5.173 4.332 ( -0.158 -1.122 4.178) 4.329 4.431 ( -0.171 -0.380 -7.885) 7.896 4.490 ( 0.803 2.760 -1.052) 3.061 4.567 ( 2.469 4.259 -1.192) 5.065 4.696 ( 1.206 -2.734 -6.098) 6.791 4.788 ( -6.844 0.137 -5.621) 8.858 4.850 ( 0.676 1.118 -5.907) 6.050 5.595 ( 0.649 -1.052 -1.968) 2.324 5.783 ( -0.060 1.646 6.352) 6.562 5.910 ( -2.266 -1.823 -0.402) 2.936 5.993 ( -0.280 1.022 -0.334) 1.111 6.662 ( -0.990 -1.838 2.600) 3.335 6.762 ( -0.193 2.550 -1.283) 2.861 7.183 ( -0.231 -1.698 -4.326) 4.653 7.282 ( -0.805 -0.470 -5.722) 5.797 7.683 ( 5.625 -8.185 15.300) 18.241 8.655 ( 0.877 -3.114 0.944) 3.370 8.778 ( -3.528 -2.505 -16.637) 17.191 8.894 ( 1.428 -4.577 -0.866) 4.872 9.037 ( 2.341 -1.225 0.310) 2.660 9.124 ( -2.113 -0.999 -1.313) 2.681 9.398 ( -2.541 -3.984 4.616) 6.606 9.625 ( -1.896 1.787 -2.617) 3.693 10.226 ( 0.787 3.477 4.970) 6.117 10.437 ( 0.661 -7.761 1.035) 7.858 10.607 ( 1.418 -6.771 3.981) 7.981 10.811 ( 0.477 0.220 0.172) 0.552 11.089 ( 0.442 0.950 1.709) 2.004 11.221 ( -2.686 2.468 -2.125) 4.222 11.838 ( 4.379 -13.083 13.520) 19.316 12.295 ( 2.951 -14.394 -0.744) 14.712 12.619 ( 1.170 -1.834 -2.595) 3.386 12.767 ( -4.481 -4.211 -3.101) 6.887 13.145 ( -0.702 9.443 3.145) 9.977 13.357 ( 21.009 8.903 -3.794) 23.131 13.613 ( 8.647 2.371 6.883) 11.303 14.336 ( -33.719 19.043 -20.287) 43.717 15.624 ( -2.290 -0.452 8.843) 9.146 15.907 ( 0.022 0.411 -0.403) 0.576 ======================= Grid point 190 (88/160) ======================= q-point: ( 0.22 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.281 ( 11.717 -0.000 -1.790) 11.853 1.835 ( 9.763 -0.000 16.773) 19.408 2.062 ( 6.897 -0.000 -0.693) 6.932 2.322 ( 0.947 -0.000 -1.791) 2.025 2.593 ( 7.389 -0.000 -2.818) 7.908 2.832 ( 5.199 -0.000 10.462) 11.682 2.864 ( 12.206 -0.000 -1.862) 12.347 3.036 ( 1.597 -0.000 1.248) 2.027 3.066 ( -6.887 0.000 13.960) 15.567 3.155 ( 2.739 -0.000 6.367) 6.931 3.483 ( 1.455 -0.000 2.857) 3.207 3.515 ( -8.324 0.000 -0.855) 8.368 3.733 ( -1.528 0.000 0.681) 1.673 3.942 ( -3.415 0.000 0.387) 3.437 4.071 ( -8.188 0.000 8.031) 11.469 4.139 ( -6.050 0.000 4.302) 7.423 4.170 ( -3.705 0.000 -2.657) 4.559 4.434 ( 1.162 -0.000 6.111) 6.220 4.591 ( 4.458 -0.000 -10.701) 11.592 4.789 ( -0.336 0.000 -1.628) 1.663 5.003 ( -1.010 0.000 -9.864) 9.916 5.079 ( 1.535 -0.000 -12.300) 12.395 5.350 ( -5.747 0.000 -1.590) 5.963 5.641 ( 0.281 -0.000 -6.216) 6.222 5.932 ( 2.284 -0.000 4.839) 5.351 5.999 ( 2.520 -0.000 -0.357) 2.545 6.443 ( -5.638 0.000 21.530) 22.256 6.548 ( 0.670 -0.000 2.693) 2.775 6.667 ( -10.287 0.000 14.601) 17.861 7.143 ( -0.734 0.000 -3.656) 3.729 7.345 ( -2.094 0.000 -4.904) 5.332 8.424 ( 1.496 -0.000 -27.788) 27.828 8.839 ( -0.583 0.000 6.929) 6.954 9.071 ( 0.846 -0.000 9.100) 9.139 9.086 ( -6.239 0.000 -4.130) 7.482 9.257 ( 1.044 -0.000 -3.183) 3.349 9.292 ( -0.171 0.000 2.484) 2.490 9.394 ( 5.693 -0.000 2.423) 6.187 9.970 ( 0.696 -0.000 -1.873) 1.998 10.350 ( -5.082 0.000 -0.830) 5.150 10.475 ( 0.103 -0.000 4.479) 4.480 10.957 ( 0.170 -0.000 0.147) 0.225 11.311 ( -0.558 0.000 -2.809) 2.864 11.325 ( 1.847 -0.000 2.563) 3.159 11.536 ( -0.595 0.000 10.283) 10.300 11.692 ( -2.259 0.000 2.088) 3.076 12.507 ( -2.077 0.000 -6.545) 6.867 12.536 ( -5.038 0.000 -2.573) 5.657 12.918 ( 2.734 -0.000 5.369) 6.025 13.198 ( 18.387 -0.000 -1.660) 18.462 14.677 ( -1.051 0.000 13.572) 13.613 15.455 ( 0.638 -0.000 8.169) 8.194 15.785 ( 0.851 -0.000 -23.375) 23.390 15.813 ( 0.442 -0.000 1.597) 1.657 ======================= Grid point 191 (89/160) ======================= q-point: ( 0.33 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.492 ( 11.105 -1.960 -3.553) 11.823 1.926 ( -0.518 -0.866 12.693) 12.733 2.183 ( 2.847 -2.127 -2.278) 4.222 2.245 ( -5.417 1.294 3.607) 6.636 2.724 ( 5.736 1.435 -8.096) 10.025 2.840 ( -1.538 1.681 14.901) 15.074 2.909 ( -4.241 2.498 7.939) 9.341 3.015 ( -6.420 -2.575 5.478) 8.824 3.094 ( 9.992 0.594 6.071) 11.707 3.192 ( 1.152 -2.629 2.849) 4.044 3.422 ( -1.549 2.015 0.542) 2.599 3.503 ( 0.617 -3.009 -2.006) 3.668 3.730 ( -0.813 2.442 1.189) 2.835 3.869 ( -3.255 5.948 0.854) 6.834 3.928 ( -2.945 1.031 3.251) 4.506 4.045 ( -7.046 -1.326 2.009) 7.446 4.184 ( 0.958 -7.211 2.202) 7.600 4.431 ( -2.484 -1.869 6.727) 7.410 4.663 ( 3.973 0.363 -10.502) 11.235 4.758 ( -2.849 0.144 1.243) 3.112 4.952 ( -0.977 6.587 -10.688) 12.593 5.045 ( -3.581 -0.678 -8.823) 9.546 5.361 ( 2.810 -4.565 -6.153) 8.161 5.650 ( 1.185 0.310 -4.587) 4.748 5.959 ( 1.405 1.044 3.845) 4.225 6.056 ( 3.398 -0.052 0.095) 3.399 6.354 ( -3.629 -0.087 31.163) 31.374 6.571 ( -1.123 0.601 4.676) 4.846 6.597 ( 3.474 -0.928 3.215) 4.823 7.133 ( -0.489 -0.153 -3.679) 3.714 7.308 ( -2.054 -0.071 -4.926) 5.338 8.474 ( 3.897 -1.124 -27.838) 28.132 8.803 ( -2.750 0.975 7.201) 7.769 8.972 ( -3.285 3.583 -1.524) 5.094 9.115 ( 1.877 -0.488 7.759) 7.998 9.258 ( -2.078 0.210 -0.806) 2.239 9.277 ( -1.113 -1.816 -1.260) 2.474 9.506 ( 4.520 -4.198 4.110) 7.413 10.010 ( 3.899 0.174 -4.696) 6.106 10.259 ( -4.784 0.718 -1.583) 5.090 10.490 ( 0.332 -1.300 4.835) 5.018 10.941 ( -1.919 0.472 2.141) 2.914 11.261 ( -2.929 2.009 -2.492) 4.339 11.339 ( 0.021 -0.073 2.437) 2.439 11.530 ( -1.330 -0.154 7.687) 7.803 11.682 ( -0.176 -1.885 3.121) 3.651 12.485 ( -0.612 -0.229 -4.195) 4.245 12.493 ( -0.483 -0.847 -4.442) 4.548 12.984 ( 5.096 0.608 6.193) 8.043 13.528 ( 21.945 4.808 -5.412) 23.108 14.570 ( -10.987 0.096 11.075) 15.601 15.468 ( 0.219 -0.537 8.957) 8.976 15.696 ( -9.424 -0.582 -18.127) 20.438 15.842 ( 1.457 -1.093 1.244) 2.206 ======================= Grid point 192 (90/160) ======================= q-point: (-0.56 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.638 ( 4.016 2.722 -4.252) 6.451 1.858 ( -6.609 -0.817 10.770) 12.663 2.025 ( -10.642 6.945 6.041) 14.071 2.250 ( -3.582 -3.243 -2.609) 5.491 2.704 ( -4.857 0.240 -3.627) 6.066 2.799 ( -2.352 0.883 9.440) 9.768 2.873 ( -1.408 0.362 3.174) 3.491 2.963 ( -0.855 -2.736 9.270) 9.703 3.083 ( -5.876 2.921 3.361) 7.372 3.324 ( 6.957 -3.492 4.022) 8.762 3.416 ( 3.291 0.907 1.198) 3.618 3.560 ( -0.646 -0.992 -2.864) 3.099 3.662 ( 1.808 3.567 4.655) 6.137 3.779 ( -2.384 1.404 -1.100) 2.977 3.932 ( -4.511 -1.879 5.182) 7.123 3.956 ( 2.697 2.107 2.304) 4.125 4.243 ( -2.984 -4.762 5.632) 7.956 4.444 ( 0.620 -6.782 1.055) 6.891 4.687 ( -0.411 1.288 -4.804) 4.991 4.730 ( 0.271 -0.193 -0.543) 0.637 4.859 ( 0.127 8.964 -13.344) 16.076 5.007 ( -2.380 -1.602 -8.203) 8.691 5.468 ( 2.896 -5.817 -4.322) 7.804 5.673 ( 1.699 -0.281 -2.469) 3.010 5.961 ( 0.417 1.922 3.801) 4.280 6.076 ( -0.730 0.703 3.079) 3.241 6.401 ( 6.945 -2.867 28.371) 29.349 6.579 ( 2.554 0.545 3.369) 4.262 6.686 ( 5.862 -0.275 1.882) 6.163 7.129 ( -0.182 -0.448 -4.024) 4.053 7.277 ( -1.967 -0.775 -4.935) 5.369 8.542 ( 2.329 -1.815 -26.349) 26.514 8.749 ( -2.891 -0.109 6.363) 6.990 8.903 ( -2.021 1.676 -1.761) 3.161 9.103 ( -3.917 0.962 8.604) 9.502 9.255 ( 3.383 0.442 -1.185) 3.611 9.269 ( -1.787 -1.154 -1.965) 2.896 9.610 ( 2.125 -4.681 4.887) 7.093 10.083 ( 5.025 1.190 -5.720) 7.707 10.195 ( -2.015 -1.118 -1.576) 2.792 10.502 ( -0.415 -0.722 4.776) 4.848 10.884 ( -4.504 -0.257 3.264) 5.569 11.204 ( -0.647 2.726 -1.547) 3.201 11.334 ( -0.790 -0.275 0.954) 1.269 11.493 ( -3.038 -0.089 6.856) 7.500 11.719 ( 1.360 -3.620 3.226) 5.036 12.498 ( 1.143 -0.897 -5.893) 6.069 12.517 ( 2.789 -0.363 -2.119) 3.521 13.071 ( 6.699 2.809 7.747) 10.620 13.784 ( 15.483 11.436 -7.222) 20.559 14.347 ( -13.120 1.499 7.804) 15.339 15.426 ( -14.455 -8.789 -5.750) 17.867 15.551 ( -2.659 0.707 -1.002) 2.928 15.876 ( 1.676 -0.147 1.408) 2.194 ======================= Grid point 193 (91/160) ======================= q-point: (-0.44 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.511 ( -9.303 8.643 0.946) 12.733 1.751 ( -8.729 12.924 13.675) 20.743 1.806 ( -4.701 -3.269 4.428) 7.239 2.176 ( -4.807 1.466 -1.707) 5.307 2.616 ( -5.023 0.460 -2.509) 5.634 2.690 ( -12.087 2.173 -1.734) 12.403 2.807 ( -3.351 -0.305 3.389) 4.776 2.875 ( -8.098 2.570 1.769) 8.678 3.109 ( 7.294 -2.146 5.019) 9.110 3.407 ( -0.912 0.102 4.035) 4.138 3.491 ( 0.293 -2.655 4.513) 5.244 3.549 ( 4.534 -4.373 5.810) 8.569 3.656 ( -0.129 9.266 7.824) 12.128 3.785 ( 1.153 0.437 -0.935) 1.548 3.868 ( 0.263 -5.159 6.280) 8.131 4.070 ( 7.543 -1.636 0.427) 7.730 4.239 ( -2.101 -6.696 1.421) 7.160 4.517 ( 0.163 -2.762 -0.936) 2.921 4.671 ( -0.096 -0.180 0.346) 0.401 4.737 ( -0.559 -2.092 -2.889) 3.611 4.797 ( 2.881 8.814 -15.275) 17.870 4.976 ( -3.257 -1.600 -7.303) 8.155 5.543 ( 0.377 -3.379 0.235) 3.408 5.722 ( 2.323 -3.135 -2.592) 4.684 5.936 ( -0.680 2.796 4.751) 5.554 6.052 ( -0.856 0.810 3.438) 3.635 6.565 ( 3.878 -3.460 17.672) 18.420 6.676 ( 9.388 -1.499 7.896) 12.359 6.807 ( 9.067 -1.585 4.219) 10.126 7.133 ( 0.107 -0.788 -4.636) 4.704 7.258 ( -1.458 -1.547 -5.113) 5.537 8.568 ( -0.300 -1.346 -21.581) 21.625 8.715 ( -2.663 -2.424 4.893) 6.075 8.856 ( -3.379 -0.639 -1.967) 3.962 9.016 ( -4.913 -0.289 4.748) 6.838 9.237 ( -2.315 0.527 -1.461) 2.788 9.326 ( 4.588 0.744 0.356) 4.662 9.664 ( 0.668 -1.854 3.177) 3.739 10.137 ( 3.341 0.957 -2.687) 4.393 10.240 ( 4.421 -2.598 -2.249) 5.599 10.491 ( -1.014 0.371 4.895) 5.013 10.812 ( -4.548 -1.503 3.126) 5.720 11.182 ( 1.098 3.238 0.243) 3.427 11.316 ( -1.921 -0.831 -1.728) 2.714 11.451 ( -1.755 -0.458 8.943) 9.125 11.803 ( 3.230 -5.640 2.409) 6.931 12.530 ( 1.518 -1.254 -5.930) 6.249 12.592 ( 5.977 0.173 -2.482) 6.474 13.154 ( 7.899 5.835 8.855) 13.223 13.759 ( -6.664 7.544 -1.679) 10.205 14.153 ( -2.844 12.202 0.613) 12.544 15.203 ( -22.284 -14.048 -15.878) 30.758 15.563 ( 2.490 0.439 8.252) 8.630 15.901 ( 1.373 0.466 0.716) 1.618 ======================= Grid point 194 (92/160) ======================= q-point: (-0.33 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.279 ( -5.414 9.608 8.589) 13.978 1.489 ( -5.367 14.769 15.514) 22.082 1.762 ( -2.302 0.221 3.500) 4.195 2.079 ( -1.852 6.585 0.118) 6.841 2.376 ( -16.262 3.824 -6.196) 17.817 2.544 ( -5.256 1.371 -0.059) 5.432 2.709 ( -8.585 2.678 -1.082) 9.057 2.781 ( -0.135 0.459 1.551) 1.624 3.243 ( 5.709 -1.362 3.744) 6.962 3.290 ( -4.881 7.549 8.004) 12.036 3.492 ( -2.826 6.789 15.599) 17.246 3.650 ( 5.907 -8.496 8.823) 13.599 3.704 ( 3.907 -7.807 -0.225) 8.733 3.786 ( -0.657 -1.282 -4.186) 4.427 3.988 ( 3.619 -6.520 4.312) 8.613 4.192 ( 2.671 -4.455 2.755) 5.880 4.327 ( 5.738 -3.965 -4.848) 8.494 4.514 ( -0.426 -0.174 0.131) 0.478 4.661 ( -1.188 1.302 2.964) 3.448 4.758 ( 2.117 3.727 -11.352) 12.135 4.766 ( 0.197 0.512 -7.690) 7.710 4.921 ( -4.300 -0.699 -6.624) 7.928 5.560 ( -0.590 -1.627 1.202) 2.107 5.790 ( 0.574 -4.221 -1.412) 4.487 5.897 ( -0.507 2.580 4.759) 5.437 6.032 ( -0.546 1.063 2.358) 2.643 6.621 ( 0.881 -1.414 9.145) 9.295 6.790 ( 3.495 0.859 1.460) 3.884 7.086 ( 10.208 -8.667 12.289) 18.175 7.163 ( 5.698 -3.944 0.057) 6.930 7.256 ( -0.691 -1.881 -5.484) 5.839 8.566 ( -1.050 -2.001 -14.825) 14.996 8.708 ( -1.985 -4.311 1.626) 5.017 8.801 ( -3.725 -1.840 -1.880) 4.560 8.960 ( -3.078 -2.164 3.155) 4.910 9.184 ( -2.645 1.255 -1.737) 3.404 9.375 ( 1.980 1.120 1.959) 3.002 9.677 ( -0.013 0.334 0.247) 0.416 10.195 ( 3.087 -1.286 0.035) 3.344 10.339 ( 4.099 -0.301 -1.643) 4.426 10.477 ( 0.079 -0.326 5.667) 5.677 10.774 ( -2.196 -2.548 2.429) 4.149 11.157 ( -1.004 2.912 1.732) 3.533 11.292 ( -1.458 -0.321 -2.134) 2.604 11.476 ( 3.337 -2.918 11.102) 11.954 11.930 ( 3.088 -8.570 1.062) 9.171 12.569 ( 1.934 -0.816 -4.802) 5.241 12.701 ( 6.216 0.080 -4.371) 7.599 13.242 ( 11.719 8.810 7.795) 16.604 13.536 ( -10.676 2.490 1.191) 11.027 13.937 ( -7.628 15.081 0.305) 16.903 14.945 ( -20.192 -6.228 -19.795) 28.954 15.604 ( 1.458 -0.699 8.444) 8.597 15.915 ( 0.922 0.644 -0.111) 1.130 ======================= Grid point 195 (93/160) ======================= q-point: (-0.22 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.191 ( 6.705 12.233 13.920) 19.707 1.321 ( 2.298 13.337 17.419) 22.058 1.719 ( 1.378 9.579 2.593) 10.019 1.986 ( -4.244 1.783 -2.181) 5.094 2.160 ( -2.907 0.545 -3.908) 4.902 2.431 ( -4.404 3.440 6.327) 8.442 2.543 ( -6.983 3.386 0.813) 7.803 2.783 ( 0.721 1.075 -1.463) 1.954 3.157 ( -0.749 9.193 4.263) 10.161 3.322 ( 3.050 2.076 10.090) 10.744 3.416 ( -1.205 -0.065 9.646) 9.721 3.764 ( -3.099 -3.296 -7.404) 8.677 3.831 ( 2.566 -10.159 7.955) 13.156 3.868 ( 5.398 -8.317 3.820) 10.626 4.084 ( 1.078 -5.049 1.776) 5.459 4.259 ( -0.285 -5.416 2.631) 6.028 4.421 ( 0.562 -0.831 -4.818) 4.921 4.537 ( 1.442 0.797 2.903) 3.338 4.628 ( 0.927 0.364 2.126) 2.348 4.724 ( 1.597 7.064 -11.427) 13.528 4.773 ( -1.167 -1.146 -6.670) 6.867 4.865 ( -1.163 0.241 -7.567) 7.660 5.567 ( -0.344 -1.775 -0.627) 1.913 5.803 ( -1.564 -1.040 2.594) 3.203 5.879 ( -0.789 -0.145 2.596) 2.717 6.013 ( -0.577 1.001 1.181) 1.652 6.633 ( -1.187 -1.263 7.100) 7.309 6.807 ( 0.212 1.941 -0.712) 2.079 7.144 ( -0.344 -2.217 -3.519) 4.174 7.263 ( -0.562 -1.555 -5.306) 5.558 7.460 ( 6.467 -13.681 16.510) 22.396 8.575 ( -0.902 -4.129 -9.303) 10.218 8.714 ( -3.258 -4.111 -6.218) 8.135 8.810 ( 2.516 -3.750 -0.145) 4.518 8.962 ( 0.303 -3.817 4.238) 5.711 9.137 ( -0.807 1.222 -2.070) 2.536 9.378 ( 0.157 1.365 4.233) 4.450 9.649 ( -3.054 0.740 -1.266) 3.388 10.253 ( 0.723 -3.531 1.108) 3.771 10.352 ( -0.278 2.779 0.410) 2.823 10.515 ( 1.284 -3.382 5.294) 6.412 10.783 ( -0.246 -2.756 1.555) 3.174 11.107 ( -1.894 1.065 2.092) 3.016 11.266 ( -0.714 1.959 -0.306) 2.107 11.621 ( 5.921 -8.065 12.568) 16.064 12.038 ( -3.379 -12.059 -0.360) 12.529 12.604 ( 1.367 -0.335 -3.854) 4.103 12.744 ( -1.943 0.605 -4.624) 5.052 13.325 ( -3.807 8.228 2.782) 9.483 13.488 ( 18.170 5.791 -0.794) 19.087 13.685 ( -4.739 4.893 7.769) 10.333 14.632 ( -11.643 10.663 -22.557) 27.534 15.616 ( -0.972 -0.287 8.566) 8.626 15.917 ( -0.033 0.577 -0.490) 0.758 ======================= Grid point 196 (94/160) ======================= q-point: (-0.11 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.167 ( 5.649 16.641 10.318) 20.379 1.353 ( 12.305 11.363 18.698) 25.103 1.668 ( 8.712 10.271 5.570) 14.575 1.935 ( -1.235 -1.769 -6.930) 7.258 2.266 ( 9.926 -2.859 1.039) 10.381 2.385 ( 3.416 0.587 9.715) 10.314 2.432 ( -2.170 2.589 0.282) 3.390 2.775 ( -0.166 1.382 -1.692) 2.191 3.089 ( 2.376 8.236 1.026) 8.633 3.304 ( -1.243 2.513 14.897) 15.159 3.454 ( 1.826 -2.204 4.112) 5.010 3.748 ( -3.089 -5.723 -5.078) 8.251 3.934 ( -2.207 -9.284 8.039) 12.477 4.016 ( 3.014 -6.510 0.725) 7.211 4.130 ( -0.664 -3.239 0.980) 3.448 4.264 ( -4.349 -1.538 2.815) 5.404 4.391 ( -2.616 -1.302 1.498) 3.284 4.511 ( -1.606 0.942 1.028) 2.127 4.643 ( -1.521 4.458 -0.430) 4.730 4.702 ( 1.928 -0.517 -2.757) 3.404 4.775 ( 3.916 3.416 -14.191) 15.113 4.896 ( 4.639 -0.085 -9.163) 10.271 5.583 ( -0.161 -2.362 -2.107) 3.169 5.781 ( -2.562 -1.184 1.572) 3.231 5.855 ( -1.761 0.551 4.642) 4.995 5.993 ( -0.802 0.725 -0.307) 1.123 6.609 ( -3.178 -1.487 6.249) 7.167 6.763 ( -2.666 2.584 -1.010) 3.848 7.154 ( -1.117 -2.259 -2.622) 3.636 7.255 ( -1.948 -0.599 -2.901) 3.546 7.554 ( -8.446 -9.759 15.522) 20.187 8.594 ( -3.793 -5.615 -16.084) 17.453 8.691 ( -1.409 -2.194 -1.750) 3.140 8.895 ( 2.488 -2.688 -0.566) 3.707 9.062 ( 5.332 -4.528 2.465) 7.417 9.147 ( 2.901 0.313 -2.493) 3.838 9.370 ( 0.814 2.053 5.246) 5.692 9.556 ( -7.067 0.448 -1.088) 7.164 10.239 ( -4.466 2.557 3.188) 6.054 10.346 ( -1.192 -6.726 1.035) 6.908 10.566 ( 0.187 -3.926 4.172) 5.732 10.811 ( 0.759 -2.190 0.659) 2.410 11.095 ( 0.768 -1.205 1.421) 2.015 11.233 ( 0.244 3.568 0.234) 3.584 11.768 ( 0.371 -8.177 10.764) 13.523 12.011 ( -14.122 -10.672 2.556) 17.885 12.589 ( -4.329 -0.536 -3.491) 5.587 12.674 ( -2.865 -1.384 -4.256) 5.314 13.078 ( -9.538 9.963 5.125) 14.714 13.491 ( -8.801 9.733 0.480) 13.131 13.957 ( 25.332 0.989 9.080) 26.929 14.576 ( 25.737 10.210 -27.901) 39.308 15.587 ( -2.061 0.599 9.006) 9.258 15.900 ( -1.346 0.493 -0.189) 1.446 ======================= Grid point 200 (95/160) ======================= q-point: (-0.67 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.659 ( 8.314 -0.000 -3.306) 8.947 1.846 ( -8.842 0.000 6.379) 10.903 2.151 ( -4.387 0.000 3.770) 5.784 2.169 ( -5.249 0.000 2.607) 5.860 2.705 ( -5.331 0.000 -2.232) 5.779 2.808 ( -5.413 0.000 9.554) 10.981 2.874 ( -2.313 0.000 4.484) 5.045 2.934 ( 0.568 -0.000 10.137) 10.153 3.124 ( -5.363 0.000 2.805) 6.052 3.277 ( 7.721 -0.000 4.078) 8.732 3.466 ( 4.060 -0.000 -1.356) 4.281 3.510 ( 2.341 -0.000 -4.210) 4.817 3.698 ( -3.476 0.000 3.927) 5.245 3.849 ( -4.781 0.000 0.442) 4.801 3.865 ( -3.297 0.000 3.095) 4.522 3.970 ( 1.957 -0.000 -0.383) 1.994 4.243 ( 7.218 -0.000 2.356) 7.592 4.326 ( -7.727 0.000 10.425) 12.977 4.716 ( 1.640 -0.000 -10.253) 10.384 4.719 ( -1.301 0.000 3.762) 3.981 4.968 ( -4.006 0.000 -8.842) 9.707 4.986 ( 0.672 -0.000 -11.976) 11.995 5.394 ( 3.433 -0.000 -5.843) 6.777 5.672 ( 1.181 -0.000 -2.307) 2.592 5.981 ( 0.546 -0.000 3.990) 4.028 6.082 ( -0.727 0.000 3.025) 3.111 6.373 ( 5.483 -0.000 28.561) 29.082 6.585 ( 2.516 -0.000 3.660) 4.441 6.683 ( 6.276 -0.000 1.863) 6.547 7.125 ( -0.220 0.000 -3.944) 3.950 7.269 ( -2.333 0.000 -4.549) 5.112 8.522 ( 2.644 -0.000 -26.675) 26.806 8.749 ( -3.957 0.000 7.036) 8.072 8.921 ( -3.975 0.000 -4.502) 6.005 9.112 ( -4.135 0.000 10.510) 11.295 9.251 ( -0.410 0.000 -3.166) 3.192 9.270 ( 4.012 -0.000 -0.687) 4.070 9.557 ( 3.733 -0.000 6.079) 7.134 10.095 ( 5.923 -0.000 -6.155) 8.542 10.183 ( -3.782 0.000 -1.684) 4.140 10.494 ( 0.403 -0.000 4.811) 4.828 10.880 ( -5.210 0.000 3.655) 6.365 11.232 ( -0.957 0.000 -3.028) 3.175 11.333 ( -0.761 0.000 1.328) 1.531 11.499 ( -2.687 0.000 8.420) 8.838 11.674 ( 0.533 -0.000 2.039) 2.108 12.491 ( 1.042 -0.000 -6.889) 6.968 12.512 ( 3.486 -0.000 -1.197) 3.686 13.098 ( 7.573 -0.000 8.516) 11.396 13.902 ( 14.510 -0.000 -8.129) 16.632 14.367 ( -8.940 0.000 6.406) 10.998 15.328 ( -19.861 0.000 -6.602) 20.929 15.560 ( -1.133 0.000 1.757) 2.091 15.875 ( 2.194 -0.000 1.514) 2.666 ======================= Grid point 202 (96/160) ======================= q-point: (-0.56 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( -11.339 3.751 2.632) 12.230 1.748 ( -1.164 -2.369 2.127) 3.390 1.979 ( -7.564 9.283 9.571) 15.330 2.161 ( 0.199 -2.910 -1.146) 3.133 2.625 ( -4.065 0.617 -0.701) 4.170 2.692 ( -8.518 -1.156 4.517) 9.711 2.797 ( -6.307 -0.680 2.138) 6.694 2.911 ( -7.090 0.863 4.417) 8.398 3.109 ( 7.356 1.300 4.073) 8.508 3.372 ( 2.862 -2.480 3.674) 5.276 3.488 ( 0.481 2.704 -2.130) 3.475 3.532 ( -1.284 0.685 0.743) 1.634 3.713 ( 3.209 -5.651 6.320) 9.065 3.753 ( -2.712 1.445 -0.671) 3.145 3.850 ( -1.382 0.553 5.586) 5.781 4.075 ( 8.872 0.661 -0.867) 8.939 4.173 ( -4.958 1.793 9.928) 11.241 4.396 ( 3.091 -7.138 1.679) 7.958 4.694 ( -1.125 1.909 -3.816) 4.413 4.721 ( -0.722 -0.653 0.598) 1.143 4.906 ( -2.315 0.136 -10.052) 10.316 4.986 ( 1.504 3.913 -12.698) 13.372 5.460 ( 1.760 -3.765 -3.422) 5.384 5.689 ( 0.738 -0.579 -0.517) 1.071 5.977 ( -0.462 1.256 4.832) 5.014 6.060 ( -1.183 0.111 4.597) 4.748 6.501 ( 5.902 -2.124 24.648) 25.434 6.664 ( 7.059 -0.149 4.376) 8.307 6.793 ( 6.454 -0.203 0.691) 6.494 7.124 ( 0.110 -0.205 -4.408) 4.414 7.234 ( -1.922 -0.736 -4.655) 5.089 8.547 ( 0.501 -0.660 -24.667) 24.681 8.685 ( -3.885 -0.759 5.543) 6.811 8.843 ( -5.255 -0.434 -3.666) 6.422 9.020 ( -5.652 0.290 7.704) 9.559 9.242 ( -1.167 0.052 -3.172) 3.381 9.351 ( 5.279 1.252 1.553) 5.643 9.627 ( 3.146 -1.444 5.201) 6.248 10.144 ( -0.157 -0.042 -0.694) 0.713 10.210 ( 6.918 -0.602 -6.001) 9.178 10.498 ( 0.042 0.249 4.130) 4.138 10.788 ( -5.571 -0.745 3.773) 6.769 11.230 ( 1.308 1.400 -1.775) 2.612 11.310 ( -2.127 -0.051 -0.661) 2.228 11.454 ( -1.901 0.528 9.505) 9.708 11.705 ( 1.143 -3.414 0.843) 3.698 12.518 ( 2.137 -0.176 -5.502) 5.905 12.596 ( 6.303 0.116 -2.800) 6.898 13.231 ( 8.951 2.087 10.207) 13.735 13.838 ( -14.915 1.563 1.392) 15.061 14.409 ( 11.162 11.159 -7.664) 17.546 14.945 ( -26.413 -10.650 -8.930) 29.847 15.574 ( 1.650 0.383 7.226) 7.422 15.907 ( 1.591 0.187 0.707) 1.751 ======================= Grid point 203 (97/160) ======================= q-point: (-0.44 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( -6.210 4.923 7.606) 10.984 1.735 ( -1.231 -0.637 3.784) 4.029 1.761 ( -5.681 10.927 12.300) 17.406 2.192 ( 3.361 4.079 -3.258) 6.209 2.465 ( -15.017 4.423 -4.408) 16.264 2.554 ( -4.655 -0.194 0.179) 4.663 2.736 ( -5.937 -0.016 0.901) 6.005 2.782 ( -2.708 -0.199 3.282) 4.260 3.241 ( 6.963 1.437 0.344) 7.118 3.399 ( -0.707 3.623 7.309) 8.189 3.490 ( 2.649 -4.094 6.769) 8.342 3.548 ( 1.569 -5.106 0.426) 5.359 3.702 ( -2.777 3.079 3.728) 5.576 3.760 ( -4.261 1.057 4.228) 6.095 3.861 ( 4.651 -4.080 5.748) 8.445 4.109 ( -0.876 -2.997 5.810) 6.596 4.274 ( 10.453 -1.532 -1.976) 10.748 4.462 ( -2.438 -5.070 0.281) 5.632 4.673 ( 0.479 -0.081 -2.626) 2.670 4.711 ( -1.136 -0.526 1.286) 1.795 4.878 ( -1.627 -1.025 -10.151) 10.332 4.955 ( 1.887 7.808 -12.512) 14.869 5.509 ( -0.378 -3.676 -0.429) 3.720 5.714 ( 0.296 -2.796 -1.304) 3.100 5.947 ( -1.040 2.177 5.831) 6.311 6.046 ( -0.594 0.304 3.611) 3.673 6.586 ( 1.573 -1.998 17.235) 17.422 6.798 ( 5.727 0.013 5.447) 7.904 6.933 ( 8.294 -5.323 6.458) 11.783 7.132 ( 0.678 -0.634 -4.764) 4.853 7.221 ( -0.713 -1.528 -5.179) 5.447 8.544 ( -0.900 -0.418 -21.268) 21.291 8.643 ( -2.879 -2.453 2.752) 4.677 8.765 ( -4.357 -1.519 -1.757) 4.937 8.941 ( -3.440 -0.231 6.345) 7.221 9.204 ( -2.590 0.687 -2.716) 3.815 9.408 ( 3.038 1.922 2.486) 4.371 9.674 ( 0.723 -0.544 1.948) 2.148 10.166 ( 1.241 -1.341 1.391) 2.296 10.331 ( 6.227 -0.548 -4.546) 7.729 10.495 ( 0.584 1.492 3.342) 3.706 10.726 ( -3.167 -2.070 3.497) 5.151 11.214 ( -2.048 2.892 0.848) 3.644 11.284 ( 0.071 -0.523 -1.699) 1.779 11.447 ( 1.402 -0.367 9.539) 9.649 11.772 ( 0.388 -6.951 -0.523) 6.981 12.561 ( 2.634 -0.132 -3.977) 4.772 12.709 ( 6.758 0.459 -4.846) 8.328 13.371 ( 11.827 4.498 8.813) 15.420 13.576 ( -11.724 1.478 1.947) 11.976 14.205 ( -18.233 12.076 -1.261) 21.905 14.808 ( -4.183 -7.448 -15.812) 17.972 15.600 ( 1.344 0.079 8.021) 8.133 15.925 ( 0.860 0.401 -0.079) 0.952 ======================= Grid point 204 (98/160) ======================= q-point: (-0.33 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.383 ( 8.608 7.042 12.468) 16.707 1.592 ( 0.415 13.544 12.431) 18.388 1.768 ( 3.703 -1.614 3.199) 5.152 2.137 ( -13.368 9.296 -5.783) 17.279 2.202 ( 3.039 4.853 -2.257) 6.154 2.491 ( -2.082 2.291 -0.413) 3.124 2.591 ( -7.713 1.729 3.624) 8.696 2.789 ( 0.068 -0.558 -0.200) 0.597 3.278 ( 0.177 2.162 0.630) 2.259 3.377 ( 4.421 5.079 8.409) 10.773 3.543 ( -1.676 11.409 17.774) 21.187 3.627 ( 1.852 -9.600 6.209) 11.582 3.667 ( -1.778 -6.648 -5.054) 8.538 3.722 ( 0.396 -6.079 -0.035) 6.092 3.972 ( 1.954 -6.097 2.259) 6.789 4.150 ( 0.150 -5.332 3.208) 6.224 4.397 ( -0.827 -1.851 -2.306) 3.070 4.500 ( 4.227 -3.862 2.976) 6.453 4.646 ( -2.239 1.382 1.098) 2.851 4.730 ( 1.034 -2.074 -4.139) 4.744 4.856 ( -2.035 -0.083 -6.303) 6.624 4.910 ( 3.943 9.016 -15.590) 18.436 5.524 ( -1.166 -2.834 0.132) 3.067 5.740 ( -1.582 -4.021 -1.922) 4.729 5.909 ( -0.913 2.154 6.501) 6.909 6.030 ( -0.872 0.643 2.807) 3.008 6.610 ( -0.843 -1.189 13.166) 13.246 6.839 ( 0.801 1.601 1.181) 2.144 7.088 ( 0.227 -4.686 3.101) 5.624 7.203 ( 2.303 -6.388 2.811) 7.349 7.247 ( 3.175 -4.036 -1.630) 5.388 8.523 ( -1.688 -1.158 -16.852) 16.976 8.634 ( -1.967 -3.674 -0.910) 4.266 8.753 ( 1.658 -2.259 -0.828) 2.921 8.914 ( -0.757 -1.412 5.922) 6.135 9.157 ( -1.516 0.783 -2.458) 2.992 9.422 ( 1.526 2.670 3.512) 4.668 9.655 ( -3.373 -0.013 0.155) 3.377 10.189 ( -0.798 -2.263 1.152) 2.662 10.403 ( 1.292 -0.178 -2.950) 3.225 10.493 ( 1.463 2.203 3.973) 4.773 10.722 ( -0.679 -3.066 3.137) 4.439 11.134 ( -3.762 1.683 2.360) 4.749 11.297 ( 1.093 1.242 -0.293) 1.680 11.519 ( 4.618 -3.081 9.213) 10.756 11.829 ( -3.561 -9.325 -1.542) 10.101 12.599 ( 1.548 -0.213 -3.462) 3.798 12.764 ( -0.859 1.144 -5.266) 5.457 13.447 ( -1.092 4.458 2.031) 5.019 13.593 ( 18.672 4.772 0.164) 19.273 13.785 ( -15.412 4.933 8.581) 18.317 14.765 ( -3.194 3.839 -18.901) 19.549 15.614 ( -0.003 0.075 8.176) 8.176 15.928 ( -0.130 0.465 -0.508) 0.701 ======================= Grid point 205 (99/160) ======================= q-point: (-0.22 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( 8.413 16.230 6.007) 19.243 1.567 ( 15.193 9.368 17.042) 24.678 1.857 ( -2.071 8.876 -0.971) 9.166 1.892 ( 3.347 -2.874 -4.656) 6.414 2.260 ( 8.906 2.866 2.419) 9.663 2.439 ( 0.683 4.578 3.187) 5.620 2.470 ( -4.493 1.399 4.699) 6.650 2.783 ( -1.082 -0.457 -1.195) 1.675 3.259 ( 2.676 5.560 2.761) 6.760 3.384 ( -1.958 7.601 15.503) 17.377 3.446 ( 3.458 2.938 5.680) 7.270 3.633 ( -5.547 -5.985 -5.918) 10.081 3.740 ( -1.438 -10.530 6.581) 12.500 3.863 ( 3.645 -8.395 1.661) 9.301 4.046 ( 0.469 -5.148 0.124) 5.171 4.200 ( -0.559 -4.405 1.292) 4.624 4.366 ( -3.761 -1.839 1.704) 4.520 4.510 ( -4.351 -0.832 2.661) 5.168 4.673 ( 3.612 -0.908 0.541) 3.763 4.737 ( -0.975 1.992 -5.307) 5.752 4.819 ( 0.238 1.399 -5.730) 5.903 4.933 ( 6.642 4.667 -16.929) 18.775 5.532 ( -1.037 -2.897 -0.534) 3.123 5.731 ( -3.803 -3.546 -2.122) 5.616 5.879 ( -0.630 1.661 7.078) 7.298 6.006 ( -1.195 0.602 1.668) 2.138 6.590 ( -2.721 -0.636 11.384) 11.722 6.807 ( -2.400 2.043 0.037) 3.152 7.101 ( -2.345 -3.369 1.208) 4.278 7.230 ( -1.483 -2.145 -2.073) 3.332 7.357 ( -2.640 -9.076 9.139) 13.148 8.508 ( -2.257 -2.878 -17.790) 18.162 8.637 ( -1.471 -3.169 -1.241) 3.708 8.851 ( 4.422 -2.073 -0.615) 4.922 8.967 ( 5.433 -4.457 5.654) 9.019 9.149 ( 1.360 0.193 -2.438) 2.798 9.425 ( 2.573 3.246 4.470) 6.094 9.562 ( -7.221 0.141 0.049) 7.223 10.187 ( -2.829 -3.537 0.071) 4.529 10.362 ( -3.941 2.711 -2.025) 5.194 10.515 ( 1.707 -0.644 5.337) 5.640 10.752 ( 0.275 -3.441 2.351) 4.177 11.079 ( -1.512 -0.304 2.963) 3.340 11.294 ( 1.004 2.727 0.493) 2.947 11.638 ( 3.618 -5.031 8.922) 10.863 11.824 ( -7.239 -8.631 -0.342) 11.270 12.602 ( -2.804 0.833 -4.385) 5.271 12.663 ( -6.152 0.285 -4.656) 7.720 13.275 ( -9.420 9.902 7.017) 15.363 13.632 ( 2.206 4.756 0.392) 5.258 13.999 ( 24.544 3.366 5.004) 25.274 14.708 ( 7.283 3.621 -21.664) 23.141 15.602 ( -0.801 0.903 8.371) 8.457 15.910 ( -1.383 0.490 -0.265) 1.491 ======================= Grid point 206 (100/160) ======================= q-point: (-0.11 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( 3.381 17.629 2.871) 18.178 1.676 ( 10.896 12.206 12.630) 20.669 1.917 ( 13.357 0.242 -0.995) 13.396 2.018 ( 9.525 5.278 -1.340) 10.971 2.401 ( -1.518 -1.310 -7.397) 7.664 2.444 ( 12.892 0.082 8.989) 15.717 2.503 ( 8.903 -0.315 12.170) 15.082 2.766 ( -1.524 -1.178 0.709) 2.052 3.252 ( 4.040 11.558 5.026) 13.235 3.291 ( -1.242 1.304 11.922) 12.057 3.468 ( -0.841 -0.678 3.193) 3.370 3.620 ( -3.564 -6.006 -1.532) 7.150 3.764 ( -6.370 -8.430 4.604) 11.525 3.990 ( 2.258 -7.513 -0.671) 7.873 4.067 ( -3.234 -1.899 0.511) 3.785 4.189 ( -3.961 -1.437 3.206) 5.295 4.336 ( -1.004 -2.835 0.530) 3.054 4.480 ( -0.546 -0.728 0.845) 1.242 4.664 ( -1.581 4.826 -1.487) 5.291 4.722 ( 0.700 -0.880 -2.346) 2.601 4.833 ( 0.895 -1.195 -8.233) 8.368 5.016 ( 6.853 2.703 -15.527) 17.186 5.542 ( -1.524 -2.956 -0.090) 3.327 5.679 ( -5.375 -2.237 -3.941) 7.030 5.864 ( 0.481 0.976 7.462) 7.541 5.982 ( -0.889 0.391 0.370) 1.039 6.541 ( -3.603 -0.414 11.184) 11.757 6.726 ( -4.259 2.381 0.113) 4.881 7.056 ( -9.229 -4.387 11.569) 15.436 7.195 ( -3.456 -0.375 0.428) 3.502 7.354 ( -3.622 -4.630 0.304) 5.886 8.483 ( -3.212 -2.213 -24.133) 24.447 8.662 ( 0.842 -3.650 2.599) 4.559 8.902 ( 0.680 -1.681 4.640) 4.982 9.142 ( 7.440 -2.523 0.499) 7.872 9.196 ( 3.424 -1.342 -2.722) 4.575 9.408 ( -7.297 -0.028 1.872) 7.533 9.472 ( 4.056 4.887 2.251) 6.738 10.129 ( -7.197 -0.454 0.300) 7.217 10.294 ( -1.643 -1.919 -0.182) 2.533 10.553 ( 1.171 -1.344 4.462) 4.805 10.799 ( 1.242 -3.641 1.181) 4.025 11.097 ( 1.700 -2.800 2.249) 3.973 11.287 ( 1.825 3.232 0.665) 3.771 11.715 ( -0.434 -4.156 4.435) 6.093 11.755 ( -7.161 -2.948 5.674) 9.600 12.494 ( -4.465 -1.047 -2.852) 5.400 12.638 ( -0.628 -1.077 -5.005) 5.158 13.047 ( -6.283 9.295 6.750) 13.094 13.478 ( -8.685 14.761 -2.484) 17.306 14.322 ( 17.200 0.537 12.028) 20.995 15.028 ( 23.635 -5.890 -24.138) 34.292 15.589 ( 1.517 1.879 6.287) 6.735 15.875 ( -2.029 0.500 0.352) 2.119 ======================= Grid point 211 (101/160) ======================= q-point: (-0.56 0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.469 ( -6.725 0.000 7.539) 10.103 1.719 ( -1.148 0.000 4.210) 4.363 1.888 ( -6.893 0.000 10.111) 12.237 2.232 ( 6.612 -0.000 -6.362) 9.176 2.516 ( -10.438 0.000 -2.993) 10.859 2.544 ( -7.963 0.000 3.936) 8.883 2.726 ( 0.149 -0.000 2.094) 2.099 2.780 ( -8.319 0.000 3.261) 8.935 3.272 ( 8.926 -0.000 1.489) 9.049 3.398 ( 1.901 -0.000 3.304) 3.812 3.466 ( -1.152 0.000 3.573) 3.754 3.528 ( -1.523 0.000 0.096) 1.526 3.689 ( -4.367 0.000 -1.494) 4.615 3.721 ( 2.323 -0.000 2.799) 3.637 3.896 ( 3.154 -0.000 10.457) 10.922 4.095 ( -4.360 0.000 13.398) 14.089 4.261 ( 11.539 -0.000 -1.083) 11.590 4.385 ( -2.135 0.000 -2.244) 3.097 4.673 ( -0.615 0.000 -5.110) 5.146 4.709 ( -1.084 0.000 3.986) 4.131 4.859 ( -1.643 0.000 -8.659) 8.814 5.052 ( 2.736 -0.000 -14.295) 14.555 5.456 ( 0.142 -0.000 -2.168) 2.173 5.689 ( -0.286 0.000 0.008) 0.286 5.970 ( -1.221 0.000 5.940) 6.064 6.047 ( -0.526 0.000 4.235) 4.268 6.562 ( 2.273 -0.000 21.434) 21.554 6.797 ( 7.751 -0.000 8.542) 11.535 6.885 ( 4.356 -0.000 -0.734) 4.417 7.127 ( 0.375 -0.000 -4.644) 4.659 7.205 ( -0.733 0.000 -5.171) 5.223 8.541 ( -0.299 0.000 -24.366) 24.368 8.618 ( -3.392 0.000 4.140) 5.352 8.750 ( -4.401 0.000 -2.196) 4.919 8.940 ( -3.806 0.000 7.526) 8.434 9.210 ( -2.588 0.000 -3.016) 3.974 9.431 ( 3.147 -0.000 2.754) 4.182 9.666 ( 1.273 -0.000 2.680) 2.967 10.152 ( 1.079 -0.000 2.304) 2.544 10.325 ( 5.828 -0.000 -5.366) 7.922 10.512 ( 1.632 -0.000 1.750) 2.393 10.704 ( -3.541 0.000 3.830) 5.216 11.254 ( -4.335 0.000 0.172) 4.338 11.271 ( 2.523 -0.000 -1.397) 2.884 11.448 ( 0.763 -0.000 9.489) 9.520 11.697 ( -0.176 0.000 -1.272) 1.284 12.560 ( 2.707 -0.000 -3.567) 4.478 12.714 ( 6.922 -0.000 -5.039) 8.562 13.415 ( 11.728 -0.000 9.101) 14.845 13.590 ( -11.721 0.000 2.215) 11.929 14.347 ( -31.958 0.000 -1.289) 31.984 14.711 ( 11.008 -0.000 -14.851) 18.486 15.601 ( 1.158 -0.000 7.762) 7.848 15.929 ( 0.835 -0.000 -0.068) 0.838 ======================= Grid point 213 (102/160) ======================= q-point: (-0.44 0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.467 ( 7.887 1.950 12.294) 14.736 1.734 ( 2.506 -0.886 4.577) 5.292 1.795 ( -0.212 5.757 7.714) 9.628 2.226 ( -9.356 2.038 -6.934) 11.822 2.361 ( 0.069 8.339 -1.524) 8.477 2.484 ( 0.121 -3.650 -3.735) 5.224 2.632 ( -7.308 2.474 7.738) 10.927 2.758 ( 0.187 -2.180 2.190) 3.096 3.325 ( 0.622 3.290 -0.177) 3.353 3.461 ( 1.667 -5.833 3.175) 6.847 3.483 ( 2.890 4.334 5.687) 7.712 3.553 ( 2.968 -3.913 0.604) 4.948 3.617 ( -3.955 -2.983 -0.399) 4.970 3.747 ( -0.520 2.582 5.644) 6.228 3.916 ( 2.059 3.569 11.404) 12.125 4.063 ( -0.885 -3.705 8.233) 9.072 4.325 ( -5.924 -4.657 -3.522) 8.317 4.445 ( 8.515 -1.031 0.686) 8.605 4.668 ( -2.786 0.772 1.513) 3.263 4.696 ( 1.675 -1.179 -3.479) 4.037 4.849 ( 0.133 -0.277 -8.533) 8.539 5.061 ( 2.063 5.184 -13.667) 14.762 5.462 ( -1.138 -2.772 -0.965) 3.148 5.683 ( -1.334 -1.523 -1.819) 2.722 5.942 ( -1.495 0.979 6.988) 7.213 6.037 ( -0.858 0.160 3.907) 4.003 6.589 ( -0.030 -0.741 18.875) 18.889 6.877 ( 2.069 2.513 5.500) 6.391 6.966 ( 2.067 -5.674 5.199) 7.968 7.138 ( 0.831 -0.944 -4.176) 4.361 7.212 ( 1.182 -0.836 -5.637) 5.820 8.520 ( -1.662 0.336 -22.929) 22.992 8.581 ( -1.920 -1.645 1.849) 3.133 8.722 ( 1.364 -0.832 -1.202) 1.999 8.898 ( -1.498 -0.366 7.786) 7.937 9.167 ( -1.762 0.267 -2.600) 3.152 9.464 ( 1.891 1.335 3.491) 4.189 9.652 ( -3.336 -0.204 0.996) 3.488 10.163 ( -0.558 -0.633 2.531) 2.668 10.380 ( 0.371 -0.999 -2.440) 2.663 10.547 ( 2.702 1.926 -0.700) 3.392 10.677 ( -0.659 -1.324 3.849) 4.124 11.164 ( -5.115 1.108 2.207) 5.680 11.314 ( 2.554 0.514 -0.786) 2.721 11.486 ( 3.282 -0.596 8.071) 8.733 11.693 ( -2.741 -4.107 -2.081) 5.358 12.596 ( 1.361 -0.093 -2.887) 3.193 12.780 ( -0.349 0.459 -5.623) 5.652 13.503 ( 2.347 1.411 2.182) 3.502 13.659 ( 17.577 1.837 -0.266) 17.675 13.857 ( -20.898 2.070 8.833) 22.783 14.805 ( 0.252 0.800 -16.098) 16.119 15.616 ( 0.444 0.099 7.876) 7.889 15.934 ( -0.207 0.174 -0.494) 0.563 ======================= Grid point 214 (103/160) ======================= q-point: (-0.33 0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.677 ( 17.728 3.070 12.888) 22.131 1.766 ( 6.855 9.901 4.639) 12.905 1.832 ( 4.515 -2.370 -2.188) 5.548 2.028 ( -4.506 8.300 -1.047) 9.502 2.326 ( 2.282 2.189 -2.118) 3.806 2.498 ( -3.524 2.162 9.248) 10.130 2.537 ( 2.830 4.309 0.094) 5.156 2.760 ( -1.967 -1.794 2.304) 3.521 3.305 ( 0.410 1.731 2.364) 2.958 3.480 ( -2.018 1.263 5.702) 6.179 3.529 ( -1.876 -2.998 -3.287) 4.828 3.556 ( 0.788 -6.442 1.888) 6.759 3.633 ( -2.292 8.641 8.542) 12.365 3.724 ( 5.072 -3.559 6.602) 9.055 3.957 ( 2.108 -2.856 1.941) 4.046 4.112 ( 0.877 -4.523 3.637) 5.870 4.298 ( -2.798 -5.183 0.622) 5.923 4.489 ( -5.644 -0.977 2.683) 6.325 4.661 ( 3.563 -0.166 -0.680) 3.631 4.729 ( 0.113 -1.562 -4.150) 4.435 4.849 ( 0.160 1.338 -7.647) 7.765 5.044 ( 3.283 5.471 -14.354) 15.709 5.471 ( -1.071 -3.198 -0.663) 3.438 5.667 ( -2.951 -2.522 -3.863) 5.476 5.909 ( -1.255 1.222 7.767) 7.962 6.016 ( -1.407 0.355 3.377) 3.675 6.582 ( -1.769 -0.244 16.660) 16.755 6.848 ( -2.137 2.483 2.174) 3.931 7.014 ( -3.334 -5.532 8.158) 10.405 7.170 ( -0.107 -3.016 -1.300) 3.286 7.252 ( 1.436 -2.244 -4.320) 5.076 8.479 ( -2.258 -0.408 -22.166) 22.284 8.580 ( -0.799 -2.450 0.809) 2.701 8.816 ( 7.172 -1.427 -1.354) 7.437 8.904 ( 1.668 -2.042 7.697) 8.136 9.155 ( 0.781 0.326 -2.466) 2.607 9.483 ( 2.507 2.460 4.258) 5.520 9.561 ( -7.191 -0.309 1.089) 7.280 10.148 ( -1.806 -0.799 0.352) 2.006 10.362 ( -4.214 -1.674 -3.449) 5.697 10.552 ( 1.175 3.048 2.276) 3.982 10.695 ( 0.395 -2.130 3.443) 4.068 11.082 ( -3.294 0.391 3.593) 4.890 11.340 ( 1.930 2.003 -0.174) 2.787 11.568 ( 4.032 -2.401 6.943) 8.380 11.682 ( -3.934 -5.683 -1.158) 7.008 12.608 ( -0.096 -0.094 -3.990) 3.993 12.679 ( -9.090 0.935 -5.022) 10.427 13.447 ( -9.753 7.497 8.479) 14.941 13.674 ( 7.880 -0.082 2.657) 8.316 14.074 ( 26.768 3.725 -1.194) 27.052 14.738 ( -3.819 0.097 -15.628) 16.088 15.618 ( 0.196 0.691 7.838) 7.871 15.918 ( -1.439 0.280 -0.326) 1.501 ======================= Grid point 215 (104/160) ======================= q-point: (-0.22 0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.741 ( 0.365 14.199 -2.735) 14.465 1.856 ( 5.985 3.095 -1.814) 6.977 1.959 ( 17.951 7.262 8.606) 21.191 2.061 ( 10.464 -0.099 1.482) 10.569 2.389 ( 1.259 -2.659 -1.530) 3.316 2.483 ( 7.878 5.064 11.822) 15.082 2.541 ( 5.194 3.879 7.973) 10.276 2.735 ( -3.259 -1.805 2.219) 4.336 3.303 ( -0.530 0.073 8.827) 8.843 3.409 ( -5.396 -2.347 -0.645) 5.920 3.492 ( -0.787 5.945 4.709) 7.625 3.550 ( -1.937 0.168 0.392) 1.984 3.641 ( 2.223 -2.094 6.267) 6.972 3.848 ( 3.852 -6.613 0.427) 7.665 4.013 ( 0.659 -2.837 0.358) 2.934 4.155 ( -1.636 -2.400 0.958) 3.058 4.288 ( -4.012 -1.926 2.321) 5.019 4.423 ( -0.867 -4.637 0.905) 4.803 4.704 ( -1.955 -1.170 -3.769) 4.404 4.720 ( -0.299 0.683 0.791) 1.087 4.828 ( -0.243 1.298 -8.365) 8.469 5.071 ( 4.302 2.543 -14.525) 15.361 5.489 ( -0.185 -2.443 -0.588) 2.519 5.631 ( -3.820 -2.383 -5.577) 7.167 5.883 ( -0.667 0.881 7.913) 7.990 5.990 ( -1.172 0.313 2.287) 2.589 6.544 ( -2.654 0.585 15.762) 15.994 6.769 ( -4.422 2.108 1.546) 5.137 6.965 ( -8.843 -4.726 12.898) 16.337 7.175 ( -1.685 -1.555 -0.646) 2.382 7.287 ( 0.286 -2.298 -5.349) 5.829 8.450 ( -1.449 -1.141 -24.946) 25.014 8.601 ( 0.494 -2.610 2.160) 3.423 8.883 ( 1.133 -0.291 5.827) 5.944 9.068 ( 10.493 -4.608 0.022) 11.460 9.180 ( 1.781 -0.283 -2.214) 2.855 9.411 ( -7.797 0.203 1.622) 7.966 9.541 ( 5.414 2.463 4.543) 7.484 10.113 ( -3.462 -0.198 -2.246) 4.132 10.278 ( -5.664 -1.123 -3.171) 6.587 10.551 ( 1.349 1.283 5.293) 5.611 10.732 ( 0.962 -2.958 2.344) 3.895 11.057 ( -0.134 -1.298 3.657) 3.883 11.346 ( 1.792 2.901 0.101) 3.411 11.643 ( 0.217 -3.129 2.696) 4.136 11.683 ( -0.795 -4.103 4.547) 6.176 12.501 ( -7.335 1.132 -3.612) 8.254 12.621 ( -0.216 -0.730 -5.056) 5.113 13.219 ( -8.119 7.932 9.529) 14.820 13.721 ( -2.636 9.564 -3.862) 10.645 14.365 ( 13.144 4.414 6.881) 15.479 14.887 ( 17.735 -8.574 -17.528) 26.368 15.624 ( 2.263 1.608 6.241) 6.830 15.883 ( -2.199 0.292 0.283) 2.236 ======================= Grid point 216 (105/160) ======================= q-point: (-0.11 0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.595 ( -0.373 12.480 -1.710) 12.603 1.955 ( 9.932 7.074 5.059) 13.202 2.178 ( 14.920 3.359 0.087) 15.294 2.221 ( 6.585 3.502 -0.207) 7.461 2.372 ( 0.788 0.729 -2.285) 2.525 2.667 ( 11.430 -2.340 7.434) 13.835 2.686 ( 10.800 1.446 12.385) 16.496 2.692 ( -2.236 -3.519 7.275) 8.385 3.258 ( -3.814 0.885 11.806) 12.439 3.368 ( -5.195 -5.005 0.424) 7.226 3.445 ( 2.404 8.030 3.081) 8.930 3.509 ( -2.432 -3.074 -0.964) 4.036 3.675 ( 1.007 0.965 5.376) 5.554 3.945 ( -3.578 -2.724 1.484) 4.736 4.028 ( 1.654 0.088 -0.055) 1.657 4.063 ( -6.875 -4.422 -0.357) 8.182 4.322 ( 3.226 -4.164 -2.088) 5.667 4.491 ( 2.434 -1.603 0.705) 2.998 4.623 ( -6.925 -1.531 -3.195) 7.778 4.717 ( 0.202 0.272 0.868) 0.932 4.821 ( -0.109 -0.225 -9.377) 9.380 5.110 ( 1.731 0.535 -11.959) 12.096 5.499 ( -0.480 0.095 -1.374) 1.458 5.598 ( -1.529 -1.688 -6.906) 7.272 5.876 ( 0.144 -0.112 6.911) 6.914 5.978 ( 0.222 0.056 1.278) 1.299 6.492 ( -2.997 1.040 17.787) 18.068 6.671 ( -4.666 1.620 1.859) 5.277 6.816 ( -12.275 -2.471 16.414) 20.644 7.159 ( -0.948 -0.257 -2.039) 2.263 7.310 ( 0.335 -1.573 -6.955) 7.138 8.443 ( 0.504 -0.244 -27.654) 27.660 8.651 ( 1.889 -3.349 3.332) 5.088 8.896 ( -0.166 -0.373 7.812) 7.822 9.187 ( -3.020 -2.216 0.669) 3.805 9.244 ( 4.844 -1.957 -2.198) 5.668 9.321 ( -0.303 1.716 0.754) 1.899 9.625 ( 7.050 4.117 3.619) 8.931 10.029 ( -4.690 1.059 -3.514) 5.956 10.238 ( -1.833 -3.134 -1.561) 3.952 10.570 ( 1.085 -0.009 4.821) 4.941 10.785 ( 1.463 -3.927 1.401) 4.418 11.099 ( 1.925 -3.332 3.156) 4.977 11.349 ( 1.985 2.946 0.359) 3.571 11.643 ( -1.946 -1.456 2.211) 3.286 11.714 ( 0.231 -1.150 6.104) 6.216 12.438 ( -0.108 -1.953 -2.484) 3.162 12.619 ( -0.832 -0.383 -5.787) 5.859 13.025 ( -6.151 6.970 6.403) 11.288 13.441 ( -12.117 13.156 -3.412) 18.209 14.554 ( 9.826 -0.676 12.592) 15.987 15.251 ( 11.891 -7.109 -9.734) 16.931 15.684 ( 6.343 1.902 -3.456) 7.469 15.856 ( 0.302 0.047 0.356) 0.469 ======================= Grid point 222 (106/160) ======================= q-point: ( 0.56 -0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.705 ( 16.999 -0.000 13.037) 21.423 1.793 ( 4.012 -0.000 -1.762) 4.382 1.880 ( 7.130 -0.000 2.503) 7.557 2.124 ( -1.253 0.000 0.479) 1.341 2.335 ( -5.808 0.000 -5.797) 8.206 2.554 ( -2.660 0.000 17.374) 17.577 2.560 ( 6.288 -0.000 -5.462) 8.329 2.733 ( -1.895 0.000 4.302) 4.701 3.340 ( -1.063 0.000 3.333) 3.498 3.425 ( -2.960 0.000 -1.153) 3.177 3.491 ( -1.684 0.000 -5.441) 5.696 3.579 ( -0.869 0.000 0.270) 0.910 3.606 ( 5.483 -0.000 9.889) 11.307 3.773 ( 1.257 -0.000 3.223) 3.460 4.004 ( -1.490 0.000 9.468) 9.584 4.012 ( 4.334 -0.000 11.751) 12.525 4.222 ( -1.668 0.000 -5.092) 5.359 4.480 ( -5.587 0.000 2.530) 6.133 4.662 ( 2.998 -0.000 -0.446) 3.031 4.710 ( 0.004 -0.000 -4.277) 4.277 4.863 ( 1.183 -0.000 -9.036) 9.113 5.104 ( 0.520 -0.000 -12.008) 12.020 5.433 ( -0.229 0.000 -1.845) 1.859 5.643 ( -2.503 0.000 -4.156) 4.851 5.921 ( -1.578 0.000 7.890) 8.046 6.019 ( -1.456 0.000 4.062) 4.315 6.579 ( -1.151 0.000 19.242) 19.277 6.911 ( -2.814 0.000 -1.106) 3.024 6.914 ( -1.718 0.000 13.205) 13.316 7.141 ( 0.352 -0.000 -3.681) 3.698 7.233 ( 1.605 -0.000 -5.979) 6.191 8.478 ( -2.675 0.000 -25.563) 25.703 8.554 ( -0.410 0.000 3.141) 3.167 8.802 ( 8.297 -0.000 -2.108) 8.561 8.885 ( -0.083 0.000 8.872) 8.873 9.159 ( 0.683 -0.000 -2.476) 2.568 9.510 ( 2.923 -0.000 4.380) 5.266 9.555 ( -7.754 0.000 1.334) 7.868 10.143 ( -1.185 0.000 1.255) 1.726 10.341 ( -4.185 0.000 -4.018) 5.801 10.586 ( 0.625 -0.000 0.500) 0.800 10.674 ( 0.624 -0.000 3.703) 3.755 11.087 ( -4.129 0.000 3.709) 5.550 11.362 ( 2.526 -0.000 -0.833) 2.660 11.544 ( 3.710 -0.000 6.760) 7.711 11.623 ( -2.720 0.000 -1.317) 3.022 12.606 ( 0.250 -0.000 -3.724) 3.732 12.689 ( -9.418 0.000 -5.174) 10.746 13.534 ( -13.391 0.000 10.043) 16.738 13.659 ( 12.731 -0.000 2.594) 12.993 14.115 ( 29.142 -0.000 -4.059) 29.423 14.735 ( -8.395 0.000 -12.994) 15.470 15.625 ( 0.550 -0.000 7.642) 7.662 15.921 ( -1.470 0.000 -0.351) 1.511 ======================= Grid point 224 (107/160) ======================= q-point: (-0.33 0.56 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.852 ( 3.678 0.375 -10.534) 11.164 1.977 ( 10.443 4.718 7.017) 13.437 1.990 ( 7.458 0.831 -2.639) 7.955 2.174 ( 10.773 7.601 6.629) 14.758 2.304 ( 3.307 -5.417 2.044) 6.668 2.566 ( 5.859 3.497 17.289) 18.586 2.609 ( 0.172 0.967 2.319) 2.519 2.705 ( -1.799 -0.972 6.028) 6.365 3.301 ( -3.279 -0.122 8.803) 9.395 3.342 ( -6.695 -2.375 -2.874) 7.663 3.501 ( -1.493 1.328 -2.763) 3.410 3.563 ( 2.291 -3.124 -3.832) 5.449 3.707 ( 5.237 2.999 6.761) 9.062 3.782 ( 1.806 0.718 4.934) 5.303 3.989 ( 1.773 0.810 4.856) 5.233 4.096 ( 1.808 -3.144 2.442) 4.372 4.264 ( 0.938 -0.672 2.378) 2.643 4.333 ( -8.056 -3.397 0.740) 8.774 4.681 ( -3.694 -0.830 -4.972) 6.250 4.718 ( 2.339 -0.234 0.712) 2.457 4.860 ( -0.838 1.240 -9.000) 9.123 5.101 ( 0.406 0.538 -10.739) 10.761 5.455 ( 2.153 -0.871 -3.193) 3.948 5.598 ( -2.977 -0.884 -6.483) 7.189 5.896 ( -1.292 0.390 8.233) 8.343 5.994 ( -1.390 0.114 3.446) 3.718 6.557 ( -1.689 0.471 18.971) 19.052 6.815 ( -5.068 2.809 4.781) 7.512 6.880 ( -6.758 -3.959 9.872) 12.602 7.148 ( -0.230 -0.920 -2.358) 2.541 7.259 ( 1.244 -0.685 -7.012) 7.155 8.437 ( -1.340 -0.327 -26.701) 26.736 8.564 ( 0.948 -1.013 3.210) 3.497 8.890 ( 1.182 0.700 8.205) 8.319 8.991 ( 11.227 -2.739 -2.298) 11.782 9.179 ( 1.039 0.052 -1.825) 2.100 9.414 ( -7.681 0.077 1.505) 7.827 9.572 ( 4.883 0.801 5.701) 7.549 10.124 ( -0.925 0.868 -1.267) 1.793 10.245 ( -7.185 -1.617 -5.908) 9.441 10.582 ( 0.005 1.210 4.315) 4.481 10.692 ( 0.864 -1.029 2.961) 3.252 11.043 ( -1.183 -0.319 4.137) 4.315 11.393 ( 2.147 1.632 -0.969) 2.866 11.600 ( 0.075 -1.137 1.477) 1.866 11.615 ( 2.115 -2.337 5.133) 6.023 12.520 ( -8.554 0.629 -3.786) 9.376 12.610 ( 0.174 -0.304 -4.956) 4.968 13.333 ( -9.541 3.262 11.408) 15.225 13.834 ( 4.553 2.490 -2.092) 5.595 14.501 ( 6.729 9.099 -1.746) 11.451 14.704 ( 16.490 -9.986 -11.134) 22.263 15.647 ( 2.654 0.625 6.396) 6.953 15.886 ( -2.454 0.075 0.137) 2.459 ======================= Grid point 225 (108/160) ======================= q-point: (-0.22 0.56 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( -5.754 7.944 -6.903) 11.995 2.008 ( 6.170 -1.155 -7.148) 9.513 2.212 ( 11.549 -0.016 3.958) 12.209 2.317 ( 12.970 8.151 4.196) 15.883 2.422 ( 0.591 1.290 3.102) 3.411 2.593 ( 4.501 -3.420 10.529) 11.950 2.683 ( 2.601 0.704 7.052) 7.549 2.728 ( 8.920 2.186 15.660) 18.155 3.225 ( -6.704 -2.610 10.168) 12.456 3.282 ( -3.128 -3.235 0.044) 4.500 3.472 ( -1.192 -0.074 -4.744) 4.892 3.602 ( 2.105 5.891 -0.911) 6.322 3.730 ( 3.868 3.752 5.990) 8.057 3.858 ( 2.603 -4.835 1.572) 5.712 4.031 ( 1.072 0.129 2.868) 3.064 4.038 ( -9.975 1.188 0.225) 10.048 4.220 ( 1.787 -6.264 -1.897) 6.784 4.404 ( 1.180 -4.978 3.579) 6.244 4.604 ( -4.894 -0.429 -5.100) 7.081 4.735 ( -0.312 0.681 2.351) 2.468 4.831 ( -0.094 0.930 -11.141) 11.180 5.105 ( -0.121 -0.783 -9.103) 9.138 5.506 ( 3.204 0.603 -4.449) 5.516 5.567 ( -1.201 -1.338 -7.479) 7.692 5.877 ( -0.781 0.133 7.621) 7.662 5.978 ( -0.333 -0.062 2.323) 2.348 6.520 ( -2.084 1.565 21.224) 21.384 6.695 ( -6.703 0.987 6.485) 9.378 6.776 ( -8.099 -1.567 8.366) 11.749 7.149 ( -0.365 -0.635 -1.743) 1.890 7.286 ( 1.222 -0.851 -7.964) 8.102 8.436 ( 1.507 -0.415 -28.104) 28.147 8.604 ( 2.165 -1.505 3.770) 4.601 8.902 ( 0.689 0.762 8.523) 8.584 9.151 ( -4.930 -1.466 0.151) 5.145 9.195 ( 7.928 -2.632 -2.692) 8.776 9.350 ( 1.113 1.094 0.049) 1.561 9.665 ( 6.569 0.546 6.687) 9.390 10.061 ( -4.509 2.225 -6.058) 7.872 10.181 ( -2.414 -2.934 -2.913) 4.788 10.574 ( 0.141 0.490 5.903) 5.925 10.724 ( 0.952 -2.223 2.104) 3.206 11.053 ( 1.062 -1.448 4.057) 4.436 11.409 ( 2.373 2.918 -0.671) 3.821 11.614 ( 0.310 -1.117 2.270) 2.549 11.674 ( 1.166 -2.696 5.659) 6.376 12.421 ( -2.211 -0.185 -2.837) 3.601 12.613 ( -0.279 -0.239 -6.042) 6.053 13.143 ( -8.456 4.694 8.843) 13.105 13.665 ( -14.693 9.009 -7.049) 18.621 14.553 ( 7.301 0.584 10.332) 12.665 15.116 ( 16.327 -6.132 -9.158) 19.698 15.722 ( 7.214 1.790 -0.218) 7.436 15.849 ( -1.072 -0.607 0.636) 1.386 ======================= Grid point 226 (109/160) ======================= q-point: (-0.11 -0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.624 ( -6.348 3.411 -4.050) 8.266 2.095 ( 1.640 2.514 2.391) 3.837 2.239 ( -7.372 0.364 1.888) 7.619 2.411 ( 8.019 0.107 -2.192) 8.314 2.509 ( 9.430 6.686 -1.789) 11.697 2.651 ( 2.794 -1.273 8.841) 9.359 2.789 ( 4.169 0.043 15.228) 15.789 2.892 ( 12.204 -2.158 11.583) 16.963 3.164 ( -3.518 -1.211 2.034) 4.241 3.288 ( 0.167 -2.741 6.183) 6.766 3.416 ( -4.235 2.476 -1.398) 5.101 3.591 ( 3.329 4.015 -0.928) 5.297 3.735 ( -0.997 3.198 7.186) 7.928 3.795 ( -9.762 2.339 2.178) 10.271 3.933 ( -2.117 -5.714 -0.780) 6.143 4.106 ( 4.423 0.985 1.518) 4.779 4.348 ( 4.326 -4.635 -4.876) 7.998 4.383 ( -8.346 -10.820 -0.097) 13.666 4.569 ( 1.567 3.923 -1.614) 4.522 4.716 ( -0.832 0.054 1.230) 1.486 4.831 ( 0.728 1.265 -11.265) 11.359 5.100 ( -1.172 -0.451 -7.360) 7.466 5.536 ( 2.349 1.727 -6.203) 6.854 5.595 ( 2.953 -0.299 -5.813) 6.527 5.872 ( -0.232 -0.748 6.071) 6.121 5.990 ( 1.413 -0.650 1.327) 2.044 6.456 ( -3.927 2.012 28.970) 29.305 6.594 ( -4.066 -0.056 3.985) 5.694 6.673 ( -3.884 0.912 4.532) 6.038 7.149 ( -0.022 -0.104 -2.096) 2.098 7.309 ( 0.688 -0.527 -8.022) 8.069 8.481 ( 4.298 0.485 -28.621) 28.946 8.663 ( 2.499 -1.954 4.024) 5.124 8.896 ( -0.464 1.142 8.679) 8.766 9.084 ( -4.231 -2.878 2.232) 5.583 9.290 ( 2.102 -0.069 -3.071) 3.722 9.372 ( 1.748 2.081 0.527) 2.768 9.762 ( 4.966 1.877 6.040) 8.042 9.982 ( -2.182 0.345 -6.835) 7.183 10.188 ( -0.036 -2.162 -2.222) 3.100 10.578 ( -0.149 -0.385 5.062) 5.079 10.773 ( 1.506 -3.945 1.413) 4.453 11.095 ( 0.900 -2.723 3.763) 4.732 11.412 ( 1.610 3.786 0.222) 4.120 11.623 ( -0.408 -0.092 3.163) 3.191 11.707 ( 0.501 -1.636 5.004) 5.289 12.455 ( 4.372 -2.012 -3.041) 5.693 12.594 ( -2.085 0.281 -6.527) 6.858 12.974 ( -6.072 3.758 5.259) 8.869 13.328 ( -11.904 6.764 -1.984) 13.835 14.639 ( 0.575 -0.687 12.254) 12.287 15.339 ( 5.856 -3.825 0.410) 7.007 15.765 ( 0.759 1.974 -2.998) 3.669 15.930 ( 7.747 0.563 -8.045) 11.182 ======================= Grid point 233 (110/160) ======================= q-point: (-0.33 -0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.891 ( -12.246 0.000 -8.555) 14.938 1.966 ( 9.042 -0.000 -10.758) 14.053 2.222 ( 13.295 -0.000 6.412) 14.761 2.418 ( 11.702 -0.000 0.446) 11.710 2.425 ( 1.250 -0.000 5.194) 5.343 2.555 ( 4.989 -0.000 11.477) 12.515 2.696 ( 0.707 -0.000 6.484) 6.523 2.740 ( 8.108 -0.000 21.946) 23.396 3.206 ( -5.091 0.000 12.774) 13.751 3.246 ( -3.786 0.000 -2.809) 4.714 3.482 ( -1.327 0.000 -8.866) 8.965 3.639 ( 7.170 -0.000 -6.310) 9.551 3.785 ( -0.821 0.000 3.248) 3.350 3.814 ( 3.441 -0.000 7.853) 8.574 4.029 ( 3.123 -0.000 6.135) 6.884 4.081 ( -14.548 0.000 -0.592) 14.560 4.119 ( 2.269 -0.000 -0.154) 2.274 4.352 ( 2.141 -0.000 4.422) 4.913 4.600 ( -2.974 0.000 -6.713) 7.343 4.741 ( -0.219 0.000 2.541) 2.550 4.843 ( -0.726 0.000 -11.443) 11.466 5.094 ( -0.436 0.000 -8.041) 8.053 5.515 ( 4.725 -0.000 -5.519) 7.265 5.553 ( -1.509 0.000 -7.873) 8.016 5.878 ( -1.129 0.000 7.925) 8.005 5.977 ( -0.577 0.000 2.691) 2.752 6.538 ( -1.588 0.000 22.500) 22.556 6.707 ( -9.087 0.000 12.926) 15.800 6.759 ( -4.913 0.000 0.710) 4.964 7.141 ( 0.010 -0.000 -1.885) 1.885 7.278 ( 1.494 -0.000 -8.187) 8.322 8.431 ( 1.760 -0.000 -28.293) 28.348 8.590 ( 2.439 -0.000 4.063) 4.739 8.913 ( 0.989 -0.000 9.409) 9.461 9.134 ( -3.525 0.000 -1.816) 3.965 9.166 ( 7.118 -0.000 -1.800) 7.342 9.361 ( 1.693 -0.000 -0.372) 1.733 9.667 ( 5.584 -0.000 7.817) 9.607 10.100 ( -7.800 0.000 -7.810) 11.038 10.135 ( 1.028 -0.000 -2.284) 2.505 10.581 ( -0.763 0.000 6.183) 6.230 10.702 ( 0.786 -0.000 2.369) 2.496 11.040 ( 0.775 -0.000 4.299) 4.368 11.443 ( 2.864 -0.000 -1.786) 3.375 11.607 ( 1.606 -0.000 2.752) 3.186 11.637 ( 0.686 -0.000 5.732) 5.773 12.420 ( -3.000 0.000 -2.919) 4.185 12.610 ( -0.095 0.000 -6.120) 6.121 13.191 ( -9.288 0.000 9.835) 13.528 13.757 ( -14.895 0.000 -8.304) 17.053 14.563 ( 4.581 -0.000 8.702) 9.834 15.049 ( 19.428 -0.000 -8.092) 21.046 15.742 ( 8.736 -0.000 0.922) 8.785 15.841 ( -2.713 0.000 0.500) 2.759 ======================= Grid point 234 (111/160) ======================= q-point: (-0.22 -0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( -13.400 0.544 -7.259) 15.250 2.118 ( 5.225 0.298 -3.513) 6.303 2.249 ( -11.411 0.430 3.233) 11.868 2.396 ( 5.275 -0.935 1.602) 5.591 2.603 ( 10.633 2.863 -1.753) 11.150 2.684 ( 0.790 3.374 7.890) 8.617 2.784 ( 1.048 -1.723 20.341) 20.440 2.837 ( 14.364 -2.372 12.556) 19.225 3.179 ( -0.468 2.196 1.598) 2.756 3.240 ( 4.131 -1.941 6.128) 7.641 3.445 ( -3.132 0.729 -7.424) 8.091 3.700 ( 1.982 5.607 -0.443) 5.963 3.760 ( -9.597 0.126 2.940) 10.038 3.820 ( -0.623 -5.149 2.324) 5.683 3.881 ( -1.698 4.869 2.723) 5.832 4.110 ( 4.704 -0.398 4.384) 6.443 4.162 ( -3.833 -8.291 3.975) 9.961 4.309 ( -3.011 -1.349 -4.562) 5.631 4.625 ( 4.385 1.707 -4.330) 6.394 4.711 ( -2.412 -0.331 2.691) 3.629 4.850 ( 1.524 0.532 -12.854) 12.955 5.091 ( 0.000 -0.291 -7.258) 7.264 5.547 ( 1.102 -0.035 -6.796) 6.885 5.600 ( 5.569 0.449 -6.108) 8.278 5.862 ( -1.016 -0.243 6.861) 6.940 5.980 ( 0.796 -0.312 1.676) 1.882 6.490 ( -4.386 1.072 30.619) 30.950 6.595 ( -2.861 0.138 3.832) 4.784 6.686 ( -3.331 0.362 2.088) 3.948 7.145 ( 0.374 -0.164 -1.705) 1.753 7.302 ( 1.246 -0.192 -8.570) 8.662 8.485 ( 5.069 0.030 -28.663) 29.108 8.641 ( 3.025 -0.443 4.910) 5.784 8.921 ( 0.245 1.014 9.176) 9.235 9.042 ( -4.975 -1.256 1.444) 5.330 9.283 ( 4.493 -0.391 -4.227) 6.181 9.405 ( 2.395 1.063 -0.631) 2.695 9.760 ( 4.444 -0.886 8.322) 9.475 9.985 ( -4.756 -0.021 -7.091) 8.538 10.167 ( 2.339 -0.282 -3.231) 3.999 10.568 ( -0.940 -0.428 6.421) 6.503 10.720 ( 0.522 -1.406 1.773) 2.322 11.061 ( 0.844 -0.827 4.470) 4.623 11.484 ( 3.182 2.900 -1.699) 4.628 11.620 ( -0.744 0.182 4.571) 4.635 11.660 ( 1.273 -2.624 4.978) 5.770 12.429 ( 3.818 -0.602 -2.956) 4.866 12.597 ( -1.609 0.043 -7.249) 7.426 13.032 ( -8.218 1.759 6.919) 10.886 13.435 ( -17.643 3.311 -4.920) 18.613 14.630 ( 0.730 -0.234 11.892) 11.917 15.281 ( 7.972 -1.736 -0.723) 8.191 15.798 ( -0.902 1.138 0.108) 1.456 15.932 ( 11.408 -0.151 -8.978) 14.518 ======================= Grid point 235 (112/160) ======================= q-point: (-0.11 -0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.455 ( -11.758 -3.936 -5.793) 13.686 1.939 ( -17.626 -2.006 11.852) 21.335 2.227 ( 1.854 5.130 -1.310) 5.610 2.386 ( -10.091 -1.782 1.878) 10.418 2.586 ( -0.500 -2.353 -2.738) 3.645 2.774 ( 1.806 -2.160 -0.947) 2.970 2.849 ( 8.154 4.163 12.346) 15.370 3.099 ( 1.345 -2.010 10.035) 10.322 3.131 ( 7.486 2.992 4.697) 9.331 3.349 ( -0.575 0.912 -3.029) 3.215 3.363 ( 3.374 2.651 6.458) 7.754 3.561 ( -8.897 -0.265 3.920) 9.726 3.673 ( -1.089 2.651 0.612) 2.931 3.794 ( -3.501 1.579 5.696) 6.870 3.894 ( 1.856 -0.095 4.023) 4.431 4.062 ( -6.051 -3.369 3.701) 7.853 4.263 ( 5.448 -4.742 -2.119) 7.528 4.370 ( 3.766 -5.039 -6.712) 9.199 4.633 ( 0.000 3.497 -0.626) 3.553 4.703 ( 0.314 -0.596 1.058) 1.255 4.858 ( 0.894 1.660 -13.258) 13.391 5.088 ( -0.191 0.970 -7.714) 7.777 5.575 ( 1.646 0.013 -3.099) 3.509 5.689 ( 6.289 1.918 -5.758) 8.740 5.854 ( -0.864 -1.312 5.413) 5.636 6.006 ( 1.051 -1.061 1.321) 1.994 6.443 ( 1.723 1.589 25.724) 25.831 6.582 ( 1.186 1.651 6.706) 7.007 6.653 ( 0.055 0.222 2.489) 2.500 7.154 ( 0.595 0.176 -2.261) 2.345 7.316 ( 0.445 0.117 -8.282) 8.295 8.574 ( 5.772 1.102 -26.909) 27.543 8.698 ( 3.133 -0.839 4.224) 5.326 8.903 ( -0.795 1.954 8.855) 9.103 9.013 ( -0.725 -2.550 1.714) 3.157 9.317 ( 0.177 1.669 -2.949) 3.393 9.397 ( -1.097 1.951 -0.771) 2.367 9.810 ( -0.672 -1.118 2.110) 2.481 9.957 ( 0.960 -1.007 -0.686) 1.551 10.213 ( 3.445 0.845 -2.836) 4.542 10.561 ( -1.060 -0.774 5.186) 5.349 10.757 ( 1.052 -4.049 1.410) 4.415 11.075 ( -0.919 -1.632 3.965) 4.385 11.470 ( -0.154 4.952 1.509) 5.179 11.608 ( -1.410 -0.516 1.781) 2.329 11.714 ( 2.470 -1.624 5.134) 5.924 12.538 ( 4.764 -0.351 -5.058) 6.957 12.553 ( -0.508 -0.165 -4.871) 4.900 12.899 ( -5.343 0.845 4.035) 6.749 13.198 ( -6.303 -0.402 0.272) 6.322 14.557 ( -10.246 -0.213 11.646) 15.513 15.394 ( 4.125 -1.889 4.026) 6.065 15.791 ( 1.210 1.030 -0.665) 1.722 16.056 ( 3.774 3.519 -15.631) 16.460 ======================= Grid point 243 (113/160) ======================= q-point: (-0.22 -0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( -14.455 0.000 -7.247) 16.170 1.916 ( -19.083 0.000 11.406) 22.232 2.291 ( 6.230 -0.000 -5.259) 8.153 2.365 ( -10.183 0.000 3.461) 10.755 2.551 ( -7.747 0.000 4.744) 9.084 2.752 ( 2.076 -0.000 -4.152) 4.642 2.894 ( 9.656 -0.000 13.615) 16.692 3.072 ( 0.308 -0.000 6.132) 6.140 3.168 ( 9.698 -0.000 6.445) 11.644 3.363 ( -3.206 0.000 -8.081) 8.694 3.394 ( 6.920 -0.000 10.015) 12.173 3.558 ( -10.492 0.000 3.383) 11.024 3.742 ( -1.987 0.000 -0.551) 2.062 3.747 ( -4.841 0.000 8.309) 9.616 3.961 ( -6.319 0.000 7.627) 9.905 3.971 ( 5.547 -0.000 -1.655) 5.788 4.218 ( 6.606 -0.000 3.151) 7.319 4.320 ( 3.144 -0.000 -7.685) 8.303 4.662 ( -2.653 0.000 4.077) 4.864 4.704 ( 2.815 -0.000 -4.333) 5.167 4.871 ( 0.597 -0.000 -13.725) 13.738 5.101 ( 0.998 -0.000 -8.420) 8.479 5.573 ( 1.728 -0.000 -3.168) 3.609 5.709 ( 6.813 -0.000 -5.813) 8.956 5.841 ( -1.447 0.000 6.047) 6.217 5.995 ( 0.821 -0.000 1.387) 1.612 6.458 ( 1.543 -0.000 22.294) 22.347 6.604 ( 2.640 -0.000 9.260) 9.629 6.653 ( -0.901 0.000 2.537) 2.692 7.155 ( 0.857 -0.000 -2.027) 2.201 7.317 ( 0.735 -0.000 -8.634) 8.665 8.586 ( 6.880 -0.000 -27.757) 28.597 8.690 ( 2.480 -0.000 6.201) 6.679 8.927 ( -0.458 0.000 8.837) 8.849 8.985 ( -0.450 0.000 0.760) 0.883 9.335 ( 1.606 -0.000 -3.694) 4.028 9.421 ( -1.248 0.000 -1.593) 2.024 9.782 ( -1.514 0.000 0.743) 1.686 9.949 ( 1.394 -0.000 2.903) 3.220 10.226 ( 4.184 -0.000 -3.588) 5.511 10.549 ( -0.694 0.000 6.132) 6.171 10.715 ( -0.178 0.000 1.404) 1.415 11.059 ( -0.858 0.000 4.425) 4.507 11.556 ( 2.125 -0.000 -4.150) 4.662 11.570 ( -3.406 0.000 7.528) 8.262 11.694 ( 3.206 -0.000 4.837) 5.803 12.530 ( 8.096 -0.000 -3.408) 8.784 12.552 ( -3.239 0.000 -7.203) 7.897 12.913 ( -6.712 0.000 4.866) 8.291 13.198 ( -10.442 0.000 -0.665) 10.463 14.554 ( -10.165 0.000 11.813) 15.584 15.374 ( 4.580 -0.000 3.505) 5.767 15.801 ( 0.918 -0.000 0.550) 1.070 16.093 ( 6.089 -0.000 -16.950) 18.011 ======================= Grid point 244 (114/160) ======================= q-point: (-0.11 -0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( -12.154 -4.285 -5.167) 13.884 1.597 ( -19.484 -2.363 14.049) 24.137 2.099 ( -18.888 -0.450 7.973) 20.506 2.320 ( -0.896 6.668 -2.809) 7.291 2.479 ( -4.540 -7.607 -3.098) 9.385 2.741 ( -4.864 -0.522 -8.110) 9.471 2.912 ( -8.006 1.960 4.754) 9.515 2.959 ( -7.795 -2.120 10.785) 13.474 3.274 ( -4.982 0.055 -0.305) 4.992 3.366 ( 3.283 3.884 9.684) 10.938 3.468 ( 2.842 0.648 6.719) 7.324 3.504 ( 5.349 -1.461 10.857) 12.191 3.653 ( 1.734 2.687 3.154) 4.491 3.735 ( -0.453 -2.695 -0.564) 2.790 3.972 ( 6.281 2.650 6.606) 9.492 4.066 ( 5.149 0.273 -4.161) 6.626 4.330 ( 5.095 -1.786 1.920) 5.730 4.382 ( 2.372 -2.401 -7.201) 7.953 4.624 ( -1.925 -0.103 4.937) 5.300 4.720 ( 0.370 1.902 -4.053) 4.492 4.871 ( -0.101 -0.743 -12.699) 12.722 5.095 ( -1.130 1.735 -9.579) 9.800 5.591 ( 0.265 0.028 0.740) 0.787 5.813 ( 4.051 0.937 -0.620) 4.204 5.823 ( 0.662 -0.702 1.452) 1.743 6.001 ( -0.390 -0.672 1.742) 1.907 6.550 ( 6.558 0.112 5.239) 8.394 6.651 ( 2.026 1.037 5.153) 5.634 6.713 ( 11.883 1.033 19.522) 22.877 7.170 ( 0.994 0.333 -2.865) 3.051 7.321 ( 0.049 0.306 -8.095) 8.101 8.666 ( 3.257 2.744 -17.486) 17.997 8.736 ( 2.370 -2.599 0.233) 3.525 8.909 ( -0.726 1.785 7.730) 7.966 9.026 ( 3.842 -0.557 -2.100) 4.414 9.327 ( -0.619 2.136 -1.355) 2.604 9.379 ( -2.478 0.960 -3.023) 4.025 9.742 ( -3.936 -1.846 -4.009) 5.914 10.005 ( 4.350 0.085 9.089) 10.077 10.296 ( 4.824 1.056 -2.399) 5.490 10.550 ( 0.497 0.768 4.969) 5.053 10.730 ( 0.380 -3.940 1.316) 4.171 11.035 ( -2.231 -0.903 3.591) 4.323 11.499 ( -1.636 4.289 3.032) 5.501 11.557 ( -3.619 -1.219 1.093) 3.972 11.768 ( 5.158 -0.931 5.154) 7.351 12.517 ( 0.095 -0.233 -3.817) 3.825 12.675 ( 8.229 0.665 -3.903) 9.131 12.819 ( -4.206 -0.366 3.188) 5.290 13.122 ( -0.041 -3.893 1.359) 4.124 14.298 ( -19.987 -0.269 10.287) 22.480 15.443 ( 2.947 -0.766 4.365) 5.322 15.827 ( 2.078 0.413 -0.190) 2.127 16.084 ( -5.375 4.001 -21.831) 22.836 ======================= Grid point 253 (115/160) ======================= q-point: (-0.11 -0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.003 ( -7.628 0.000 -0.004) 7.628 1.271 ( -17.385 0.000 16.760) 24.148 1.760 ( -19.787 0.000 7.719) 21.239 2.243 ( -10.988 0.000 -0.875) 11.023 2.396 ( -2.982 0.000 -0.786) 3.084 2.605 ( -7.402 0.000 -10.463) 12.817 2.751 ( -14.145 0.000 27.625) 31.036 2.772 ( -8.015 0.000 -6.347) 10.224 3.166 ( -6.899 0.000 -3.472) 7.724 3.326 ( -3.989 0.000 11.587) 12.254 3.492 ( 0.554 -0.000 6.905) 6.927 3.718 ( 4.193 -0.000 -3.474) 5.445 3.733 ( 12.318 -0.000 7.155) 14.245 3.787 ( 8.349 -0.000 7.004) 10.898 4.117 ( 7.499 -0.000 5.689) 9.413 4.160 ( 5.405 -0.000 -6.727) 8.630 4.389 ( 2.759 -0.000 2.383) 3.646 4.407 ( 2.049 -0.000 -7.475) 7.750 4.590 ( -1.997 0.000 6.537) 6.835 4.741 ( 0.641 -0.000 -4.067) 4.117 4.840 ( -1.979 0.000 -11.018) 11.195 5.055 ( -4.768 0.000 -9.949) 11.032 5.589 ( -0.240 0.000 1.648) 1.666 5.788 ( -1.533 0.000 6.049) 6.240 5.911 ( 3.943 -0.000 -3.333) 5.164 5.990 ( -0.483 0.000 0.880) 1.004 6.634 ( 3.797 -0.000 -0.301) 3.808 6.683 ( 1.923 -0.000 1.579) 2.488 7.063 ( 24.894 -0.000 22.659) 33.662 7.189 ( 0.960 -0.000 -3.672) 3.796 7.321 ( 0.167 -0.000 -6.407) 6.409 8.711 ( -1.429 0.000 7.802) 7.932 8.748 ( 3.399 -0.000 -19.717) 20.008 8.919 ( 0.711 -0.000 5.425) 5.471 9.058 ( -1.518 0.000 -4.382) 4.638 9.325 ( -4.185 0.000 -4.589) 6.211 9.387 ( 6.720 -0.000 -1.348) 6.853 9.662 ( -4.542 0.000 -3.234) 5.575 10.091 ( 4.993 -0.000 10.719) 11.825 10.386 ( 5.031 -0.000 -0.851) 5.103 10.619 ( 6.253 -0.000 4.384) 7.636 10.704 ( 0.004 -0.000 1.063) 1.063 10.999 ( -0.687 0.000 3.219) 3.291 11.423 ( -8.206 0.000 -5.858) 10.083 11.585 ( 8.410 -0.000 13.032) 15.510 11.862 ( 6.139 -0.000 6.582) 9.001 12.555 ( 4.174 -0.000 -1.436) 4.414 12.747 ( -1.887 0.000 1.668) 2.519 12.825 ( 6.213 -0.000 -3.412) 7.088 13.137 ( 5.068 -0.000 2.418) 5.615 13.903 ( -25.773 0.000 7.172) 26.752 15.450 ( -4.111 0.000 -2.216) 4.670 15.864 ( 1.990 -0.000 -0.198) 1.999 15.912 ( -16.606 0.000 -22.305) 27.808 ======================= Grid point 254 (116/160) ======================= q-point: ( 0.00 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.235 ( -7.901 0.000 12.964) 15.182 1.352 ( 16.029 -0.000 5.398) 16.914 1.548 ( -2.877 0.000 15.185) 15.455 1.925 ( -8.265 0.000 -14.418) 16.619 2.104 ( -4.848 0.000 -5.053) 7.003 2.127 ( 6.613 -0.000 -2.693) 7.140 2.654 ( 3.333 -0.000 -2.095) 3.937 2.678 ( -4.184 0.000 -3.740) 5.612 3.264 ( -5.090 0.000 30.896) 31.313 3.579 ( -0.057 0.000 14.047) 14.047 3.618 ( -0.667 0.000 5.316) 5.358 3.690 ( 2.539 -0.000 -6.038) 6.550 3.890 ( 0.147 -0.000 -9.890) 9.891 3.961 ( 6.956 -0.000 -25.180) 26.123 4.266 ( 3.153 -0.000 5.463) 6.308 4.363 ( 0.705 -0.000 -4.526) 4.581 4.476 ( -1.650 0.000 7.744) 7.918 4.485 ( -2.929 0.000 6.628) 7.246 4.566 ( -0.660 0.000 1.630) 1.759 4.681 ( 3.246 -0.000 -7.353) 8.037 4.718 ( -2.209 0.000 1.978) 2.965 4.747 ( -1.175 0.000 -0.604) 1.321 5.621 ( -1.560 0.000 6.120) 6.315 5.818 ( -0.699 0.000 -9.098) 9.125 5.894 ( 1.332 -0.000 3.975) 4.192 5.956 ( -0.782 0.000 -1.770) 1.935 6.720 ( 0.120 -0.000 1.752) 1.756 6.733 ( -0.589 0.000 0.672) 0.894 7.123 ( -0.445 0.000 -1.921) 1.972 7.160 ( 0.624 -0.000 -5.088) 5.126 8.050 ( 4.949 -0.000 14.517) 15.338 8.385 ( -4.334 0.000 -18.610) 19.108 8.792 ( 0.021 -0.000 5.024) 5.024 8.887 ( 0.017 -0.000 -4.146) 4.146 9.052 ( 3.221 -0.000 2.386) 4.009 9.102 ( -2.943 0.000 -2.372) 3.779 9.498 ( -4.250 0.000 1.847) 4.634 9.542 ( 2.317 -0.000 -2.351) 3.301 10.345 ( -1.230 0.000 8.163) 8.256 10.491 ( 2.655 -0.000 -4.880) 5.556 10.769 ( 0.906 -0.000 1.010) 1.357 10.775 ( -0.680 0.000 0.585) 0.897 11.100 ( 1.805 -0.000 0.655) 1.920 11.122 ( -2.528 0.000 -2.110) 3.293 12.173 ( -2.419 0.000 7.736) 8.106 12.320 ( 3.737 -0.000 -7.073) 8.000 12.698 ( 0.628 -0.000 3.406) 3.464 12.804 ( 0.010 -0.000 -6.128) 6.128 13.078 ( -22.624 0.000 1.058) 22.649 13.100 ( 33.455 -0.000 -1.115) 33.473 13.732 ( 27.870 -0.000 7.121) 28.765 13.891 ( -40.802 0.000 -8.442) 41.667 15.786 ( -1.427 0.000 6.074) 6.240 15.875 ( 0.453 -0.000 -2.642) 2.680 ======================= Grid point 255 (117/160) ======================= q-point: ( 0.11 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.154 ( -4.782 -5.572 6.572) 9.854 1.575 ( 5.986 -4.119 3.890) 8.242 1.675 ( 16.392 -2.173 16.690) 23.494 1.852 ( 0.206 -0.106 -4.141) 4.147 2.101 ( 4.217 -1.024 -9.067) 10.052 2.278 ( 10.691 0.312 -2.854) 11.069 2.630 ( 0.254 1.192 -3.275) 3.494 2.700 ( 1.882 -0.162 -0.562) 1.970 3.251 ( 0.036 -4.671 27.905) 28.293 3.575 ( -2.028 -0.900 12.608) 12.802 3.605 ( 0.072 1.509 5.237) 5.451 3.732 ( 3.305 3.032 -4.992) 6.711 3.892 ( 0.189 -1.357 -10.634) 10.722 4.072 ( 4.213 0.318 -22.445) 22.839 4.219 ( -4.038 4.875 0.265) 6.336 4.295 ( -4.839 1.877 -4.659) 6.975 4.400 ( -1.682 3.386 4.930) 6.212 4.485 ( -2.244 -3.922 2.981) 5.413 4.603 ( 2.957 -0.065 6.340) 6.996 4.679 ( -1.372 0.259 -1.176) 1.825 4.701 ( -2.608 -0.274 3.749) 4.575 4.766 ( 3.608 -0.397 -4.693) 5.932 5.592 ( -1.595 0.531 4.570) 4.869 5.774 ( -3.753 0.808 -5.309) 6.551 5.931 ( 2.202 -0.861 3.649) 4.348 5.951 ( -0.330 -0.856 -1.735) 1.963 6.705 ( -1.687 0.073 2.672) 3.160 6.720 ( -1.857 -1.440 0.906) 2.518 7.112 ( -0.478 0.376 -1.934) 2.027 7.169 ( 0.671 0.383 -4.621) 4.685 8.016 ( -7.003 3.173 16.288) 18.011 8.226 ( -11.611 2.507 -20.896) 24.037 8.813 ( 2.412 1.339 4.827) 5.559 8.910 ( 3.414 1.579 -3.632) 5.229 9.081 ( 0.943 0.416 -2.984) 3.157 9.120 ( 4.352 -0.536 1.951) 4.799 9.421 ( -4.936 -1.264 2.423) 5.642 9.534 ( -3.024 0.144 -0.023) 3.027 10.312 ( -3.247 0.043 6.598) 7.354 10.492 ( -0.111 5.819 -3.895) 7.003 10.721 ( -3.261 0.960 3.308) 4.743 10.782 ( -0.079 -1.060 -2.798) 2.993 11.104 ( 0.190 -0.437 -1.285) 1.371 11.153 ( 3.081 -2.029 0.690) 3.753 12.017 ( -11.151 4.143 2.656) 12.189 12.190 ( -13.458 2.695 -2.336) 13.923 12.661 ( -2.144 3.817 0.826) 4.455 12.694 ( -2.724 10.171 -1.978) 10.714 12.914 ( -7.191 -10.263 -1.384) 12.608 13.348 ( -20.596 -6.802 2.808) 21.871 13.862 ( 41.845 -5.753 -17.123) 45.577 14.235 ( 28.588 -0.730 14.399) 32.017 15.755 ( -2.296 -0.142 7.050) 7.416 15.871 ( -0.927 -0.122 -2.250) 2.437 ======================= Grid point 256 (118/160) ======================= q-point: ( 0.22 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.194 ( 0.298 -10.371 0.736) 10.401 1.760 ( 9.830 -5.446 7.294) 13.397 1.919 ( 9.131 -1.039 0.160) 9.191 1.975 ( 11.381 -4.259 11.580) 16.785 2.224 ( 8.540 0.900 -8.200) 11.873 2.470 ( 11.494 -1.663 -2.794) 11.945 2.678 ( 6.802 1.882 -0.325) 7.065 2.746 ( 4.170 -1.183 -0.466) 4.360 3.350 ( 3.493 -6.779 22.307) 23.575 3.522 ( -3.562 1.164 10.100) 10.773 3.580 ( -2.229 2.060 3.717) 4.799 3.716 ( -0.734 4.662 -1.359) 4.911 3.884 ( -7.223 -0.325 -6.841) 9.953 3.997 ( -0.743 3.191 -4.411) 5.495 4.168 ( -0.771 5.374 -1.521) 5.638 4.221 ( -1.172 1.106 -8.805) 8.951 4.344 ( -2.673 4.024 -2.315) 5.356 4.504 ( 1.124 -5.220 -6.850) 8.685 4.607 ( -5.399 0.189 6.008) 8.079 4.652 ( 1.655 -2.441 6.353) 7.004 4.703 ( 1.394 0.886 -2.328) 2.854 4.810 ( 1.790 1.318 -5.254) 5.705 5.557 ( -1.668 1.180 2.042) 2.889 5.673 ( -6.792 1.389 -1.692) 7.136 5.954 ( -0.007 -0.869 -0.580) 1.044 5.981 ( 1.716 -1.353 3.712) 4.307 6.673 ( -2.326 -0.930 3.781) 4.535 6.697 ( -2.474 -1.471 1.456) 3.226 7.101 ( -0.479 0.201 -1.430) 1.522 7.171 ( 0.495 1.137 -3.886) 4.079 7.790 ( -14.315 4.887 21.171) 26.020 7.990 ( -11.033 2.814 -25.876) 28.271 8.824 ( 1.497 4.009 3.868) 5.768 8.962 ( 4.257 1.662 -1.833) 4.924 9.124 ( 4.035 -0.457 -3.663) 5.469 9.202 ( 4.482 -0.308 1.287) 4.674 9.364 ( -5.045 -2.857 -0.657) 5.835 9.475 ( -2.673 -1.687 4.488) 5.490 10.220 ( -7.406 0.644 5.828) 9.446 10.384 ( -2.748 7.924 -2.546) 8.765 10.682 ( -1.742 -1.541 6.033) 6.466 10.800 ( 1.639 0.271 -5.351) 5.603 11.128 ( 2.349 0.243 -1.937) 3.054 11.236 ( 4.365 -1.329 1.097) 4.693 11.812 ( -7.009 4.184 -1.253) 8.258 11.945 ( -11.144 0.481 4.358) 11.976 12.564 ( -2.898 6.285 2.083) 7.228 12.592 ( -1.463 3.917 -3.502) 5.454 12.928 ( -3.713 -9.889 0.199) 10.565 13.213 ( -8.707 -10.991 2.127) 14.182 14.539 ( 33.440 -0.479 -22.622) 40.376 14.661 ( 20.967 1.464 17.636) 27.437 15.722 ( -2.026 -0.703 7.246) 7.556 15.849 ( -1.596 -0.336 -1.954) 2.545 ======================= Grid point 257 (119/160) ======================= q-point: ( 0.33 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.347 ( 4.350 -11.272 -0.771) 12.107 1.984 ( 11.002 -2.481 5.833) 12.697 2.110 ( 6.932 -6.042 1.308) 9.288 2.166 ( 7.583 -3.979 4.977) 9.904 2.330 ( 7.494 5.052 -3.265) 9.609 2.680 ( 9.597 -2.422 -1.463) 10.006 2.802 ( 7.630 -2.209 1.732) 8.130 2.887 ( 11.394 0.583 2.315) 11.641 3.406 ( -4.509 -0.160 8.534) 9.653 3.473 ( -6.924 2.792 2.113) 7.759 3.491 ( 0.260 1.423 6.753) 6.906 3.619 ( -5.226 1.375 2.798) 6.085 3.755 ( -3.103 -1.989 1.145) 3.859 4.011 ( -0.596 0.549 0.947) 1.246 4.099 ( 1.334 5.054 2.513) 5.800 4.191 ( -5.181 5.313 -0.522) 7.439 4.220 ( -1.065 2.732 -10.049) 10.468 4.525 ( -4.318 -2.016 2.557) 5.409 4.585 ( 0.030 -5.453 -4.729) 7.218 4.700 ( 0.721 2.808 -1.010) 3.070 4.726 ( 2.823 -1.079 -2.875) 4.171 4.805 ( 1.209 1.207 -7.066) 7.270 5.513 ( -3.336 1.815 -2.006) 4.295 5.535 ( -5.857 0.886 2.254) 6.338 5.965 ( 0.432 -0.541 0.406) 0.802 6.013 ( 0.593 -1.000 3.416) 3.608 6.653 ( -1.470 -1.610 4.047) 4.597 6.669 ( -2.202 -1.024 2.361) 3.387 7.092 ( -0.583 -0.039 -0.540) 0.796 7.163 ( 0.258 1.473 -2.624) 3.021 7.493 ( -14.921 3.944 25.732) 30.005 7.832 ( -4.144 1.122 -31.052) 31.348 8.797 ( 0.543 4.421 2.205) 4.970 9.001 ( 2.056 1.719 0.493) 2.725 9.204 ( 3.559 -0.917 -2.489) 4.439 9.256 ( -1.401 -0.472 1.078) 1.830 9.304 ( 0.329 -0.290 -0.724) 0.846 9.525 ( 2.758 -6.370 3.103) 7.603 10.088 ( -6.250 0.919 6.058) 8.753 10.276 ( -2.321 5.782 -3.660) 7.226 10.685 ( -0.696 -2.374 7.065) 7.486 10.820 ( 1.990 1.994 -4.899) 5.651 11.165 ( 2.724 1.600 -1.806) 3.639 11.310 ( 3.171 -0.112 0.699) 3.249 11.708 ( -2.111 1.856 0.225) 2.820 11.824 ( -4.274 -1.150 3.939) 5.925 12.476 ( -1.771 3.503 0.843) 4.015 12.538 ( -1.914 1.493 -3.724) 4.445 12.962 ( -2.219 -7.002 1.348) 7.468 13.201 ( -4.732 -8.551 0.773) 9.804 14.907 ( 10.032 2.550 17.535) 20.362 14.986 ( 21.612 2.537 -21.086) 30.301 15.702 ( -1.824 -1.281 5.650) 6.074 15.835 ( -0.382 -0.639 -1.265) 1.468 ======================= Grid point 258 (120/160) ======================= q-point: ( 0.44 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.506 ( 2.711 -6.055 -0.190) 6.638 2.139 ( 5.929 3.304 3.065) 7.447 2.199 ( -0.884 -7.271 -1.604) 7.498 2.332 ( 3.611 -1.931 1.164) 4.258 2.401 ( 5.730 0.890 0.077) 5.799 2.820 ( 7.308 1.147 4.239) 8.526 2.939 ( 3.816 -2.745 -0.095) 4.701 3.080 ( 7.919 -0.115 3.854) 8.808 3.247 ( -4.962 4.703 1.739) 7.054 3.372 ( -5.397 -1.730 2.015) 6.015 3.431 ( -1.707 2.572 -1.275) 3.340 3.591 ( 0.152 -1.561 6.737) 6.917 3.762 ( -3.636 -2.678 -0.852) 4.596 3.944 ( -5.508 0.784 11.503) 12.778 4.032 ( -2.967 2.090 0.989) 3.762 4.130 ( 5.324 2.835 2.904) 6.694 4.227 ( 2.426 2.466 -10.478) 11.034 4.491 ( -2.933 -3.757 -3.514) 5.921 4.595 ( -2.718 1.751 2.644) 4.177 4.664 ( -2.102 2.146 -0.489) 3.044 4.713 ( 0.821 1.191 -2.011) 2.477 4.879 ( 3.200 -2.155 -10.130) 10.839 5.414 ( -3.086 -0.327 -1.532) 3.461 5.505 ( 0.546 0.519 -2.248) 2.371 5.974 ( 0.117 0.188 1.861) 1.874 6.027 ( 0.753 -0.197 1.469) 1.663 6.645 ( -1.434 -0.554 2.092) 2.596 6.660 ( 0.300 -1.405 3.922) 4.177 7.076 ( -1.655 0.073 3.942) 4.276 7.152 ( -0.297 0.735 1.656) 1.836 7.260 ( -8.802 1.756 21.525) 23.321 7.816 ( 2.970 -0.536 -33.508) 33.643 8.770 ( 0.572 2.639 1.350) 3.019 9.003 ( -0.166 0.635 2.284) 2.376 9.202 ( -2.176 0.816 2.115) 3.143 9.244 ( 0.840 -0.271 -1.396) 1.652 9.359 ( 2.018 -0.784 0.902) 2.346 9.640 ( 2.839 -5.308 -1.995) 6.341 10.021 ( -1.298 -0.788 6.273) 6.454 10.188 ( -2.001 4.172 -4.523) 6.470 10.697 ( -0.988 -2.388 7.291) 7.735 10.827 ( 1.983 3.208 -4.197) 5.642 11.179 ( 0.832 1.821 -0.449) 2.052 11.347 ( 1.156 -0.472 -0.488) 1.340 11.682 ( -0.663 -0.007 1.945) 2.055 11.798 ( -0.506 -0.661 2.607) 2.737 12.440 ( 0.127 0.880 -0.563) 1.053 12.497 ( -1.783 0.239 -3.341) 3.794 12.982 ( -0.859 -2.341 2.038) 3.221 13.208 ( -1.240 -3.228 -0.404) 3.482 14.964 ( -1.255 1.345 16.672) 16.774 15.234 ( 11.667 2.380 -17.645) 21.286 15.687 ( -1.615 -1.717 3.544) 4.256 15.848 ( 0.875 -0.614 -1.397) 1.759 ======================= Grid point 259 (121/160) ======================= q-point: (-0.44 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.502 ( -4.290 4.580 -0.089) 6.276 2.161 ( -0.384 0.285 2.850) 2.890 2.190 ( -5.218 1.543 1.365) 5.610 2.306 ( -8.041 -3.761 -0.343) 8.883 2.464 ( 1.891 1.124 -5.631) 6.046 2.874 ( -7.415 3.904 0.375) 8.389 2.922 ( 0.859 0.481 0.807) 1.273 3.111 ( 0.309 -1.088 -0.018) 1.131 3.260 ( -3.377 -3.145 1.096) 4.743 3.365 ( 6.866 -1.871 1.677) 7.311 3.413 ( 3.012 1.455 1.883) 3.839 3.640 ( 2.201 -2.404 2.887) 4.354 3.684 ( -1.328 1.634 5.181) 5.592 3.911 ( -1.820 -3.836 11.085) 11.871 4.005 ( 0.334 -0.275 5.312) 5.329 4.200 ( 0.299 3.367 -9.771) 10.339 4.235 ( 3.332 -1.065 1.329) 3.742 4.422 ( -6.104 4.162 2.257) 7.725 4.561 ( 3.289 -0.939 -2.569) 4.278 4.617 ( -2.613 0.132 1.506) 3.019 4.738 ( 1.660 -0.069 -1.319) 2.121 4.902 ( -1.274 -0.837 -8.399) 8.536 5.446 ( 4.367 -2.596 -4.939) 7.085 5.538 ( 3.313 -0.674 -4.562) 5.678 5.963 ( -0.722 0.923 2.531) 2.790 6.046 ( 1.500 0.855 0.030) 1.727 6.631 ( -0.420 0.115 3.101) 3.132 6.688 ( 1.596 -0.398 1.410) 2.166 7.046 ( -0.768 -0.931 16.282) 16.327 7.147 ( -0.133 -1.069 10.518) 10.573 7.177 ( -1.245 0.878 1.552) 2.175 7.914 ( 7.512 -1.760 -32.801) 33.696 8.771 ( 1.147 0.048 1.284) 1.722 8.993 ( -1.496 -1.273 3.100) 3.670 9.174 ( 0.875 3.932 4.692) 6.184 9.245 ( -0.866 -0.996 -1.369) 1.902 9.357 ( -2.979 -1.275 0.332) 3.257 9.690 ( -0.375 -0.143 -6.306) 6.318 10.059 ( 2.518 -3.525 7.112) 8.328 10.147 ( 1.059 1.227 -4.686) 4.959 10.695 ( -1.751 -1.688 7.547) 7.929 10.823 ( 1.633 3.834 -3.889) 5.700 11.160 ( -1.284 1.098 1.304) 2.134 11.364 ( -0.566 -2.028 -2.079) 2.959 11.668 ( -1.674 -0.919 3.107) 3.647 11.810 ( 1.691 0.456 1.675) 2.423 12.459 ( 1.397 -1.228 -1.161) 2.193 12.480 ( 0.286 -0.361 -2.825) 2.862 12.976 ( 0.326 2.700 2.428) 3.646 13.221 ( 2.699 3.171 -1.468) 4.415 14.852 ( -11.725 -0.355 16.609) 20.334 15.341 ( 2.917 0.117 -16.536) 16.792 15.688 ( -0.442 -2.269 2.766) 3.605 15.862 ( 0.211 -0.062 -2.641) 2.650 ======================= Grid point 260 (122/160) ======================= q-point: (-0.33 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.321 ( -6.534 10.309 0.812) 12.232 1.959 ( -13.663 5.916 10.556) 18.251 2.156 ( -10.264 0.007 -4.683) 11.282 2.178 ( -4.010 -3.744 2.569) 6.058 2.428 ( -3.790 2.900 -10.181) 11.244 2.673 ( -9.485 4.519 -2.464) 10.791 2.892 ( -3.901 0.378 -3.703) 5.392 2.920 ( -15.795 1.504 -3.750) 16.303 3.380 ( 4.393 -8.825 6.212) 11.651 3.520 ( 9.125 0.213 2.669) 9.510 3.536 ( 10.137 -3.300 0.542) 10.675 3.672 ( -0.610 -0.938 2.394) 2.643 3.692 ( 2.323 3.385 7.074) 8.179 3.920 ( -2.154 -3.070 13.661) 14.166 4.004 ( -3.669 2.516 1.766) 4.786 4.155 ( 2.438 -1.383 6.919) 7.465 4.251 ( -1.091 0.838 -9.908) 10.003 4.378 ( 2.905 0.275 3.939) 4.902 4.579 ( -1.512 -1.279 -0.291) 2.002 4.653 ( 4.828 -1.295 -4.571) 6.773 4.756 ( 0.574 0.548 1.676) 1.855 4.876 ( -2.065 -0.367 -8.875) 9.119 5.558 ( 4.958 -2.047 -3.315) 6.306 5.621 ( 4.810 -2.042 -7.277) 8.959 5.938 ( -0.790 1.462 2.753) 3.216 6.049 ( 0.028 1.553 -0.012) 1.553 6.635 ( 1.392 0.565 3.568) 3.871 6.713 ( 1.644 1.010 0.421) 1.975 7.091 ( 1.854 -1.859 2.768) 3.816 7.162 ( -0.116 0.652 -2.966) 3.039 7.214 ( 7.775 -3.488 23.905) 25.378 8.074 ( 8.905 -3.141 -28.855) 30.361 8.809 ( 1.993 -1.782 1.155) 2.912 8.973 ( -3.053 -2.441 2.768) 4.790 9.121 ( -2.504 4.346 5.358) 7.340 9.267 ( 2.409 -0.875 -0.408) 2.595 9.309 ( -3.721 -1.567 -1.549) 4.324 9.641 ( -2.335 3.209 -7.392) 8.391 10.153 ( 3.247 -5.092 7.738) 9.816 10.205 ( 5.239 -1.529 -4.442) 7.037 10.675 ( -2.002 -0.875 8.066) 8.357 10.806 ( 0.946 4.012 -3.618) 5.484 11.121 ( -1.894 1.067 2.320) 3.179 11.356 ( -3.316 -2.478 -3.800) 5.619 11.658 ( -0.416 -1.854 4.877) 5.234 11.857 ( 4.974 0.708 0.982) 5.120 12.490 ( 2.116 -0.306 0.451) 2.185 12.532 ( 2.529 -4.482 -4.089) 6.573 12.945 ( 1.650 7.190 2.560) 7.809 13.235 ( 5.393 8.018 -2.082) 9.885 14.580 ( -21.249 -0.356 16.656) 27.001 15.313 ( -8.057 -2.841 -19.313) 21.118 15.717 ( 1.080 -2.356 3.104) 4.044 15.855 ( -0.124 0.956 -3.039) 3.188 ======================= Grid point 261 (123/160) ======================= q-point: (-0.22 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.148 ( -1.047 9.190 3.594) 9.924 1.663 ( -13.737 6.065 13.516) 20.203 1.933 ( -13.375 2.528 3.000) 13.939 2.123 ( -6.815 -3.271 -1.323) 7.674 2.306 ( -6.121 3.964 -15.913) 17.504 2.461 ( -11.243 3.134 -2.191) 11.875 2.672 ( -9.717 0.777 -2.625) 10.095 2.823 ( -4.631 -1.358 -6.432) 8.041 3.499 ( 1.080 -3.944 10.197) 10.987 3.612 ( -5.704 2.557 20.825) 21.743 3.639 ( 2.004 0.704 -4.398) 4.884 3.668 ( 1.274 -0.589 9.291) 9.396 3.757 ( 6.672 -2.333 -3.385) 7.837 3.837 ( 1.193 4.961 -1.824) 5.419 4.015 ( 3.071 -4.323 0.952) 5.387 4.243 ( 1.648 -0.370 -6.932) 7.135 4.288 ( 6.139 -4.508 8.958) 11.758 4.429 ( 2.417 -1.345 -0.453) 2.803 4.597 ( 0.821 -2.569 1.519) 3.096 4.725 ( 2.815 1.160 -4.959) 5.819 4.741 ( -1.006 1.475 4.274) 4.632 4.834 ( -3.265 -0.400 -9.253) 9.821 5.628 ( 1.709 -0.779 2.133) 2.842 5.724 ( 4.516 -2.255 -10.745) 11.872 5.911 ( -0.686 1.569 3.511) 3.907 6.019 ( -1.501 1.571 -0.106) 2.175 6.667 ( 2.597 0.502 2.700) 3.780 6.728 ( 1.513 1.403 0.216) 2.075 7.117 ( -0.046 -1.429 -1.197) 1.865 7.155 ( 0.104 0.484 -4.711) 4.737 7.494 ( 17.913 -4.857 22.325) 29.033 8.247 ( 7.444 -4.108 -22.997) 24.519 8.845 ( -0.493 -1.165 2.856) 3.123 8.941 ( -3.524 -2.743 -0.325) 4.478 9.043 ( -2.464 1.637 3.283) 4.419 9.240 ( -4.574 -0.886 -2.209) 5.156 9.352 ( 5.376 -0.528 0.324) 5.411 9.583 ( -0.643 2.566 -5.756) 6.335 10.266 ( 3.310 -5.735 7.639) 10.110 10.325 ( 6.001 -2.144 -2.966) 7.029 10.663 ( -0.065 -1.140 7.339) 7.428 10.782 ( 0.854 3.456 -2.915) 4.601 11.086 ( -0.254 2.044 2.195) 3.010 11.292 ( -5.733 -0.701 -4.493) 7.317 11.730 ( 6.371 -4.603 6.844) 10.422 11.972 ( 9.206 0.475 1.432) 9.329 12.541 ( 2.439 -2.101 0.992) 3.368 12.640 ( 3.558 -7.107 -4.701) 9.234 12.897 ( 2.889 10.365 2.684) 11.090 13.257 ( 8.129 9.545 -1.851) 12.674 14.149 ( -29.085 1.804 14.833) 32.698 15.086 ( -22.642 -3.211 -22.645) 32.183 15.763 ( 1.633 -1.651 3.946) 4.579 15.849 ( 0.879 1.245 -2.938) 3.310 ======================= Grid point 262 (124/160) ======================= q-point: (-0.11 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.149 ( 9.043 4.326 6.200) 11.787 1.408 ( -10.704 3.810 14.891) 18.731 1.688 ( -10.991 3.407 9.925) 15.196 2.065 ( -2.010 -2.200 -4.713) 5.576 2.118 ( -11.150 1.798 -17.815) 21.093 2.251 ( -10.468 1.418 -1.183) 10.629 2.606 ( 1.223 0.100 -2.689) 2.956 2.754 ( -4.818 -0.863 -5.067) 7.045 3.400 ( -8.469 4.212 29.738) 31.206 3.571 ( -0.639 -2.469 13.014) 13.262 3.635 ( -1.028 0.171 6.213) 6.300 3.668 ( 0.905 1.869 -3.485) 4.057 3.852 ( 4.047 -1.919 -14.427) 15.106 3.885 ( 3.765 1.714 -12.808) 13.459 4.148 ( 6.846 -3.744 6.501) 10.156 4.299 ( 3.830 -1.662 -4.867) 6.413 4.430 ( 4.653 -3.516 8.571) 10.367 4.479 ( 2.098 -0.441 0.852) 2.306 4.625 ( -1.671 -1.562 1.817) 2.922 4.673 ( -2.639 1.866 -1.241) 3.462 4.746 ( 0.277 1.554 0.804) 1.772 4.778 ( -2.811 0.019 -7.454) 7.967 5.639 ( -0.752 -0.318 5.551) 5.611 5.798 ( 2.435 -1.147 -11.501) 11.812 5.890 ( -0.208 1.030 4.394) 4.518 5.980 ( -1.387 0.980 -1.115) 2.032 6.703 ( 1.788 0.158 1.932) 2.638 6.736 ( 0.845 1.086 0.277) 1.403 7.125 ( -0.297 -0.981 -1.375) 1.715 7.154 ( 0.341 0.319 -5.384) 5.404 7.845 ( 16.270 -3.168 16.731) 23.552 8.376 ( 3.476 -2.986 -19.047) 19.590 8.816 ( -2.563 -0.021 5.055) 5.667 8.908 ( -3.057 -1.929 -3.745) 5.205 9.019 ( 0.589 0.367 2.716) 2.803 9.167 ( -4.776 -0.808 -2.529) 5.465 9.458 ( 5.706 -1.151 -1.227) 5.949 9.555 ( -0.998 1.540 -2.053) 2.753 10.346 ( 0.451 -2.343 8.797) 9.115 10.425 ( 3.696 -2.106 -3.459) 5.483 10.713 ( 2.752 -3.017 3.604) 5.446 10.776 ( 1.585 2.135 -1.160) 2.901 11.079 ( 1.656 1.887 1.296) 2.825 11.194 ( -5.046 0.823 -3.617) 6.263 11.999 ( 16.682 -8.942 4.913) 19.555 12.135 ( 10.359 1.887 2.897) 10.921 12.615 ( 2.284 -5.599 1.964) 6.358 12.761 ( 2.004 -4.766 -5.223) 7.349 12.866 ( 7.146 9.959 3.117) 12.648 13.373 ( 16.479 5.902 0.360) 17.508 13.594 ( -31.841 4.429 9.083) 33.406 14.589 ( -37.201 -0.044 -20.234) 42.347 15.793 ( 0.326 -0.503 5.105) 5.140 15.861 ( 1.336 0.413 -3.110) 3.410 ======================= Grid point 264 (125/160) ======================= q-point: ( 0.11 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.083 ( 0.146 -0.000 2.065) 2.070 1.700 ( 10.731 -0.000 7.456) 13.066 1.920 ( 11.747 -0.000 12.241) 16.965 1.925 ( 8.259 -0.000 -0.038) 8.259 2.235 ( 11.734 -0.000 -7.909) 14.151 2.452 ( 9.726 -0.000 -4.893) 10.888 2.717 ( 9.558 -0.000 -4.823) 10.706 2.720 ( 0.782 -0.000 3.396) 3.485 3.277 ( 4.877 -0.000 24.095) 24.584 3.527 ( -3.697 0.000 11.818) 12.383 3.601 ( -1.487 0.000 5.215) 5.423 3.786 ( -2.343 0.000 -5.121) 5.631 3.857 ( -2.789 0.000 -8.944) 9.369 4.040 ( -4.323 0.000 -2.801) 5.151 4.200 ( -4.578 0.000 -6.386) 7.857 4.277 ( 5.809 -0.000 -13.199) 14.421 4.391 ( -3.178 0.000 1.132) 3.374 4.422 ( -2.725 0.000 0.476) 2.766 4.611 ( -7.088 0.000 8.828) 11.321 4.618 ( 1.722 -0.000 3.789) 4.162 4.715 ( 3.031 -0.000 -1.652) 3.452 4.823 ( 2.439 -0.000 -6.429) 6.876 5.569 ( -1.653 0.000 2.261) 2.801 5.685 ( -7.087 0.000 -1.885) 7.333 5.946 ( 0.286 -0.000 -1.368) 1.398 5.967 ( 2.081 -0.000 3.972) 4.484 6.665 ( -2.764 0.000 2.004) 3.414 6.681 ( -1.814 0.000 3.291) 3.758 7.103 ( -0.719 0.000 -1.933) 2.063 7.182 ( 0.616 -0.000 -3.643) 3.695 7.839 ( -15.212 0.000 20.681) 25.673 8.019 ( -12.268 0.000 -25.093) 27.931 8.873 ( 3.136 -0.000 4.885) 5.805 8.981 ( 3.608 -0.000 -5.483) 6.563 9.121 ( 3.292 -0.000 -4.115) 5.270 9.185 ( 3.684 -0.000 3.040) 4.776 9.333 ( -3.999 0.000 1.631) 4.319 9.461 ( -4.811 0.000 3.264) 5.814 10.224 ( -7.238 0.000 7.014) 10.079 10.496 ( -3.718 0.000 -2.822) 4.668 10.639 ( -4.084 0.000 4.386) 5.993 10.803 ( 2.650 -0.000 -5.871) 6.441 11.131 ( 3.319 -0.000 -3.234) 4.634 11.223 ( 5.604 -0.000 2.506) 6.139 11.862 ( -8.260 0.000 -0.721) 8.291 11.939 ( -13.920 0.000 3.763) 14.420 12.622 ( -5.319 0.000 2.095) 5.717 12.666 ( -6.227 0.000 -5.021) 7.999 12.837 ( 3.252 -0.000 -0.492) 3.289 13.069 ( -7.559 0.000 5.113) 9.126 14.531 ( 36.235 -0.000 -24.266) 43.610 14.677 ( 21.882 -0.000 19.204) 29.114 15.715 ( -2.232 0.000 7.516) 7.841 15.846 ( -1.737 0.000 -1.878) 2.558 ======================= Grid point 265 (126/160) ======================= q-point: ( 0.22 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( 5.758 -5.815 0.389) 8.192 1.919 ( 12.728 -2.644 7.591) 15.054 2.050 ( 3.807 -1.062 6.522) 7.626 2.114 ( 11.783 -1.284 1.607) 11.961 2.434 ( 11.659 4.336 -4.190) 13.126 2.635 ( 11.193 -2.179 -6.126) 12.944 2.749 ( 2.809 -2.053 4.457) 5.654 2.911 ( 12.279 1.019 -1.545) 12.418 3.378 ( 2.540 -0.844 17.173) 17.380 3.460 ( -4.426 -1.364 11.547) 12.441 3.556 ( -2.551 1.730 3.278) 4.500 3.641 ( -10.704 0.522 -3.753) 11.355 3.765 ( -5.753 1.982 -4.412) 7.517 4.016 ( -0.692 -0.037 2.088) 2.200 4.165 ( 0.599 1.101 -3.692) 3.899 4.283 ( -3.752 4.301 0.406) 5.722 4.305 ( -1.312 5.820 -7.466) 9.557 4.451 ( 1.573 -7.701 -6.616) 10.274 4.481 ( -8.574 -2.073 8.273) 12.094 4.698 ( 6.009 -0.915 -2.683) 6.644 4.743 ( 0.910 1.144 -3.123) 3.449 4.835 ( -0.147 1.087 -6.437) 6.530 5.537 ( -3.704 0.692 -0.549) 3.808 5.542 ( -7.270 0.021 1.791) 7.488 5.960 ( 1.268 -0.078 -0.661) 1.432 5.997 ( 1.005 -0.512 3.331) 3.517 6.631 ( -1.327 -0.594 3.151) 3.470 6.656 ( -1.466 -0.333 3.911) 4.190 7.090 ( -0.696 -0.051 -1.524) 1.677 7.184 ( -0.045 0.598 -1.575) 1.686 7.551 ( -16.917 1.737 24.808) 30.077 7.848 ( -6.076 0.475 -29.734) 30.353 8.894 ( 1.648 4.810 2.365) 5.607 9.022 ( 1.210 -0.561 -3.525) 3.768 9.172 ( 1.475 -0.757 -4.508) 4.803 9.229 ( -0.824 -1.981 2.790) 3.520 9.305 ( 1.550 0.111 0.639) 1.680 9.428 ( 0.837 -2.793 5.943) 6.620 10.097 ( -6.902 0.187 6.703) 9.623 10.386 ( -4.865 4.549 -3.118) 7.355 10.622 ( -1.143 -3.302 6.255) 7.165 10.847 ( 2.790 0.741 -6.561) 7.168 11.193 ( 3.660 0.956 -4.167) 5.628 11.315 ( 4.559 0.287 2.698) 5.305 11.745 ( -4.402 2.046 1.344) 5.037 11.788 ( -5.243 -2.241 3.654) 6.772 12.514 ( -5.613 0.985 0.534) 5.724 12.560 ( -5.548 -0.016 -3.780) 6.713 12.918 ( 6.418 2.315 -0.025) 6.823 13.049 ( -0.300 -6.744 3.032) 7.400 14.945 ( 9.532 1.091 19.066) 21.344 15.018 ( 22.181 0.813 -23.932) 32.641 15.685 ( -1.845 -0.445 7.061) 7.312 15.823 ( -0.689 -0.372 -1.207) 1.439 ======================= Grid point 266 (127/160) ======================= q-point: ( 0.33 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.358 ( 8.043 -7.621 0.607) 11.097 2.082 ( -1.816 -4.213 1.586) 4.854 2.154 ( 10.497 -1.322 6.418) 12.375 2.311 ( 8.461 -0.284 1.501) 8.598 2.488 ( 3.027 6.788 -0.527) 7.451 2.842 ( 10.515 0.795 0.690) 10.567 2.865 ( 5.268 -4.688 -3.592) 7.915 3.079 ( 7.441 -0.026 3.204) 8.101 3.320 ( -7.329 2.225 7.262) 10.554 3.346 ( -7.033 0.397 4.617) 8.422 3.486 ( -3.858 1.713 -2.211) 4.765 3.555 ( -1.648 -2.040 5.418) 6.019 3.717 ( 0.758 -1.176 -0.332) 1.438 3.967 ( -4.083 1.265 5.871) 7.263 4.099 ( -7.977 4.653 2.559) 9.583 4.185 ( 1.418 1.766 4.718) 5.233 4.279 ( 1.643 3.020 -10.898) 11.428 4.398 ( -4.812 -5.011 1.869) 7.194 4.557 ( 3.266 -4.134 -3.549) 6.353 4.711 ( -2.143 2.089 -1.415) 3.310 4.771 ( 0.399 3.288 -4.171) 5.326 4.839 ( 2.897 -1.650 -9.170) 9.757 5.396 ( -6.870 -1.231 2.068) 7.279 5.515 ( -0.237 0.482 -2.817) 2.867 5.983 ( 1.355 0.695 0.715) 1.682 6.018 ( 1.261 -0.718 1.113) 1.829 6.635 ( 0.648 -0.549 2.980) 3.099 6.642 ( -0.262 -0.318 4.751) 4.768 7.078 ( -0.982 0.049 -0.190) 1.001 7.164 ( -2.118 0.472 7.215) 7.534 7.294 ( -10.609 1.596 19.720) 22.450 7.805 ( 1.357 -0.585 -32.526) 32.559 8.850 ( -0.271 5.475 -0.521) 5.506 9.025 ( -1.096 0.565 2.004) 2.353 9.167 ( -1.742 -2.305 -1.490) 3.250 9.241 ( 0.308 -1.328 -0.886) 1.626 9.347 ( 1.538 -0.348 2.016) 2.560 9.530 ( 5.026 -4.986 3.422) 7.863 10.012 ( -2.979 -0.166 5.476) 6.236 10.266 ( -4.493 3.465 -4.232) 7.078 10.642 ( -0.564 -2.945 6.765) 7.400 10.876 ( 2.129 1.689 -5.703) 6.318 11.214 ( 0.400 1.632 -3.245) 3.654 11.357 ( 1.256 1.067 1.669) 2.346 11.683 ( -1.988 0.479 3.288) 3.872 11.770 ( -0.461 -2.230 2.421) 3.324 12.435 ( -3.475 -0.926 -0.870) 3.700 12.489 ( -3.152 -0.837 -2.835) 4.322 12.996 ( 5.787 2.760 2.639) 6.934 13.156 ( 7.034 -2.123 -1.250) 7.453 14.987 ( -3.186 0.973 16.914) 17.239 15.268 ( 9.552 1.094 -20.838) 22.949 15.662 ( -1.559 -0.797 6.365) 6.601 15.834 ( 1.033 -0.679 -0.632) 1.388 ======================= Grid point 267 (128/160) ======================= q-point: (-0.56 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.523 ( 4.043 -1.979 0.800) 4.572 2.071 ( -4.869 -6.510 -1.928) 8.355 2.264 ( 2.323 4.211 4.120) 6.333 2.304 ( -6.280 2.587 7.510) 10.126 2.510 ( 4.019 3.073 -6.517) 8.251 2.916 ( -3.902 0.680 -3.060) 5.005 2.950 ( 3.294 1.896 3.474) 5.149 3.098 ( -0.349 -0.130 1.540) 1.584 3.206 ( -8.884 -1.796 -1.685) 9.219 3.333 ( 5.342 -1.547 3.929) 6.809 3.443 ( 0.678 0.994 0.361) 1.257 3.571 ( 0.146 -4.123 4.031) 5.768 3.731 ( 2.090 2.631 4.218) 5.393 3.877 ( -3.726 0.737 10.018) 10.714 3.995 ( -1.955 -0.417 3.385) 3.931 4.201 ( -1.671 -2.418 4.238) 5.158 4.272 ( 2.979 3.113 -10.837) 11.662 4.406 ( -1.299 -3.707 -2.097) 4.453 4.605 ( 0.678 1.927 1.515) 2.543 4.629 ( -3.809 2.639 -1.184) 4.783 4.748 ( 1.166 1.404 -1.750) 2.529 4.876 ( -0.851 -1.706 -8.035) 8.258 5.377 ( 1.532 -4.264 -2.409) 5.132 5.529 ( 2.088 -0.323 -4.723) 5.175 5.986 ( 0.331 1.369 1.581) 2.117 6.056 ( 2.398 0.156 -0.586) 2.474 6.637 ( 0.468 0.452 3.561) 3.620 6.679 ( 2.847 -0.458 3.070) 4.211 7.044 ( -2.094 0.553 13.673) 13.843 7.120 ( -2.172 -1.554 17.210) 17.416 7.195 ( -1.641 0.938 -1.825) 2.628 7.877 ( 5.952 -1.893 -32.557) 33.150 8.800 ( -0.438 2.838 -0.981) 3.034 8.985 ( -2.877 0.135 3.574) 4.590 9.190 ( 1.926 -1.714 -0.269) 2.592 9.246 ( -0.660 0.250 -0.069) 0.709 9.334 ( -3.801 -0.745 2.653) 4.695 9.652 ( 3.511 -3.223 -0.203) 4.770 10.008 ( 1.265 -1.606 4.547) 4.986 10.174 ( -2.841 1.373 -4.861) 5.796 10.656 ( -0.904 -2.142 6.781) 7.169 10.882 ( 0.872 2.175 -4.966) 5.491 11.184 ( -1.813 1.203 -1.302) 2.536 11.350 ( -0.818 0.477 0.048) 0.949 11.651 ( -2.184 -0.539 3.709) 4.338 11.796 ( 0.863 -1.991 2.011) 2.959 12.413 ( -1.286 -2.625 -2.544) 3.875 12.470 ( 0.035 -0.565 -1.261) 1.383 13.063 ( 6.428 4.933 4.528) 9.282 13.300 ( 10.965 4.854 -4.233) 12.717 14.846 ( -12.982 -0.252 15.573) 20.276 15.326 ( -2.056 -1.511 -19.402) 19.569 15.660 ( 0.407 -0.716 6.876) 6.925 15.857 ( 0.922 -0.312 -1.354) 1.668 ======================= Grid point 268 (129/160) ======================= q-point: (-0.44 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( -3.146 7.169 0.475) 7.843 2.051 ( -5.101 -5.449 0.150) 7.465 2.091 ( -12.145 4.660 9.049) 15.846 2.207 ( -4.533 4.449 1.577) 6.544 2.497 ( -1.498 3.831 -10.257) 11.051 2.765 ( -7.996 5.072 -1.970) 9.672 2.904 ( -6.905 0.977 -2.764) 7.502 2.976 ( -13.165 3.658 -3.065) 14.003 3.209 ( 3.970 -8.044 5.474) 10.509 3.462 ( 6.986 -3.770 -0.471) 7.952 3.507 ( 6.006 -1.893 1.954) 6.593 3.627 ( 0.663 -3.750 3.077) 4.896 3.773 ( 4.902 4.342 10.351) 12.248 3.852 ( -0.478 -2.329 8.966) 9.276 4.015 ( 2.370 -1.519 4.411) 5.233 4.153 ( -4.618 -2.021 3.777) 6.299 4.286 ( -0.504 5.271 -13.433) 14.439 4.390 ( 0.007 -0.028 3.721) 3.721 4.561 ( -2.644 -0.274 1.344) 2.978 4.617 ( 2.911 -1.311 -1.882) 3.706 4.766 ( 1.225 0.400 0.658) 1.448 4.865 ( -1.512 -1.055 -8.085) 8.292 5.488 ( 4.812 -5.086 -4.623) 8.390 5.586 ( 3.483 -1.512 -5.403) 6.604 5.973 ( 0.165 2.071 1.856) 2.786 6.078 ( 0.732 1.298 -0.466) 1.561 6.651 ( 1.919 0.961 4.098) 4.626 6.731 ( 2.974 0.727 0.999) 3.221 7.057 ( 2.050 -1.460 6.426) 6.901 7.146 ( 3.674 -3.277 24.181) 24.677 7.172 ( -0.681 0.391 -4.091) 4.166 8.009 ( 6.814 -3.391 -29.556) 30.521 8.790 ( 0.890 -0.134 -1.339) 1.613 8.933 ( -4.084 -1.569 3.564) 5.643 9.186 ( -4.974 1.638 2.405) 5.762 9.264 ( 5.333 0.876 2.753) 6.066 9.270 ( -4.504 -2.269 -1.365) 5.225 9.684 ( -0.832 1.066 -3.318) 3.583 10.073 ( 3.245 -2.971 4.798) 6.510 10.169 ( 2.184 -2.108 -4.410) 5.354 10.654 ( -1.297 -1.241 7.229) 7.448 10.860 ( -1.105 1.647 -4.214) 4.657 11.146 ( -0.831 1.325 0.011) 1.564 11.324 ( -2.323 -0.550 -1.487) 2.812 11.625 ( -1.702 -1.393 4.466) 4.978 11.842 ( 2.472 -2.434 1.252) 3.689 12.435 ( 0.164 -3.644 -3.329) 4.939 12.494 ( 2.233 -0.290 -0.682) 2.353 13.114 ( 7.286 8.945 5.439) 12.755 13.412 ( 10.552 10.040 -5.275) 15.491 14.572 ( -19.977 -0.479 14.948) 24.955 15.232 ( -12.433 -5.338 -19.595) 23.812 15.691 ( 2.249 -0.457 6.873) 7.246 15.868 ( 0.474 0.390 -2.291) 2.371 ======================= Grid point 269 (130/160) ======================= q-point: (-0.33 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.350 ( -2.170 10.334 3.104) 11.006 1.814 ( -12.043 8.712 12.273) 19.276 1.975 ( -7.321 0.844 1.371) 7.495 2.087 ( -5.951 0.460 0.797) 6.022 2.387 ( -6.758 4.411 -14.107) 16.252 2.537 ( -13.881 4.405 -2.828) 14.836 2.706 ( -8.419 2.725 -5.244) 10.286 2.816 ( -4.928 1.265 -2.379) 5.616 3.360 ( 3.429 -8.447 7.157) 11.590 3.589 ( 3.556 -4.112 -0.545) 5.464 3.629 ( -3.073 -1.138 6.249) 7.056 3.688 ( 8.558 -4.943 0.930) 9.927 3.776 ( 1.482 7.577 11.962) 14.237 3.879 ( -0.095 -2.862 11.244) 11.603 4.009 ( 0.506 6.424 -6.449) 9.116 4.178 ( 1.390 -6.663 4.554) 8.190 4.235 ( 1.698 0.539 -4.517) 4.856 4.400 ( 0.603 -1.285 -3.166) 3.470 4.563 ( 1.405 -1.000 3.846) 4.215 4.694 ( 2.234 -3.571 -4.103) 5.880 4.767 ( -0.750 0.881 2.225) 2.508 4.840 ( -1.593 0.452 -7.260) 7.447 5.595 ( 2.429 -2.987 -0.483) 3.880 5.668 ( 3.757 -3.069 -7.957) 9.319 5.952 ( -0.002 2.576 2.672) 3.712 6.056 ( -1.127 2.062 -0.061) 2.351 6.683 ( 2.784 1.130 3.804) 4.848 6.761 ( 2.193 1.894 0.165) 2.902 7.086 ( -0.099 -1.700 -0.853) 1.905 7.159 ( -0.465 -0.098 -5.199) 5.220 7.371 ( 14.861 -7.208 25.402) 30.300 8.150 ( 5.296 -5.393 -24.118) 25.275 8.814 ( -0.063 -1.923 -1.175) 2.255 8.882 ( -4.512 -3.014 2.185) 5.849 9.078 ( -4.528 1.744 3.264) 5.848 9.214 ( -4.593 -1.604 -1.914) 5.228 9.353 ( 5.861 0.816 2.830) 6.560 9.637 ( -1.328 2.753 -4.569) 5.497 10.169 ( 4.141 -3.715 4.717) 7.294 10.265 ( 4.747 -3.815 -3.224) 6.891 10.647 ( -0.450 -0.718 8.245) 8.288 10.820 ( -1.950 0.583 -3.300) 3.877 11.133 ( 1.232 2.438 0.212) 2.740 11.279 ( -3.598 -0.435 -2.596) 4.458 11.646 ( 2.141 -3.690 6.246) 7.564 11.940 ( 5.362 -4.206 0.364) 6.824 12.480 ( 0.850 -3.716 -2.663) 4.650 12.552 ( 3.749 -1.364 -1.999) 4.462 13.134 ( 7.221 12.603 4.904) 15.331 13.461 ( 7.890 11.044 -3.775) 14.088 14.193 ( -23.636 2.632 13.429) 27.312 14.996 ( -21.879 -5.916 -20.461) 30.535 15.740 ( 2.459 -0.721 6.280) 6.783 15.869 ( 0.570 0.836 -2.809) 2.986 ======================= Grid point 270 (131/160) ======================= q-point: (-0.22 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.286 ( 6.279 8.630 7.339) 12.952 1.545 ( -8.941 9.808 13.474) 18.913 1.804 ( -7.326 7.665 6.239) 12.303 2.022 ( -1.607 -1.738 -0.930) 2.543 2.160 ( -14.257 2.659 -12.602) 19.213 2.293 ( -9.572 2.636 -8.449) 13.037 2.621 ( 0.131 1.804 -2.118) 2.785 2.739 ( -3.876 -0.075 -4.145) 5.676 3.478 ( 2.125 -6.088 8.426) 10.610 3.520 ( -7.003 5.194 24.085) 25.614 3.663 ( -0.010 0.072 -2.455) 2.456 3.692 ( -0.957 3.265 11.168) 11.675 3.812 ( 2.393 -1.760 -6.083) 6.769 3.956 ( 6.416 4.000 -9.203) 11.911 4.025 ( 4.118 -6.169 -2.466) 7.817 4.222 ( -1.212 -6.582 -3.385) 7.500 4.353 ( 6.531 -3.201 6.120) 9.505 4.451 ( 2.586 -2.454 -2.369) 4.281 4.596 ( 0.772 -1.092 3.243) 3.508 4.711 ( -4.096 1.514 0.026) 4.367 4.740 ( -0.168 -1.937 -3.347) 3.871 4.806 ( -0.872 2.005 -2.575) 3.378 5.626 ( -0.685 -1.170 4.585) 4.781 5.755 ( 2.529 -3.223 -10.123) 10.920 5.927 ( 0.110 2.641 3.808) 4.635 6.013 ( -1.268 2.215 -0.904) 2.707 6.714 ( 1.813 1.014 3.256) 3.862 6.770 ( 1.193 2.210 -0.340) 2.534 7.098 ( -0.185 -1.642 -0.899) 1.881 7.155 ( -0.128 -0.289 -5.431) 5.440 7.726 ( 15.202 -8.754 18.338) 25.377 8.275 ( 2.477 -6.823 -19.531) 20.837 8.805 ( -2.776 -1.448 2.191) 3.822 8.849 ( -3.023 -3.773 -1.273) 4.999 9.026 ( -0.367 0.333 1.978) 2.039 9.146 ( -4.656 -0.988 -1.685) 5.049 9.440 ( 4.371 -0.262 3.051) 5.337 9.596 ( -0.600 2.445 -3.992) 4.719 10.277 ( 3.628 -3.855 4.144) 6.722 10.363 ( 1.901 -3.735 -1.681) 4.515 10.670 ( 1.684 -1.578 7.959) 8.287 10.794 ( -0.533 -0.125 -2.549) 2.607 11.131 ( 1.226 2.890 0.770) 3.232 11.217 ( -2.902 1.202 -3.378) 4.613 11.806 ( 9.668 -9.511 7.852) 15.671 12.090 ( 5.144 -6.695 -0.606) 8.465 12.534 ( 1.949 -2.829 -0.834) 3.535 12.640 ( 2.974 -3.847 -4.209) 6.431 13.131 ( 9.119 14.345 3.160) 17.289 13.485 ( 3.015 4.745 0.137) 5.624 13.763 ( -15.688 11.629 9.431) 21.686 14.583 ( -30.540 -0.688 -19.265) 36.115 15.780 ( 1.036 -0.705 5.995) 6.125 15.872 ( 0.778 0.694 -3.044) 3.217 ======================= Grid point 271 (132/160) ======================= q-point: (-0.11 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.317 ( -5.432 7.639 13.055) 16.072 1.418 ( 13.922 6.560 6.269) 16.618 1.628 ( -3.035 7.930 11.667) 14.430 1.931 ( -9.164 0.485 -10.668) 14.072 2.070 ( 3.136 -1.857 -1.848) 4.086 2.164 ( -0.603 2.448 -8.625) 8.986 2.633 ( 0.261 -0.996 0.222) 1.053 2.686 ( -1.281 0.521 -5.193) 5.373 3.349 ( -4.807 7.683 29.357) 30.724 3.560 ( 2.095 -3.190 8.436) 9.259 3.619 ( -1.832 1.808 11.459) 11.744 3.683 ( -0.168 -1.268 -4.869) 5.035 3.872 ( 1.957 -2.338 -10.881) 11.300 3.994 ( 5.875 4.587 -23.315) 24.477 4.186 ( 3.057 -7.674 5.430) 9.885 4.273 ( -1.284 -7.890 -2.944) 8.519 4.433 ( -1.849 -1.776 7.014) 7.468 4.519 ( 3.628 -0.665 -0.647) 3.745 4.589 ( -3.332 2.231 2.294) 4.620 4.650 ( 1.287 -1.459 -2.517) 3.181 4.746 ( -0.340 -0.011 0.579) 0.672 4.761 ( -1.792 2.430 -0.646) 3.087 5.613 ( -1.690 -0.769 5.806) 6.095 5.798 ( -0.462 -2.020 -8.578) 8.825 5.914 ( 1.197 2.018 3.988) 4.627 5.975 ( -0.858 1.758 -1.716) 2.602 6.722 ( -0.042 0.594 2.921) 2.981 6.757 ( -0.363 1.992 -0.209) 2.035 7.110 ( -0.141 -1.199 -1.342) 1.805 7.158 ( 0.262 -0.325 -5.322) 5.338 7.986 ( 4.977 -6.553 14.890) 17.012 8.328 ( -4.055 -5.699 -18.769) 20.029 8.782 ( -0.692 -1.217 4.191) 4.419 8.856 ( 0.198 -2.866 -2.822) 4.027 9.053 ( 3.159 -0.310 1.386) 3.464 9.089 ( -2.581 -0.736 -1.922) 3.302 9.485 ( -0.901 -0.640 3.991) 4.141 9.562 ( -0.621 1.573 -3.464) 3.855 10.336 ( -0.062 -0.949 5.255) 5.340 10.422 ( 0.818 -5.826 -2.668) 6.460 10.717 ( 0.487 -2.751 5.525) 6.191 10.796 ( 0.089 0.086 -1.938) 1.942 11.116 ( -0.219 1.476 1.430) 2.067 11.164 ( -0.578 3.287 -3.047) 4.518 12.065 ( 1.482 -10.486 8.960) 13.872 12.218 ( 0.842 -10.421 -5.995) 12.051 12.608 ( 2.591 -4.415 1.760) 5.414 12.680 ( -3.827 -5.510 -4.612) 8.142 13.211 ( -7.570 10.166 3.240) 13.082 13.281 ( 14.855 10.530 -3.550) 18.552 13.779 ( 18.795 4.847 9.267) 21.509 14.003 ( -27.405 10.218 -12.930) 31.979 15.784 ( -1.126 -0.180 6.362) 6.463 15.878 ( 0.335 0.285 -2.785) 2.820 ======================= Grid point 274 (133/160) ======================= q-point: ( 0.22 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.274 ( 10.040 -0.000 0.788) 10.071 2.040 ( -1.612 0.000 2.844) 3.269 2.135 ( 11.511 -0.000 7.886) 13.953 2.310 ( 10.062 -0.000 0.587) 10.079 2.583 ( 0.722 -0.000 1.815) 1.953 2.790 ( 8.935 -0.000 -8.736) 12.496 2.854 ( 11.488 -0.000 1.759) 11.622 3.078 ( 5.498 -0.000 2.244) 5.938 3.341 ( -7.411 0.000 10.089) 12.519 3.366 ( -5.979 0.000 8.106) 10.073 3.481 ( -6.141 0.000 -2.001) 6.458 3.537 ( -1.474 0.000 3.292) 3.607 3.714 ( 0.339 -0.000 -2.681) 2.702 3.981 ( -3.115 0.000 4.117) 5.162 4.178 ( -8.297 0.000 -1.849) 8.501 4.187 ( -0.779 0.000 3.102) 3.198 4.289 ( -6.886 0.000 7.885) 10.469 4.368 ( 0.274 -0.000 -6.900) 6.906 4.495 ( 6.830 -0.000 -5.471) 8.751 4.733 ( -1.831 0.000 -0.524) 1.905 4.803 ( 5.085 -0.000 -9.956) 11.179 4.826 ( -1.190 0.000 -6.216) 6.329 5.381 ( -8.568 0.000 3.797) 9.372 5.520 ( -0.568 0.000 -3.000) 3.053 5.995 ( 2.857 -0.000 -0.787) 2.964 6.005 ( 0.427 -0.000 1.996) 2.041 6.629 ( 1.357 -0.000 3.829) 4.062 6.640 ( -0.342 0.000 4.498) 4.511 7.078 ( -0.712 0.000 -1.444) 1.610 7.169 ( -2.914 0.000 9.363) 9.806 7.312 ( -11.232 0.000 18.671) 21.789 7.798 ( 0.605 -0.000 -32.039) 32.045 8.963 ( 1.704 -0.000 4.428) 4.744 8.972 ( -4.269 0.000 -6.579) 7.843 9.183 ( -1.717 0.000 3.169) 3.604 9.187 ( 0.335 -0.000 -3.964) 3.978 9.345 ( 1.503 -0.000 2.006) 2.507 9.479 ( 6.046 -0.000 5.835) 8.403 10.011 ( -3.343 0.000 5.296) 6.263 10.304 ( -6.455 0.000 -4.367) 7.794 10.607 ( 0.598 -0.000 6.900) 6.926 10.892 ( 2.061 -0.000 -6.178) 6.512 11.232 ( 0.045 -0.000 -4.524) 4.525 11.370 ( 1.364 -0.000 2.634) 2.966 11.703 ( -2.185 0.000 5.501) 5.919 11.729 ( -0.807 0.000 0.693) 1.063 12.423 ( -4.592 0.000 -1.232) 4.755 12.479 ( -3.043 0.000 -2.543) 3.966 13.035 ( 3.968 -0.000 5.808) 7.034 13.131 ( 13.885 -0.000 -4.607) 14.629 14.997 ( -3.982 0.000 17.051) 17.510 15.278 ( 8.540 -0.000 -22.114) 23.706 15.655 ( -1.441 0.000 7.490) 7.627 15.826 ( 1.197 -0.000 -0.305) 1.235 ======================= Grid point 275 (134/160) ======================= q-point: ( 0.33 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.471 ( 10.475 -2.154 1.256) 10.768 1.978 ( -6.544 -2.593 -2.164) 7.364 2.301 ( 6.426 0.535 8.654) 10.792 2.368 ( -4.077 2.260 7.201) 8.578 2.567 ( 1.941 2.114 -6.318) 6.940 2.913 ( 3.650 -0.654 -6.928) 7.858 2.987 ( 2.074 1.608 2.460) 3.597 3.087 ( -4.230 -1.029 3.477) 5.572 3.214 ( -8.698 2.095 -0.647) 8.970 3.302 ( 3.674 -1.594 6.717) 7.820 3.437 ( -0.642 -1.288 0.783) 1.638 3.510 ( -1.869 -1.483 2.962) 3.804 3.767 ( 5.062 0.980 2.867) 5.900 3.921 ( -3.309 2.104 4.762) 6.169 4.011 ( -6.393 2.732 1.286) 7.071 4.133 ( -6.705 -4.538 3.684) 8.895 4.267 ( 2.204 -1.835 6.613) 7.208 4.401 ( 3.245 1.993 -10.827) 11.478 4.584 ( 0.899 -1.615 2.423) 3.047 4.692 ( -0.822 1.621 -5.790) 6.069 4.795 ( -0.720 2.454 -4.266) 4.974 4.848 ( -0.640 -0.927 -7.376) 7.462 5.302 ( -1.260 -2.693 1.256) 3.227 5.524 ( 1.178 -0.115 -5.229) 5.361 6.010 ( 0.835 0.943 1.055) 1.644 6.053 ( 3.192 -0.352 -1.093) 3.393 6.645 ( 0.937 0.247 4.411) 4.516 6.673 ( 3.445 -0.108 3.736) 5.083 7.060 ( -1.703 0.833 5.136) 5.475 7.093 ( -4.103 -1.139 25.864) 26.212 7.211 ( -2.368 0.501 -1.646) 2.927 7.848 ( 4.990 -0.921 -32.265) 32.662 8.869 ( -3.322 3.605 -3.819) 6.215 8.974 ( -3.398 -1.647 5.119) 6.361 9.172 ( 2.135 0.763 -2.148) 3.124 9.215 ( 0.377 -2.822 -1.634) 3.283 9.333 ( -3.100 0.193 3.630) 4.777 9.599 ( 6.136 -1.591 5.210) 8.205 9.991 ( 0.792 -0.315 2.907) 3.030 10.193 ( -5.608 0.510 -5.219) 7.678 10.623 ( 0.239 -0.989 6.718) 6.795 10.909 ( 0.163 0.623 -5.255) 5.295 11.201 ( -2.489 0.513 -3.147) 4.045 11.366 ( -1.052 0.683 1.441) 1.910 11.660 ( -2.078 1.492 4.056) 4.796 11.740 ( -0.400 -3.090 2.042) 3.725 12.378 ( -1.171 -0.874 -2.955) 3.297 12.461 ( 0.477 -0.309 -0.862) 1.032 13.132 ( 8.120 1.878 7.814) 11.425 13.383 ( 16.530 2.786 -8.188) 18.656 14.843 ( -13.865 -0.080 14.867) 20.329 15.297 ( -5.955 -1.065 -19.319) 20.244 15.654 ( 1.348 -0.023 8.012) 8.125 15.853 ( 1.482 -0.134 -0.711) 1.649 ======================= Grid point 276 (135/160) ======================= q-point: (-0.56 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( 2.923 3.682 0.465) 4.724 1.906 ( -5.880 -7.410 -2.168) 9.705 2.202 ( -8.924 4.980 6.653) 12.195 2.308 ( -3.024 4.806 8.277) 10.038 2.561 ( -1.193 2.440 -8.520) 8.943 2.860 ( -7.236 3.941 -1.957) 8.469 2.927 ( -7.089 1.378 -0.209) 7.225 3.029 ( -8.370 0.944 -5.891) 10.278 3.095 ( 1.591 -3.043 4.849) 5.942 3.404 ( 4.034 -2.034 0.609) 4.559 3.464 ( 2.125 -1.672 2.713) 3.830 3.540 ( 1.857 -4.670 1.631) 5.283 3.827 ( -3.430 1.684 6.477) 7.520 3.863 ( 7.957 2.453 10.028) 13.034 3.983 ( 2.128 -1.320 2.159) 3.306 4.071 ( -6.165 -5.223 2.982) 8.613 4.357 ( 3.877 -2.264 4.151) 6.115 4.407 ( 1.799 5.111 -10.509) 11.824 4.552 ( -3.755 -1.145 2.428) 4.616 4.657 ( -0.973 5.128 -3.121) 6.081 4.768 ( -0.085 -0.107 -1.323) 1.330 4.836 ( -1.166 -1.766 -6.575) 6.907 5.378 ( 4.097 -5.576 -2.614) 7.397 5.561 ( 2.478 -1.045 -6.316) 6.865 6.013 ( 0.934 1.828 1.217) 2.387 6.095 ( 1.456 0.391 -0.950) 1.782 6.668 ( 2.294 0.752 4.685) 5.271 6.740 ( 4.129 0.281 2.121) 4.650 7.042 ( 0.789 -0.031 8.245) 8.283 7.092 ( 1.317 -2.329 23.255) 23.408 7.177 ( -1.367 0.198 -3.084) 3.379 7.951 ( 5.535 -2.340 -30.261) 30.852 8.801 ( -1.923 1.016 -3.487) 4.110 8.909 ( -5.284 -1.095 4.934) 7.312 9.188 ( -1.662 -0.784 -2.472) 3.080 9.232 ( -4.846 -1.257 -0.440) 5.026 9.292 ( 4.534 1.380 4.225) 6.350 9.688 ( 2.351 -0.287 2.856) 3.710 10.037 ( 3.573 -0.900 1.567) 4.004 10.132 ( -1.102 -1.509 -4.762) 5.115 10.632 ( -0.491 -0.958 6.595) 6.683 10.878 ( -2.945 0.411 -4.019) 4.999 11.165 ( -0.565 0.611 -2.128) 2.285 11.332 ( -2.016 0.900 0.241) 2.221 11.613 ( -2.173 0.422 3.953) 4.531 11.770 ( -0.338 -4.509 1.349) 4.719 12.392 ( 1.561 -0.990 -3.215) 3.708 12.489 ( 2.360 -0.232 -0.654) 2.460 13.256 ( 9.833 5.272 9.700) 14.785 13.597 ( 14.058 8.017 -10.208) 19.133 14.564 ( -18.747 -0.252 12.931) 22.775 15.127 ( -16.039 -4.806 -16.467) 23.484 15.691 ( 2.609 0.272 7.593) 8.033 15.873 ( 0.946 0.170 -1.939) 2.164 ======================= Grid point 277 (136/160) ======================= q-point: (-0.44 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.517 ( -3.108 6.858 1.463) 7.670 1.893 ( -5.379 -3.085 3.937) 7.345 2.026 ( -4.036 6.442 5.095) 9.151 2.152 ( -7.520 5.692 5.229) 10.784 2.469 ( -6.124 3.786 -10.776) 12.960 2.621 ( -15.916 3.777 -4.490) 16.963 2.772 ( -6.038 3.901 -3.885) 8.172 2.873 ( -5.590 4.038 -1.130) 6.988 3.213 ( 4.938 -6.081 5.542) 9.596 3.493 ( 2.424 -5.264 -3.552) 6.797 3.563 ( 4.117 -6.485 1.732) 7.874 3.599 ( 0.826 -2.220 6.984) 7.375 3.792 ( -1.475 -2.293 4.573) 5.324 3.949 ( 4.164 5.918 6.977) 10.052 4.039 ( -1.315 -6.805 6.841) 9.738 4.086 ( 6.499 0.432 3.429) 7.361 4.309 ( -4.188 5.232 6.144) 9.092 4.410 ( 1.788 3.835 -14.056) 14.679 4.553 ( 1.826 -0.795 2.301) 3.043 4.625 ( 0.703 -2.131 -1.669) 2.796 4.765 ( -1.875 -1.180 -2.100) 3.053 4.837 ( -0.393 -0.854 -4.326) 4.427 5.506 ( 3.695 -5.820 -2.561) 7.354 5.618 ( 2.401 -2.106 -6.031) 6.825 6.005 ( 0.617 2.660 2.022) 3.398 6.091 ( -0.639 1.411 -0.007) 1.549 6.707 ( 2.999 1.168 4.778) 5.760 6.795 ( 3.136 1.493 0.583) 3.522 7.055 ( -0.174 -1.310 -1.466) 1.974 7.151 ( -1.150 -0.883 -4.493) 4.721 7.242 ( 10.349 -5.416 29.039) 31.300 8.055 ( 3.495 -4.153 -26.273) 26.827 8.776 ( -1.783 -1.794 -3.083) 3.988 8.831 ( -5.562 -2.172 3.676) 7.012 9.106 ( -5.295 1.122 2.857) 6.120 9.185 ( -3.002 -1.333 -3.202) 4.587 9.381 ( 6.211 1.794 3.809) 7.504 9.683 ( -1.000 1.953 -1.394) 2.599 10.123 ( 5.025 -1.307 1.884) 5.524 10.190 ( 4.194 -3.590 -3.064) 6.314 10.631 ( -0.523 -0.871 7.297) 7.368 10.816 ( -3.847 -0.661 -2.975) 4.908 11.169 ( 1.787 1.224 -1.811) 2.824 11.283 ( -2.652 0.890 -0.421) 2.829 11.594 ( -0.274 -1.532 4.836) 5.080 11.825 ( 0.543 -6.807 -0.390) 6.840 12.442 ( 3.419 -0.488 -2.242) 4.117 12.541 ( 3.599 -0.176 -1.824) 4.039 13.348 ( 8.694 9.021 9.124) 15.499 13.667 ( 4.000 9.572 -6.675) 12.336 14.251 ( -15.851 3.418 9.064) 18.576 14.866 ( -20.960 -7.219 -15.779) 27.211 15.734 ( 2.391 0.046 7.331) 7.711 15.882 ( 0.633 0.506 -2.820) 2.934 ======================= Grid point 278 (137/160) ======================= q-point: (-0.33 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( 3.259 6.915 7.397) 10.638 1.751 ( -5.707 9.634 8.539) 14.082 1.930 ( -2.874 4.547 9.648) 11.046 2.024 ( -1.696 2.532 -3.438) 4.594 2.236 ( -16.291 5.584 -7.284) 18.699 2.347 ( -9.304 3.019 -12.526) 15.893 2.678 ( -0.902 3.787 -1.392) 4.134 2.766 ( -3.307 2.861 -2.146) 4.870 3.349 ( 3.508 -6.235 6.699) 9.801 3.561 ( -2.694 -2.318 1.738) 3.957 3.588 ( 1.352 -2.996 3.928) 5.122 3.744 ( 4.828 -5.204 0.845) 7.149 3.818 ( 1.166 -7.683 3.611) 8.569 3.884 ( -2.828 9.826 17.620) 20.372 4.073 ( -3.067 -5.538 1.626) 6.536 4.140 ( 4.531 6.753 -11.813) 14.342 4.303 ( 5.275 -2.532 7.325) 9.375 4.417 ( 2.859 0.790 -10.660) 11.065 4.584 ( 1.398 -0.277 2.000) 2.456 4.682 ( -0.130 -3.829 0.226) 3.838 4.721 ( -3.028 -0.687 -3.373) 4.584 4.830 ( -0.915 0.327 -1.758) 2.008 5.586 ( 0.197 -3.230 2.107) 3.861 5.682 ( 2.017 -3.865 -7.628) 8.786 5.985 ( 0.390 3.107 3.177) 4.461 6.057 ( -1.061 2.178 -0.271) 2.438 6.739 ( 2.033 1.451 4.549) 5.190 6.816 ( 1.586 2.415 -0.380) 2.914 7.066 ( -0.113 -1.589 -0.854) 1.808 7.142 ( -0.784 -1.126 -5.219) 5.397 7.532 ( 12.477 -10.427 22.240) 27.550 8.140 ( 0.914 -6.503 -22.047) 23.004 8.761 ( -3.017 -2.781 0.585) 4.144 8.776 ( -3.517 -3.491 -0.132) 4.957 9.034 ( -1.877 0.592 3.237) 3.788 9.136 ( -3.313 -0.116 -2.713) 4.284 9.454 ( 4.181 1.601 4.836) 6.590 9.643 ( -1.107 2.242 -3.629) 4.407 10.221 ( 4.299 -1.820 2.531) 5.310 10.295 ( 3.226 -3.101 -2.588) 5.169 10.642 ( 0.474 -1.400 8.372) 8.501 10.777 ( -1.793 -1.558 -2.501) 3.449 11.182 ( 0.847 2.355 0.306) 2.521 11.235 ( -1.424 0.687 -2.344) 2.827 11.658 ( 4.265 -5.627 6.672) 9.715 11.913 ( -0.366 -10.100 -2.654) 10.449 12.512 ( 4.416 0.182 -0.445) 4.442 12.609 ( 3.766 -0.286 -3.783) 5.346 13.380 ( 6.984 10.927 4.464) 13.715 13.566 ( -6.533 3.732 1.491) 7.670 13.992 ( -5.587 11.498 6.091) 14.160 14.555 ( -21.055 -2.389 -16.897) 27.102 15.770 ( 1.318 -0.316 6.962) 7.093 15.885 ( 0.478 0.598 -3.195) 3.285 ======================= Grid point 279 (138/160) ======================= q-point: (-0.22 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.481 ( 4.105 8.146 12.621) 15.572 1.593 ( 4.237 10.792 4.781) 12.542 1.826 ( -1.597 11.027 8.262) 13.871 1.934 ( -11.591 0.313 -1.847) 11.741 2.056 ( 6.466 0.732 -3.545) 7.410 2.215 ( -2.736 2.869 -14.040) 14.589 2.641 ( -0.881 2.049 2.116) 3.074 2.708 ( -0.360 2.030 -4.654) 5.090 3.433 ( -1.005 -3.443 12.996) 13.482 3.528 ( 1.502 2.418 11.220) 11.575 3.626 ( -1.988 -3.708 -3.782) 5.658 3.719 ( -3.585 9.239 18.621) 21.094 3.809 ( 1.599 -3.855 -7.182) 8.307 3.996 ( 3.768 -11.371 5.137) 13.034 4.083 ( -2.227 -6.339 -3.872) 7.755 4.151 ( 4.332 5.715 -17.941) 19.321 4.391 ( -0.370 -2.381 5.506) 6.011 4.488 ( 4.980 -1.676 -4.373) 6.836 4.618 ( -4.166 0.253 -2.666) 4.953 4.625 ( 1.870 -1.222 -0.597) 2.312 4.739 ( 0.357 -0.972 3.174) 3.338 4.795 ( -2.180 1.034 -0.687) 2.509 5.590 ( -1.855 -1.632 4.719) 5.327 5.739 ( -0.180 -3.983 -7.238) 8.264 5.965 ( 0.887 2.995 3.923) 5.015 6.017 ( -0.950 2.438 -1.104) 2.840 6.744 ( 0.084 1.553 4.376) 4.644 6.802 ( -0.281 2.600 -0.850) 2.750 7.082 ( 0.218 -1.554 -0.557) 1.665 7.144 ( -0.255 -1.221 -5.434) 5.576 7.807 ( 5.183 -11.427 17.078) 21.192 8.188 ( -3.685 -7.857 -20.283) 22.062 8.741 ( -1.702 -2.874 2.933) 4.445 8.791 ( 1.056 -3.509 -1.730) 4.053 9.035 ( 1.583 -0.933 2.837) 3.380 9.089 ( -1.316 0.480 -2.510) 2.875 9.490 ( 1.452 1.266 5.870) 6.178 9.595 ( -2.363 1.777 -4.009) 4.981 10.291 ( 0.708 -3.873 2.475) 4.650 10.340 ( -0.409 -1.574 -1.751) 2.390 10.671 ( 0.388 -2.085 7.916) 8.195 10.780 ( -0.081 -1.631 -2.289) 2.812 11.149 ( -1.431 1.760 2.608) 3.457 11.221 ( 0.663 2.333 -3.716) 4.438 11.839 ( 4.892 -10.962 8.673) 14.810 11.981 ( -4.205 -12.405 -5.056) 14.040 12.570 ( 1.570 -0.332 0.899) 1.840 12.636 ( -1.732 -0.091 -4.987) 5.281 13.386 ( -5.966 7.426 3.028) 9.996 13.446 ( 9.685 6.972 -2.749) 12.246 13.903 ( 6.719 7.255 12.874) 16.233 14.215 ( -11.164 10.259 -17.657) 23.274 15.781 ( -0.502 -0.121 6.913) 6.932 15.885 ( 0.088 0.405 -3.114) 3.141 ======================= Grid point 280 (139/160) ======================= q-point: (-0.11 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.338 ( -3.639 12.166 3.596) 13.198 1.713 ( 3.664 9.074 3.694) 10.460 1.746 ( 14.572 4.515 9.789) 18.126 1.862 ( 2.314 1.491 4.220) 5.038 2.142 ( 3.896 3.202 -9.999) 11.199 2.266 ( 11.301 -0.707 -2.434) 11.582 2.614 ( 0.070 0.378 0.230) 0.448 2.710 ( 1.940 1.029 -2.240) 3.137 3.389 ( -0.210 6.956 23.732) 24.732 3.552 ( -0.879 -1.364 5.719) 5.945 3.608 ( -3.491 -0.810 5.323) 6.417 3.655 ( 1.873 -2.050 3.856) 4.752 3.885 ( 2.748 -2.760 -9.667) 10.422 4.057 ( -7.138 -7.060 -1.599) 10.166 4.114 ( 1.869 -0.451 -10.535) 10.709 4.210 ( 2.408 -4.772 -4.288) 6.853 4.357 ( -3.861 -1.387 -1.058) 4.237 4.539 ( -1.953 1.628 -4.849) 5.475 4.589 ( 4.126 -1.640 2.170) 4.942 4.690 ( 1.694 0.888 0.201) 1.924 4.703 ( -3.612 -0.119 4.672) 5.906 4.773 ( 0.841 0.253 -1.392) 1.646 5.573 ( -1.868 -1.448 4.105) 4.737 5.741 ( -3.487 -2.756 -4.696) 6.466 5.961 ( 1.348 2.080 3.775) 4.516 5.981 ( -0.385 2.132 -1.062) 2.413 6.717 ( -1.564 1.280 4.317) 4.766 6.757 ( -2.066 2.326 -0.425) 3.140 7.099 ( 0.123 -0.976 -0.872) 1.315 7.154 ( 0.190 -1.226 -5.063) 5.213 7.899 ( -6.053 -8.521 17.187) 20.116 8.138 ( -9.833 -6.108 -22.057) 24.910 8.766 ( 0.898 -3.172 4.241) 5.372 8.868 ( 4.201 -2.366 -1.908) 5.185 9.074 ( 1.801 -0.223 -1.834) 2.580 9.118 ( 4.386 -0.971 0.588) 4.530 9.466 ( -2.420 3.207 2.675) 4.827 9.533 ( -3.381 0.185 0.039) 3.387 10.306 ( -3.477 -1.216 3.076) 4.799 10.346 ( -1.822 -6.935 -1.550) 7.336 10.692 ( -0.314 -1.620 6.736) 6.935 10.790 ( -0.142 -0.737 -3.064) 3.155 11.118 ( -0.453 0.913 1.307) 1.658 11.208 ( 1.666 3.123 -1.882) 4.008 11.889 ( -8.130 -7.893 0.537) 11.344 12.054 ( -5.049 -10.938 2.227) 12.252 12.545 ( -4.228 -3.179 -1.045) 5.392 12.602 ( -1.896 -1.853 -1.560) 3.076 13.149 ( -7.585 12.929 1.456) 15.060 13.490 ( -8.309 6.738 -0.351) 10.703 14.022 ( 26.155 8.297 -12.726) 30.247 14.270 ( 22.658 3.177 8.171) 24.295 15.760 ( -1.786 0.416 7.136) 7.368 15.875 ( -0.892 0.265 -2.564) 2.728 ======================= Grid point 284 (140/160) ======================= q-point: (-0.67 0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.644 ( 9.811 -0.000 1.921) 9.997 1.816 ( -10.214 0.000 -3.927) 10.943 2.255 ( -8.791 0.000 5.337) 10.284 2.359 ( -0.991 0.000 10.882) 10.927 2.585 ( -1.072 0.000 -7.624) 7.699 2.893 ( -10.195 0.000 -2.326) 10.457 2.951 ( -5.244 0.000 3.329) 6.211 3.020 ( 0.647 -0.000 -6.783) 6.814 3.084 ( -5.707 0.000 2.193) 6.113 3.383 ( 3.302 -0.000 2.946) 4.425 3.465 ( 4.661 -0.000 0.992) 4.766 3.472 ( -1.340 0.000 1.154) 1.768 3.861 ( -6.697 0.000 0.702) 6.734 3.884 ( 7.101 -0.000 10.822) 12.944 3.971 ( 2.405 -0.000 1.346) 2.756 4.002 ( -4.453 0.000 6.452) 7.840 4.330 ( 5.162 -0.000 6.033) 7.940 4.463 ( 3.096 -0.000 -13.042) 13.405 4.534 ( -4.418 0.000 6.994) 8.273 4.722 ( 2.171 -0.000 -4.518) 5.013 4.792 ( -4.438 0.000 -5.286) 6.902 4.793 ( -1.189 0.000 -5.313) 5.445 5.313 ( 3.763 -0.000 -0.560) 3.805 5.550 ( 2.019 -0.000 -6.962) 7.249 6.033 ( 1.218 -0.000 1.016) 1.587 6.097 ( 1.792 -0.000 -1.203) 2.158 6.676 ( 2.425 -0.000 5.008) 5.564 6.743 ( 4.451 -0.000 2.693) 5.203 7.049 ( -0.860 0.000 -2.089) 2.259 7.062 ( 1.668 -0.000 33.567) 33.608 7.179 ( -1.754 0.000 -2.446) 3.010 7.927 ( 5.180 -0.000 -30.548) 30.985 8.815 ( -4.012 0.000 -5.658) 6.936 8.895 ( -5.333 0.000 6.940) 8.753 9.177 ( -0.637 0.000 -4.127) 4.176 9.221 ( -4.017 0.000 -0.091) 4.018 9.306 ( 4.355 -0.000 3.751) 5.748 9.684 ( 3.840 -0.000 5.971) 7.099 10.030 ( 3.747 -0.000 0.153) 3.750 10.116 ( -2.527 0.000 -4.967) 5.572 10.622 ( -0.195 0.000 6.397) 6.400 10.882 ( -3.593 0.000 -3.770) 5.208 11.171 ( -0.606 0.000 -2.901) 2.964 11.343 ( -1.955 0.000 0.786) 2.107 11.630 ( -2.602 0.000 3.688) 4.513 11.709 ( -1.030 0.000 1.364) 1.709 12.385 ( 2.237 -0.000 -3.054) 3.785 12.487 ( 2.487 -0.000 -0.689) 2.581 13.308 ( 10.716 -0.000 11.472) 15.698 13.681 ( 15.248 -0.000 -12.414) 19.662 14.562 ( -18.034 0.000 11.842) 21.575 15.075 ( -17.757 0.000 -14.483) 22.914 15.695 ( 2.635 -0.000 7.574) 8.019 15.874 ( 1.118 -0.000 -1.867) 2.176 ======================= Grid point 286 (141/160) ======================= q-point: (-0.56 0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.626 ( -5.876 4.308 -0.380) 7.296 1.801 ( 2.256 -4.637 2.900) 5.916 2.122 ( -4.419 2.715 0.447) 5.206 2.264 ( -7.536 4.131 12.240) 14.955 2.525 ( -5.325 1.699 -8.143) 9.877 2.665 ( -14.510 0.840 -6.865) 16.074 2.834 ( -6.441 1.785 1.816) 6.927 2.939 ( -5.548 1.958 -1.999) 6.214 3.140 ( 6.577 -1.491 2.396) 7.157 3.413 ( 0.083 -2.442 -2.216) 3.299 3.472 ( 0.848 -2.228 0.010) 2.384 3.560 ( 4.226 -1.532 3.922) 5.965 3.759 ( -4.908 -0.984 1.717) 5.292 3.918 ( -4.246 -3.631 6.143) 8.304 4.040 ( 8.297 2.428 9.536) 12.872 4.075 ( 7.953 -1.074 3.842) 8.897 4.383 ( -0.719 3.459 8.385) 9.099 4.494 ( -0.150 -3.990 7.865) 8.820 4.503 ( 3.361 2.789 -13.078) 13.789 4.679 ( -2.512 5.949 -6.622) 9.249 4.736 ( -2.227 -0.853 -3.885) 4.559 4.798 ( -0.595 -3.504 -4.770) 5.948 5.404 ( 4.163 -3.590 -0.767) 5.550 5.587 ( 1.863 -0.918 -7.261) 7.553 6.046 ( 0.916 1.326 1.759) 2.386 6.107 ( -0.229 0.319 -0.099) 0.405 6.724 ( 3.107 0.490 5.381) 6.233 6.815 ( 3.996 0.505 0.953) 4.139 7.039 ( -0.412 -0.383 -2.515) 2.578 7.126 ( 0.457 -1.218 6.595) 6.722 7.179 ( 4.933 -1.232 21.720) 22.307 7.998 ( 2.803 -1.548 -28.001) 28.184 8.752 ( -3.426 -0.598 -4.481) 5.673 8.800 ( -6.185 -0.932 5.032) 8.028 9.122 ( -5.528 0.489 2.455) 6.068 9.166 ( -1.356 -0.578 -4.214) 4.465 9.411 ( 6.632 0.981 3.103) 7.387 9.709 ( -0.491 0.640 1.984) 2.141 10.112 ( 5.658 0.061 -1.006) 5.747 10.137 ( 3.995 -1.762 -1.974) 4.792 10.618 ( -0.626 -0.442 6.381) 6.427 10.804 ( -4.928 -0.388 -2.455) 5.519 11.183 ( 1.899 0.274 -2.952) 3.520 11.303 ( -2.352 0.773 0.536) 2.533 11.588 ( -1.548 0.599 3.612) 3.975 11.710 ( -1.221 -4.095 -0.067) 4.274 12.443 ( 4.515 0.181 -1.576) 4.785 12.540 ( 3.758 -0.036 -2.056) 4.283 13.469 ( 9.130 3.262 12.221) 15.600 13.800 ( -1.567 3.640 -6.532) 7.641 14.320 ( -6.627 2.969 1.127) 7.348 14.742 ( -22.256 -4.485 -9.869) 24.756 15.737 ( 2.146 0.115 7.532) 7.832 15.889 ( 0.717 0.180 -2.880) 2.974 ======================= Grid point 287 (142/160) ======================= q-point: (-0.44 0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.544 ( 1.553 3.571 5.536) 6.769 1.830 ( -1.305 -0.442 4.538) 4.743 2.049 ( -3.294 6.867 9.773) 12.390 2.089 ( -3.389 3.504 -1.557) 5.118 2.351 ( -12.376 5.003 -6.962) 15.056 2.411 ( -9.974 3.430 -10.676) 15.008 2.747 ( -1.233 2.885 0.802) 3.238 2.832 ( -3.810 3.188 -0.103) 4.969 3.264 ( 5.050 -2.125 3.581) 6.546 3.454 ( -0.122 -5.611 -5.869) 8.121 3.546 ( 2.730 -5.177 1.979) 6.178 3.633 ( 3.861 -1.602 9.446) 10.329 3.712 ( -4.278 -4.667 0.424) 6.346 3.894 ( -3.125 -4.740 0.820) 5.737 4.140 ( 5.633 6.006 13.540) 15.847 4.228 ( 6.977 2.410 1.629) 7.559 4.261 ( -3.843 1.373 10.000) 10.800 4.512 ( 3.306 6.029 -16.109) 17.515 4.566 ( 0.744 -4.258 8.023) 9.113 4.618 ( -0.030 1.001 -5.533) 5.623 4.696 ( -3.016 -1.423 -4.686) 5.752 4.815 ( -0.864 -2.023 -4.002) 4.567 5.501 ( 1.982 -4.823 0.697) 5.261 5.622 ( 0.624 -2.205 -6.373) 6.773 6.039 ( 0.384 2.285 2.858) 3.679 6.090 ( -0.757 1.162 0.375) 1.436 6.765 ( 2.247 1.012 5.497) 6.024 6.858 ( 2.161 1.739 -0.455) 2.811 7.042 ( 0.096 -0.816 -1.939) 2.106 7.115 ( -1.462 -1.435 -4.088) 4.572 7.359 ( 9.040 -6.643 26.923) 29.166 8.041 ( 0.010 -3.510 -25.483) 25.724 8.713 ( -2.922 -1.855 -0.656) 3.522 8.720 ( -4.197 -2.147 1.100) 4.841 9.047 ( -2.604 0.552 3.610) 4.486 9.136 ( -2.223 0.063 -3.760) 4.368 9.491 ( 4.280 1.836 4.689) 6.609 9.678 ( -1.661 1.223 -2.047) 2.906 10.202 ( 4.098 -0.308 2.347) 4.732 10.247 ( 5.577 -1.872 -3.505) 6.848 10.617 ( -0.276 -1.075 7.057) 7.144 10.744 ( -2.762 -1.489 -2.073) 3.761 11.217 ( 2.219 1.029 -2.148) 3.255 11.250 ( -2.362 1.046 0.319) 2.603 11.587 ( 1.226 -1.822 4.381) 4.900 11.741 ( -1.845 -7.098 -2.155) 7.644 12.523 ( 4.933 0.635 0.450) 4.994 12.610 ( 4.303 0.149 -4.092) 5.940 13.543 ( 4.609 5.755 6.670) 9.943 13.626 ( -10.405 2.258 2.525) 10.942 14.198 ( -4.865 9.633 0.876) 10.827 14.486 ( -11.441 -4.774 -13.351) 18.219 15.767 ( 1.264 -0.033 7.413) 7.520 15.894 ( 0.357 0.350 -3.360) 3.397 ======================= Grid point 288 (143/160) ======================= q-point: (-0.33 0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( 9.336 4.932 10.215) 14.692 1.767 ( -3.338 4.586 -2.483) 6.192 1.920 ( -3.270 3.500 13.668) 14.483 2.061 ( -5.809 6.597 1.946) 9.003 2.111 ( 4.492 7.102 -6.045) 10.352 2.278 ( -2.451 3.553 -14.074) 14.721 2.703 ( -0.960 3.831 3.518) 5.289 2.762 ( -0.527 3.183 -2.425) 4.036 3.348 ( 1.509 -3.663 6.000) 7.189 3.489 ( -1.804 -5.166 -6.757) 8.695 3.611 ( 2.438 1.026 9.111) 9.487 3.700 ( -3.567 -7.535 -0.146) 8.338 3.779 ( 4.833 -9.392 4.971) 11.674 3.896 ( -1.479 -1.819 2.171) 3.195 4.005 ( -4.615 9.571 11.914) 15.964 4.244 ( 0.870 -0.399 4.062) 4.173 4.379 ( 6.341 1.207 -3.504) 7.345 4.493 ( 1.294 3.576 -13.259) 13.793 4.577 ( -3.213 -2.867 1.069) 4.437 4.625 ( 2.071 0.186 -3.844) 4.370 4.702 ( 0.546 -2.754 2.402) 3.695 4.802 ( -1.858 -0.307 -3.125) 3.649 5.546 ( -1.249 -3.046 3.262) 4.635 5.653 ( -0.718 -4.431 -5.833) 7.360 6.021 ( 0.394 2.609 3.858) 4.674 6.062 ( -0.850 1.995 -0.072) 2.170 6.776 ( 0.372 1.584 5.498) 5.733 6.853 ( -0.209 2.491 -1.213) 2.778 7.055 ( 0.469 -1.056 -0.602) 1.303 7.113 ( -0.595 -1.828 -5.112) 5.462 7.580 ( 5.137 -10.884 21.806) 24.907 8.054 ( -3.250 -5.483 -23.972) 24.805 8.682 ( -2.050 -2.850 2.718) 4.440 8.729 ( 1.628 -2.712 -1.726) 3.604 9.027 ( 0.475 -0.032 4.313) 4.339 9.100 ( -1.190 0.522 -3.062) 3.327 9.527 ( 2.404 2.201 5.882) 6.725 9.627 ( -3.043 1.384 -3.248) 4.661 10.236 ( -1.157 -1.593 3.503) 4.018 10.323 ( 1.472 -0.635 -4.505) 4.782 10.634 ( 0.448 -1.700 7.631) 7.831 10.740 ( -0.331 -2.247 -1.945) 2.990 11.182 ( -2.471 1.607 2.837) 4.091 11.254 ( 1.802 1.227 -3.570) 4.183 11.673 ( 3.798 -6.068 5.877) 9.262 11.771 ( -3.769 -8.870 -3.846) 10.377 12.573 ( 1.098 0.418 1.260) 1.723 12.646 ( -0.755 0.761 -5.351) 5.457 13.499 ( -0.939 4.439 2.866) 5.366 13.558 ( 4.662 4.589 -2.656) 7.060 14.034 ( -1.872 5.723 14.646) 15.835 14.374 ( -2.267 6.038 -18.239) 19.346 15.780 ( 0.046 0.026 7.287) 7.287 15.892 ( -0.148 0.337 -3.425) 3.445 ======================= Grid point 289 (144/160) ======================= q-point: (-0.22 0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.568 ( -3.682 10.068 -2.808) 11.082 1.797 ( 4.651 1.269 4.119) 6.341 1.873 ( 7.049 6.008 3.578) 9.929 1.964 ( 6.329 8.924 13.588) 17.445 2.221 ( 3.933 4.645 -8.277) 10.274 2.269 ( 11.584 1.627 -4.672) 12.596 2.655 ( 0.303 3.647 2.789) 4.602 2.743 ( 1.403 2.401 -1.022) 2.962 3.393 ( -0.153 -3.768 7.817) 8.680 3.501 ( -3.420 -6.389 -5.577) 9.145 3.618 ( 1.237 3.489 9.738) 10.418 3.706 ( -3.828 0.180 8.119) 8.978 3.816 ( -0.076 -1.110 7.710) 7.789 3.910 ( -1.249 -4.697 -1.745) 5.164 4.008 ( 3.035 -6.844 -0.350) 7.495 4.223 ( -2.567 0.699 -1.338) 2.977 4.357 ( -4.050 2.319 -6.461) 7.970 4.543 ( 3.688 -1.635 -8.730) 9.617 4.565 ( 1.072 0.139 -4.306) 4.439 4.675 ( 0.938 -1.457 1.769) 2.477 4.711 ( -0.427 0.041 0.104) 0.442 4.777 ( -0.612 0.225 0.713) 0.966 5.538 ( -2.147 -2.120 3.188) 4.389 5.666 ( -3.321 -4.814 -3.743) 6.943 6.005 ( 0.176 2.266 3.786) 4.416 6.027 ( -0.424 2.359 0.331) 2.420 6.750 ( -1.391 1.950 5.463) 5.965 6.806 ( -2.288 2.565 -1.199) 3.640 7.077 ( 0.763 -1.141 0.047) 1.373 7.124 ( -0.130 -1.724 -5.337) 5.610 7.708 ( -3.603 -10.535 19.827) 22.739 8.017 ( -7.163 -5.726 -24.825) 26.464 8.701 ( 0.342 -3.351 3.797) 5.076 8.821 ( 5.541 -2.478 -2.070) 6.413 9.064 ( 3.108 -1.030 2.912) 4.382 9.100 ( 1.874 -0.225 -1.790) 2.602 9.533 ( -1.605 3.202 0.849) 3.681 9.545 ( -2.235 1.203 2.332) 3.447 10.218 ( -3.635 -4.147 2.592) 6.093 10.306 ( -3.626 -0.723 -3.271) 4.936 10.665 ( 1.250 -1.167 7.674) 7.863 10.758 ( -0.143 -2.185 -2.269) 3.153 11.135 ( -1.546 0.782 2.939) 3.412 11.262 ( 1.476 2.344 -2.965) 4.058 11.744 ( -4.264 -6.675 -0.658) 7.948 11.838 ( 1.047 -10.009 3.459) 10.642 12.537 ( -5.701 1.061 -2.122) 6.175 12.583 ( -2.908 -0.387 -1.979) 3.539 13.390 ( -4.444 11.521 3.398) 12.808 13.605 ( 0.949 5.119 -2.286) 5.686 14.123 ( 17.641 2.255 1.525) 17.850 14.360 ( 11.439 5.389 -5.906) 13.956 15.770 ( -1.000 0.583 7.198) 7.291 15.880 ( -0.941 0.230 -3.040) 3.191 ======================= Grid point 290 (145/160) ======================= q-point: (-0.11 0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.423 ( -0.094 11.670 -2.941) 12.035 1.850 ( 7.063 2.940 6.830) 10.256 1.986 ( 10.783 5.390 -2.434) 12.298 2.080 ( 11.927 6.107 13.283) 18.867 2.223 ( 2.708 2.047 -7.812) 8.518 2.506 ( 14.957 1.832 1.029) 15.104 2.670 ( 5.437 1.597 -0.377) 5.679 2.771 ( 4.372 1.418 1.863) 4.959 3.431 ( 0.238 -3.523 6.633) 7.514 3.486 ( -4.466 -3.845 2.261) 6.312 3.555 ( -2.174 4.960 9.984) 11.358 3.666 ( -1.544 -0.793 6.895) 7.110 3.834 ( -5.366 -4.424 1.490) 7.113 3.946 ( 3.536 -2.133 -3.302) 5.287 4.076 ( -1.663 -4.062 -1.356) 4.593 4.188 ( -1.613 -2.103 -2.680) 3.769 4.274 ( -5.197 -2.425 -5.573) 7.997 4.581 ( -0.516 0.093 -3.995) 4.029 4.598 ( 1.882 0.966 -4.770) 5.218 4.662 ( 0.651 -0.430 -0.511) 0.933 4.725 ( 0.599 2.489 0.836) 2.693 4.777 ( 0.279 -1.814 -1.915) 2.652 5.525 ( -1.741 -2.023 1.268) 2.955 5.627 ( -6.029 -3.459 -1.109) 7.039 5.979 ( -0.677 1.581 0.809) 1.901 6.013 ( 0.828 1.818 3.663) 4.172 6.701 ( -2.075 1.865 5.325) 6.012 6.733 ( -3.229 2.166 -0.291) 3.899 7.095 ( 0.151 -0.431 -0.012) 0.457 7.141 ( 0.317 -1.824 -4.746) 5.094 7.667 ( -11.569 -7.355 22.419) 26.279 7.923 ( -8.053 -3.690 -27.931) 29.302 8.747 ( 0.737 -3.633 4.327) 5.698 8.930 ( 4.565 -1.489 -1.336) 4.984 9.134 ( 4.678 0.559 -2.101) 5.159 9.177 ( 4.760 -2.698 1.368) 5.640 9.410 ( -7.107 1.554 -1.916) 7.523 9.538 ( 2.095 4.612 4.380) 6.697 10.182 ( -6.591 -3.696 4.118) 8.606 10.260 ( -2.572 -3.984 -3.272) 5.761 10.691 ( 0.810 0.054 7.301) 7.346 10.782 ( 0.734 -1.820 -3.027) 3.608 11.123 ( 0.691 -0.255 0.844) 1.120 11.270 ( 2.490 2.071 -1.308) 3.493 11.725 ( -3.656 -4.394 -1.565) 5.927 11.894 ( -4.185 -4.778 4.898) 8.021 12.456 ( -2.577 -2.971 -0.392) 3.953 12.556 ( -1.748 -1.029 -2.486) 3.209 13.160 ( -7.094 13.149 3.044) 15.248 13.429 ( -9.037 10.772 -1.334) 14.124 14.534 ( 28.021 -1.351 -15.265) 31.938 14.629 ( 18.330 -1.605 10.774) 21.322 15.741 ( -1.464 1.203 6.651) 6.916 15.856 ( -1.389 0.291 -2.225) 2.639 ======================= Grid point 295 (146/160) ======================= q-point: (-0.56 0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.579 ( 0.591 -0.000 4.451) 4.490 1.816 ( 0.197 -0.000 4.719) 4.723 2.109 ( 0.714 -0.000 -5.639) 5.684 2.143 ( -8.812 0.000 13.285) 15.941 2.400 ( -9.048 0.000 -7.794) 11.942 2.454 ( -10.584 0.000 -9.352) 14.124 2.777 ( -0.827 0.000 2.820) 2.939 2.864 ( -4.284 0.000 1.645) 4.589 3.255 ( 6.215 -0.000 0.718) 6.256 3.388 ( -0.601 0.000 -3.283) 3.337 3.481 ( 2.623 -0.000 -1.363) 2.955 3.629 ( 1.990 -0.000 8.028) 8.271 3.660 ( -3.801 0.000 -1.316) 4.023 3.841 ( -2.881 0.000 4.362) 5.228 4.176 ( 4.567 -0.000 13.494) 14.246 4.216 ( 9.501 -0.000 -3.243) 10.040 4.419 ( -3.544 0.000 16.537) 16.912 4.423 ( -0.726 0.000 6.375) 6.416 4.563 ( 2.539 -0.000 -7.044) 7.488 4.661 ( -1.437 0.000 -7.690) 7.823 4.731 ( -2.194 0.000 -4.460) 4.970 4.748 ( 0.460 -0.000 -11.903) 11.912 5.445 ( 2.596 -0.000 1.695) 3.100 5.600 ( 0.224 -0.000 -6.983) 6.987 6.063 ( 0.238 -0.000 2.796) 2.807 6.101 ( -0.531 0.000 0.594) 0.796 6.775 ( 2.324 -0.000 5.849) 6.294 6.876 ( 2.600 -0.000 -0.923) 2.759 7.035 ( 0.343 -0.000 -2.953) 2.973 7.098 ( -1.836 0.000 -2.473) 3.080 7.293 ( 7.305 -0.000 28.807) 29.719 8.007 ( -0.178 0.000 -27.069) 27.070 8.695 ( -2.277 0.000 -3.094) 3.841 8.698 ( -5.026 0.000 3.508) 6.129 9.052 ( -2.800 0.000 3.608) 4.567 9.137 ( -1.834 0.000 -4.057) 4.452 9.511 ( 4.298 -0.000 4.245) 6.042 9.689 ( -1.873 0.000 -1.076) 2.161 10.202 ( 3.782 -0.000 2.766) 4.685 10.226 ( 6.795 -0.000 -4.038) 7.904 10.606 ( -0.474 0.000 6.190) 6.209 10.728 ( -3.198 0.000 -1.846) 3.693 11.225 ( 2.837 -0.000 -3.166) 4.251 11.264 ( -2.842 0.000 1.215) 3.091 11.576 ( 0.002 -0.000 3.214) 3.214 11.664 ( -1.768 0.000 -1.322) 2.208 12.529 ( 4.914 -0.000 0.761) 4.972 12.612 ( 4.512 -0.000 -4.239) 6.191 13.599 ( 3.607 -0.000 7.624) 8.434 13.648 ( -11.334 0.000 3.032) 11.733 14.345 ( -19.269 0.000 2.202) 19.395 14.387 ( 6.132 -0.000 -15.522) 16.689 15.767 ( 1.203 -0.000 7.511) 7.607 15.898 ( 0.323 -0.000 -3.424) 3.439 ======================= Grid point 297 (147/160) ======================= q-point: (-0.44 0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( 10.045 1.423 8.078) 12.969 1.783 ( -4.904 -0.505 -1.538) 5.165 2.007 ( -4.533 3.159 10.895) 12.216 2.125 ( 2.616 1.718 -1.829) 3.625 2.270 ( -2.598 6.326 -4.621) 8.254 2.327 ( -2.030 0.470 -8.978) 9.217 2.773 ( 0.190 3.060 3.762) 4.853 2.807 ( -1.127 0.711 1.173) 1.775 3.314 ( 1.521 0.076 1.847) 2.394 3.401 ( -0.536 -3.193 -5.311) 6.220 3.556 ( -6.803 -5.115 1.301) 8.610 3.578 ( 5.636 -3.410 0.111) 6.588 3.707 ( 4.118 1.181 7.597) 8.721 3.820 ( -1.533 -3.202 -1.117) 3.721 4.190 ( -4.165 0.218 7.232) 8.348 4.267 ( -1.645 9.904 18.625) 21.158 4.381 ( 8.799 -0.389 -6.333) 10.848 4.467 ( -3.337 -6.581 11.127) 13.352 4.600 ( 1.892 1.648 -6.164) 6.655 4.643 ( -3.231 -0.811 -1.900) 3.835 4.667 ( 2.245 3.184 -9.859) 10.600 4.781 ( 0.361 -1.823 -11.157) 11.311 5.483 ( 0.164 -2.498 3.521) 4.320 5.591 ( -1.937 -1.667 -5.960) 6.485 6.058 ( -0.141 1.043 3.805) 3.947 6.089 ( -0.606 0.760 0.742) 1.222 6.799 ( 0.617 0.643 6.126) 6.190 6.891 ( -0.122 1.226 -2.277) 2.589 7.047 ( 0.967 0.208 -1.766) 2.024 7.079 ( -0.849 -1.472 -4.005) 4.350 7.424 ( 4.578 -4.512 26.560) 27.327 7.984 ( -2.922 -1.787 -27.150) 27.366 8.642 ( -2.117 -1.115 2.845) 3.718 8.692 ( 1.736 -1.017 -1.919) 2.781 9.029 ( -0.154 0.102 4.775) 4.779 9.107 ( -1.111 0.213 -3.214) 3.408 9.562 ( 2.627 1.103 5.320) 6.035 9.645 ( -3.263 0.473 -2.167) 3.945 10.223 ( -1.544 -0.076 3.573) 3.893 10.310 ( 1.811 -0.548 -4.486) 4.869 10.611 ( 0.867 -0.547 5.852) 5.941 10.704 ( -0.423 -1.102 -1.793) 2.147 11.207 ( -3.279 0.808 2.440) 4.167 11.270 ( 2.616 0.456 -3.289) 4.228 11.601 ( 2.227 -1.555 3.301) 4.275 11.648 ( -2.311 -3.631 -1.944) 4.722 12.580 ( 0.695 0.201 1.594) 1.751 12.658 ( -0.247 0.324 -5.527) 5.542 13.558 ( 2.207 1.541 2.993) 4.026 13.620 ( 2.013 1.652 -2.832) 3.847 14.111 ( -6.302 2.100 14.935) 16.346 14.450 ( 1.769 1.899 -17.535) 17.726 15.781 ( 0.345 0.040 7.415) 7.423 15.897 ( -0.292 0.130 -3.593) 3.608 ======================= Grid point 298 (148/160) ======================= q-point: (-0.33 0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( -4.921 1.668 -7.510) 9.132 1.835 ( 8.006 2.289 4.625) 9.525 1.962 ( 3.792 3.642 6.300) 8.206 2.135 ( 4.801 7.851 10.145) 13.697 2.283 ( 7.875 1.074 1.233) 8.043 2.343 ( 7.083 4.986 -11.538) 14.427 2.738 ( 1.230 4.328 4.886) 6.642 2.796 ( 0.711 2.618 1.348) 3.029 3.332 ( -0.647 -1.840 2.318) 3.029 3.393 ( -3.674 -4.300 -5.417) 7.831 3.552 ( -2.463 -8.810 0.285) 9.152 3.660 ( 0.473 -1.193 4.626) 4.801 3.781 ( 3.085 -2.104 7.516) 8.392 3.844 ( 0.378 -3.864 -5.582) 6.799 4.071 ( -0.630 8.901 13.116) 15.863 4.199 ( -3.727 -0.781 7.992) 8.853 4.405 ( -6.699 1.270 -0.038) 6.818 4.513 ( 4.925 -1.050 -9.345) 10.615 4.553 ( -2.944 -2.240 1.937) 4.176 4.665 ( 1.691 -0.345 -2.383) 2.943 4.703 ( 3.178 0.376 -6.558) 7.297 4.787 ( 0.334 0.888 -6.393) 6.463 5.493 ( -1.733 -2.359 3.315) 4.423 5.571 ( -3.608 -4.223 -4.119) 6.915 6.043 ( -0.384 1.518 4.291) 4.568 6.065 ( -0.847 1.427 1.174) 2.033 6.785 ( -1.191 1.412 6.040) 6.316 6.852 ( -2.478 1.983 -2.207) 3.866 7.061 ( 0.867 -0.449 -0.915) 1.338 7.093 ( 0.416 -1.363 -4.346) 4.574 7.524 ( -1.110 -7.644 24.032) 25.242 7.932 ( -5.283 -2.947 -28.014) 28.660 8.646 ( 0.419 -2.098 3.619) 4.205 8.777 ( 6.483 -1.801 -2.356) 7.129 9.044 ( 1.648 -0.728 5.405) 5.697 9.105 ( 1.376 0.383 -2.416) 2.806 9.559 ( -6.121 0.767 -1.181) 6.281 9.594 ( 3.103 2.282 5.221) 6.488 10.173 ( -4.179 -0.845 2.257) 4.824 10.286 ( -5.010 -1.276 -4.133) 6.619 10.649 ( 2.619 -0.465 6.126) 6.679 10.718 ( 0.070 -1.696 -1.800) 2.474 11.149 ( -2.588 0.586 3.344) 4.269 11.299 ( 1.906 1.426 -3.225) 4.009 11.642 ( -1.697 -3.716 -0.903) 4.183 11.688 ( 2.725 -5.331 2.830) 6.622 12.558 ( -3.514 0.747 -0.998) 3.728 12.582 ( -5.700 0.209 -3.291) 6.585 13.580 ( 0.286 7.821 3.412) 8.538 13.680 ( 5.345 2.334 -2.267) 6.257 14.137 ( 12.127 -0.223 6.822) 13.916 14.446 ( 4.011 3.136 -10.307) 11.496 15.781 ( -0.273 0.451 7.211) 7.230 15.883 ( -1.105 0.107 -3.457) 3.631 ======================= Grid point 299 (149/160) ======================= q-point: (-0.22 0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( -0.181 6.144 -6.570) 8.997 1.890 ( 3.486 0.932 3.255) 4.860 2.053 ( 9.347 2.155 -1.829) 9.765 2.211 ( 10.370 7.259 13.320) 18.376 2.328 ( 3.726 7.206 -5.707) 9.919 2.532 ( 15.218 0.773 2.485) 15.439 2.743 ( 3.710 5.396 0.940) 6.615 2.800 ( 4.257 1.694 5.992) 7.543 3.320 ( -4.298 -5.817 -3.570) 8.065 3.404 ( -0.299 -3.752 2.360) 4.443 3.577 ( -3.887 -4.617 0.368) 6.046 3.643 ( -3.876 -2.729 4.243) 6.362 3.814 ( 2.186 2.449 10.440) 10.944 3.909 ( 2.985 -2.917 -1.889) 4.581 4.038 ( 1.587 3.088 8.400) 9.090 4.151 ( -3.326 -2.189 -0.936) 4.090 4.256 ( -8.631 0.551 -5.733) 10.376 4.529 ( -1.696 -3.670 5.459) 6.794 4.593 ( 1.401 -1.720 -9.012) 9.281 4.678 ( -0.024 0.178 -3.648) 3.652 4.751 ( 2.287 0.119 -4.893) 5.402 4.779 ( 1.423 2.834 -3.081) 4.421 5.483 ( -1.865 -2.191 -0.105) 2.879 5.544 ( -4.785 -4.701 -0.555) 6.731 6.012 ( -1.237 1.752 2.287) 3.135 6.044 ( -0.268 1.192 3.749) 3.943 6.739 ( -2.131 1.881 5.635) 6.312 6.777 ( -3.646 2.210 -1.346) 4.471 7.085 ( 1.090 -0.590 0.737) 1.442 7.109 ( 0.276 -1.189 -5.081) 5.226 7.524 ( -7.964 -6.975 24.374) 26.574 7.860 ( -5.266 -2.610 -30.204) 30.771 8.687 ( 1.303 -2.519 4.720) 5.507 8.908 ( 6.020 -0.791 -2.526) 6.576 9.113 ( 4.122 -3.392 3.498) 6.382 9.145 ( 3.923 0.482 -1.370) 4.183 9.431 ( -7.569 0.692 -0.425) 7.612 9.628 ( 4.196 4.145 3.574) 6.897 10.114 ( -4.718 -2.338 2.253) 5.727 10.205 ( -5.302 -2.596 -3.965) 7.112 10.695 ( 2.044 0.378 7.164) 7.459 10.740 ( 0.684 -2.121 -1.784) 2.855 11.118 ( -0.609 -0.220 2.691) 2.768 11.312 ( 1.891 2.044 -2.583) 3.798 11.652 ( -0.744 -2.937 -0.926) 3.168 11.784 ( 1.205 -5.767 3.623) 6.916 12.440 ( -5.586 0.499 -1.796) 5.889 12.542 ( -1.624 -0.520 -2.125) 2.724 13.406 ( -7.947 11.587 6.730) 15.579 13.613 ( -7.461 7.847 -4.837) 11.859 14.488 ( 24.336 -2.947 -7.941) 25.768 14.602 ( 14.415 -1.304 4.057) 15.032 15.766 ( -0.643 1.286 6.203) 6.368 15.859 ( -1.503 -0.040 -2.699) 3.090 ======================= Grid point 300 (150/160) ======================= q-point: (-0.11 0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.541 ( 1.569 7.945 -3.073) 8.662 1.988 ( 6.944 -2.501 2.358) 7.748 2.218 ( 11.431 2.350 -3.091) 12.072 2.273 ( 2.329 7.181 2.170) 7.855 2.317 ( 5.734 5.719 3.202) 8.709 2.730 ( 5.481 2.642 1.956) 6.391 2.811 ( 11.609 -0.447 4.461) 12.445 2.910 ( 9.667 2.452 5.109) 11.206 3.304 ( -5.872 -7.364 -3.479) 10.041 3.420 ( -2.065 -2.523 3.058) 4.470 3.503 ( -6.491 -0.324 1.187) 6.607 3.607 ( -1.819 -0.290 7.005) 7.243 3.825 ( 1.444 4.400 6.206) 7.743 3.991 ( 2.312 -2.102 0.546) 3.172 4.033 ( 0.681 -0.765 3.581) 3.724 4.088 ( -8.269 -3.661 1.743) 9.210 4.175 ( -0.283 -2.498 -8.640) 8.999 4.541 ( -0.737 -0.584 -1.007) 1.378 4.617 ( -0.649 -2.710 -0.390) 2.814 4.661 ( -1.714 -0.912 -3.974) 4.423 4.732 ( -2.115 0.762 1.943) 2.972 4.825 ( 5.568 2.652 -11.063) 12.666 5.467 ( -3.613 -2.835 -3.616) 5.845 5.507 ( -2.555 -1.815 2.033) 3.736 5.981 ( -0.591 1.094 1.673) 2.085 6.030 ( -0.330 0.680 3.765) 3.840 6.688 ( -1.799 1.675 5.032) 5.600 6.697 ( -3.039 1.940 0.036) 3.605 7.093 ( -0.348 0.207 1.612) 1.662 7.133 ( 0.834 -1.577 -4.341) 4.693 7.411 ( -11.694 -4.369 26.416) 29.217 7.809 ( -1.774 -1.143 -32.622) 32.691 8.732 ( 1.082 -2.301 3.818) 4.587 8.980 ( 2.447 -0.217 0.182) 2.464 9.190 ( 1.764 -1.998 -0.019) 2.665 9.239 ( 2.901 -1.879 1.375) 3.720 9.325 ( -1.495 1.388 -1.186) 2.360 9.646 ( 3.331 5.691 -0.038) 6.594 10.059 ( -4.010 -1.919 5.155) 6.807 10.178 ( -2.138 -4.254 -4.390) 6.476 10.713 ( 0.820 0.901 7.168) 7.271 10.776 ( 0.925 -2.322 -1.995) 3.198 11.136 ( 1.637 -1.291 0.982) 2.305 11.327 ( 2.154 1.657 -1.520) 3.114 11.672 ( 0.297 -1.740 -0.083) 1.767 11.819 ( -1.524 -1.842 3.473) 4.217 12.403 ( -0.091 -2.906 -0.318) 2.924 12.521 ( -1.564 -0.553 -3.325) 3.716 13.145 ( -8.665 10.728 3.792) 14.303 13.368 ( -9.395 8.279 -2.307) 12.733 14.854 ( 10.855 -2.807 16.113) 19.630 14.924 ( 21.146 -3.660 -17.852) 27.915 15.733 ( -1.570 1.888 3.803) 4.526 15.843 ( -0.134 0.085 -1.322) 1.332 ======================= Grid point 306 (151/160) ======================= q-point: ( 0.56 -0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( -4.161 0.000 -6.158) 7.432 1.857 ( 8.134 -0.000 2.278) 8.446 2.004 ( 2.603 -0.000 5.892) 6.441 2.244 ( 9.777 -0.000 8.977) 13.273 2.263 ( 0.902 -0.000 2.131) 2.314 2.400 ( 7.573 -0.000 -10.114) 12.635 2.793 ( 1.290 -0.000 3.973) 4.177 2.821 ( 1.272 -0.000 4.191) 4.380 3.326 ( 0.398 -0.000 0.757) 0.855 3.343 ( -6.271 0.000 -6.407) 8.965 3.446 ( -0.568 0.000 1.353) 1.467 3.631 ( 0.711 -0.000 1.902) 2.031 3.775 ( -0.486 0.000 -4.113) 4.142 3.802 ( 5.481 -0.000 7.127) 8.991 4.126 ( -3.158 0.000 3.212) 4.504 4.251 ( -5.475 0.000 13.381) 14.458 4.410 ( -0.254 0.000 16.457) 16.459 4.500 ( -1.130 0.000 -11.390) 11.446 4.516 ( -2.635 0.000 -0.475) 2.678 4.648 ( 1.493 -0.000 -0.992) 1.793 4.721 ( 2.391 -0.000 -5.499) 5.997 4.801 ( 2.499 -0.000 -16.232) 16.423 5.464 ( -0.996 0.000 4.909) 5.009 5.528 ( -4.091 0.000 -5.750) 7.057 6.059 ( -0.422 0.000 4.766) 4.785 6.079 ( -1.193 0.000 1.260) 1.735 6.799 ( -1.099 0.000 6.241) 6.337 6.873 ( -2.589 0.000 -3.169) 4.093 7.059 ( 0.048 -0.000 -4.110) 4.110 7.077 ( 1.733 -0.000 -1.549) 2.324 7.444 ( -0.260 0.000 26.804) 26.806 7.904 ( -4.678 0.000 -29.365) 29.735 8.625 ( 0.487 -0.000 3.607) 3.640 8.759 ( 6.696 -0.000 -2.424) 7.122 9.038 ( 0.871 -0.000 5.891) 5.955 9.109 ( 1.398 -0.000 -2.360) 2.743 9.567 ( -6.362 0.000 -0.794) 6.411 9.617 ( 3.495 -0.000 5.315) 6.361 10.169 ( -4.031 0.000 1.638) 4.351 10.269 ( -5.853 0.000 -3.518) 6.829 10.646 ( 3.068 -0.000 4.846) 5.736 10.700 ( 0.338 -0.000 -1.760) 1.792 11.155 ( -3.079 0.000 3.297) 4.511 11.313 ( 2.159 -0.000 -3.284) 3.930 11.605 ( -0.525 0.000 -0.464) 0.701 11.636 ( 2.705 -0.000 2.228) 3.504 12.564 ( -1.884 0.000 0.084) 1.886 12.585 ( -7.427 0.000 -4.350) 8.607 13.676 ( 1.196 -0.000 2.058) 2.380 13.687 ( 8.287 -0.000 -0.754) 8.321 14.131 ( 9.397 -0.000 7.383) 11.950 14.476 ( 1.744 -0.000 -10.593) 10.735 15.785 ( 0.035 -0.000 7.217) 7.217 15.884 ( -1.210 0.000 -3.628) 3.825 ======================= Grid point 308 (152/160) ======================= q-point: (-0.33 0.56 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.672 ( 2.992 1.800 -5.588) 6.589 1.881 ( -3.758 -0.958 -4.857) 6.215 2.101 ( 9.860 2.035 2.436) 10.358 2.330 ( 8.114 4.124 9.639) 13.257 2.422 ( 7.680 1.545 3.900) 8.751 2.545 ( 11.971 0.759 -2.315) 12.217 2.824 ( -0.123 1.706 6.090) 6.326 2.850 ( 7.447 3.122 4.593) 9.290 3.239 ( -5.667 -2.263 -5.475) 8.198 3.348 ( 0.985 -1.759 1.488) 2.506 3.485 ( 1.536 -3.065 -1.442) 3.719 3.580 ( -6.352 -2.545 2.778) 7.385 3.808 ( 2.272 -2.034 -0.230) 3.058 3.895 ( 5.666 1.396 5.298) 7.882 4.096 ( -1.252 -1.571 -0.826) 2.172 4.151 ( -3.824 3.653 9.395) 10.781 4.295 ( -10.511 3.454 -0.749) 11.089 4.450 ( -0.177 -4.110 9.406) 10.266 4.570 ( 1.504 -0.389 -10.598) 10.712 4.653 ( -1.899 -1.625 2.352) 3.432 4.755 ( 1.596 0.114 -3.198) 3.576 4.836 ( 3.160 2.063 -13.105) 13.637 5.451 ( -2.091 -0.794 -0.982) 2.443 5.467 ( -3.225 -2.673 -0.867) 4.277 6.042 ( -1.309 1.159 3.921) 4.293 6.055 ( -1.230 -0.015 3.163) 3.394 6.766 ( -2.275 0.773 5.562) 6.059 6.811 ( -3.806 1.040 -2.540) 4.693 7.072 ( 1.275 -0.493 -3.974) 4.202 7.102 ( 1.110 0.185 -0.920) 1.453 7.418 ( -5.614 -3.312 27.216) 27.986 7.826 ( -3.868 -0.877 -31.547) 31.795 8.653 ( 1.963 -0.917 4.848) 5.310 8.898 ( 8.437 -0.255 -4.116) 9.391 9.063 ( 1.563 -1.470 5.875) 6.255 9.152 ( 3.608 0.222 -1.004) 3.752 9.439 ( -7.874 0.223 0.418) 7.888 9.685 ( 5.074 1.559 4.210) 6.775 10.101 ( -4.065 0.814 -0.314) 4.157 10.153 ( -7.152 -2.475 -3.227) 8.228 10.702 ( 2.983 0.220 6.336) 7.007 10.710 ( 0.540 -0.803 -1.629) 1.894 11.116 ( -1.362 -0.057 3.330) 3.598 11.342 ( 1.994 0.939 -3.054) 3.767 11.617 ( 1.195 -0.650 0.270) 1.387 11.695 ( 2.462 -2.850 1.937) 4.235 12.452 ( -6.790 0.486 -2.285) 7.181 12.535 ( -1.580 -0.199 -1.868) 2.454 13.579 ( -8.554 5.319 11.299) 15.137 13.715 ( -5.448 2.499 -8.638) 10.514 14.439 ( 23.210 -1.609 -7.995) 24.601 14.581 ( 11.253 -0.674 3.976) 11.953 15.786 ( 0.240 0.637 6.352) 6.388 15.856 ( -2.011 -0.159 -3.388) 3.943 ======================= Grid point 309 (153/160) ======================= q-point: (-0.22 0.56 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.658 ( -2.351 4.906 -5.315) 7.606 1.895 ( 3.763 -6.055 -2.382) 7.516 2.279 ( 13.132 3.557 -0.275) 13.607 2.388 ( 3.011 4.865 4.857) 7.505 2.449 ( 1.124 5.019 -0.997) 5.239 2.776 ( 7.282 1.425 4.713) 8.790 2.807 ( 7.371 0.523 9.448) 11.995 2.967 ( 8.810 3.221 3.224) 9.919 3.194 ( -3.707 -3.326 -4.329) 6.599 3.375 ( -0.827 -1.650 2.138) 2.825 3.471 ( -5.181 -2.548 2.522) 6.301 3.572 ( 1.270 -3.114 -1.227) 3.580 3.871 ( 3.144 -1.274 5.907) 6.812 3.960 ( 2.667 1.618 2.368) 3.916 4.031 ( -9.331 -0.148 -1.217) 9.411 4.111 ( 0.965 1.908 2.622) 3.383 4.122 ( -2.913 -0.179 -0.023) 2.919 4.504 ( 1.833 -2.504 4.439) 5.416 4.573 ( -1.633 -1.216 -7.414) 7.689 4.622 ( -3.568 -2.614 1.256) 4.598 4.756 ( -0.788 1.071 -0.008) 1.329 4.874 ( 3.878 1.932 -11.340) 12.139 5.412 ( -2.932 -2.424 -5.579) 6.753 5.473 ( 0.255 -1.508 1.291) 2.001 6.005 ( -1.375 1.260 2.851) 3.407 6.036 ( -1.238 -0.102 3.921) 4.113 6.715 ( -2.682 1.144 4.048) 4.989 6.735 ( -3.155 1.619 -0.803) 3.636 7.102 ( 1.069 0.137 1.578) 1.911 7.110 ( 0.598 -0.104 -4.284) 4.327 7.330 ( -8.925 -3.725 27.666) 29.308 7.791 ( -0.171 -0.692 -33.553) 33.560 8.703 ( 2.533 -0.834 5.198) 5.843 8.995 ( 3.643 1.667 -1.159) 4.170 9.132 ( 1.920 -3.770 1.286) 4.422 9.205 ( 1.313 -1.237 1.800) 2.548 9.345 ( -0.903 0.613 -0.853) 1.385 9.735 ( 2.645 3.394 -0.773) 4.372 10.026 ( -2.796 -1.111 3.591) 4.684 10.109 ( -2.141 -2.876 -4.122) 5.464 10.721 ( 0.622 -0.387 1.111) 1.331 10.745 ( 1.088 -0.467 5.352) 5.482 11.117 ( 1.004 -0.659 2.562) 2.829 11.364 ( 2.236 1.819 -2.691) 3.943 11.649 ( 1.792 -0.400 0.404) 1.880 11.761 ( 1.029 -3.593 2.382) 4.432 12.373 ( -1.969 -0.543 -1.165) 2.351 12.512 ( -1.476 -0.343 -3.174) 3.517 13.336 ( -11.591 8.067 8.225) 16.342 13.501 ( -12.584 4.995 -7.183) 15.326 14.806 ( 11.674 -1.880 14.210) 18.486 14.856 ( 21.336 -2.959 -14.604) 26.025 15.772 ( -0.953 2.051 2.252) 3.192 15.835 ( -0.339 -0.867 -1.117) 1.454 ======================= Grid point 310 (154/160) ======================= q-point: (-0.11 -0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.560 ( -5.239 -0.277 -2.442) 5.787 2.053 ( 6.884 -4.350 -1.639) 8.306 2.315 ( -4.913 3.439 1.762) 6.250 2.409 ( 2.257 5.060 -2.683) 6.156 2.434 ( 3.910 3.895 0.117) 5.520 2.799 ( 4.049 -1.134 6.565) 7.796 2.986 ( 3.279 2.438 2.431) 4.754 3.082 ( 5.317 0.382 4.434) 6.933 3.166 ( 2.035 -3.070 -0.394) 3.704 3.362 ( -1.291 -1.526 0.435) 2.046 3.424 ( -2.918 0.116 2.186) 3.648 3.612 ( 2.163 0.651 1.307) 2.610 3.798 ( -10.637 0.797 -1.648) 10.794 3.945 ( 0.827 0.123 10.056) 10.091 3.999 ( 0.053 -0.548 6.143) 6.168 4.125 ( 5.426 2.277 0.192) 5.888 4.171 ( 2.772 -3.314 -7.144) 8.349 4.498 ( -6.931 -4.412 6.727) 10.618 4.550 ( -0.617 0.195 -6.245) 6.278 4.626 ( 0.585 -1.668 -0.015) 1.767 4.728 ( -0.088 1.517 -0.739) 1.690 4.911 ( 1.743 0.897 -9.641) 9.839 5.408 ( 0.815 -0.763 -4.940) 5.064 5.498 ( 1.726 -0.231 -2.132) 2.753 5.976 ( -1.122 0.393 3.056) 3.279 6.025 ( -0.048 -0.394 1.854) 1.896 6.659 ( -2.348 0.921 2.197) 3.345 6.688 ( -0.667 1.280 1.581) 2.141 7.083 ( -1.768 1.030 8.515) 8.757 7.137 ( 1.117 -0.746 -3.286) 3.550 7.225 ( -6.402 -1.959 22.278) 23.262 7.824 ( 4.501 0.260 -34.196) 34.492 8.747 ( 1.901 0.021 3.707) 4.166 9.013 ( 0.688 1.588 1.932) 2.594 9.147 ( -2.228 -3.701 3.183) 5.366 9.243 ( 1.229 -1.044 -0.865) 1.830 9.374 ( 2.181 0.671 -0.637) 2.369 9.712 ( -0.919 2.037 -5.942) 6.349 10.037 ( 2.278 0.744 7.503) 7.876 10.118 ( -0.163 -2.815 -4.705) 5.485 10.729 ( -0.390 0.918 7.608) 7.673 10.765 ( 0.728 -2.751 -1.828) 3.383 11.150 ( 1.105 -1.129 1.996) 2.546 11.377 ( 1.550 2.372 -2.410) 3.719 11.678 ( 0.891 -0.208 1.168) 1.484 11.790 ( -0.254 -1.601 2.521) 2.998 12.403 ( 3.140 -2.319 -1.328) 4.124 12.489 ( -1.538 -0.447 -3.324) 3.690 13.079 ( -8.909 6.562 3.786) 11.695 13.272 ( -7.966 3.005 -2.323) 8.825 14.939 ( 0.926 -1.118 16.494) 16.558 15.182 ( 13.583 -2.664 -14.339) 19.930 15.727 ( -1.351 2.321 0.278) 2.700 15.852 ( 1.017 -0.269 -1.794) 2.079 ======================= Grid point 317 (155/160) ======================= q-point: (-0.33 -0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( -10.844 0.000 -6.387) 12.585 1.804 ( 10.009 -0.000 -3.779) 10.699 2.319 ( 13.845 -0.000 0.819) 13.870 2.442 ( 2.952 -0.000 4.478) 5.363 2.491 ( -2.270 0.000 -0.586) 2.345 2.780 ( 14.282 -0.000 7.369) 16.071 2.822 ( -0.176 0.000 9.038) 9.040 3.007 ( 7.469 -0.000 1.059) 7.543 3.171 ( -0.666 0.000 -4.414) 4.464 3.362 ( 0.525 -0.000 2.981) 3.027 3.435 ( -7.249 0.000 4.431) 8.497 3.530 ( 4.424 -0.000 -4.112) 6.040 3.845 ( 3.310 -0.000 2.304) 4.033 3.999 ( 4.748 -0.000 7.391) 8.784 4.039 ( -12.665 0.000 -3.837) 13.233 4.064 ( -0.404 0.000 -5.851) 5.865 4.181 ( -2.100 0.000 9.430) 9.661 4.476 ( 2.318 -0.000 7.372) 7.728 4.569 ( -0.832 0.000 -13.178) 13.204 4.583 ( -4.033 0.000 6.028) 7.253 4.766 ( -0.195 0.000 -0.767) 0.792 4.892 ( 2.349 -0.000 -10.631) 10.888 5.387 ( -2.180 0.000 -6.898) 7.234 5.457 ( 1.287 -0.000 0.945) 1.597 6.026 ( -1.899 0.000 5.715) 6.022 6.026 ( -1.368 0.000 1.568) 2.081 6.727 ( -2.794 0.000 4.230) 5.069 6.751 ( -3.508 0.000 -1.899) 3.989 7.096 ( 1.778 -0.000 -5.083) 5.385 7.122 ( 0.882 -0.000 0.541) 1.034 7.287 ( -8.179 0.000 30.121) 31.212 7.784 ( 0.353 -0.000 -33.791) 33.793 8.696 ( 3.358 -0.000 5.774) 6.680 9.030 ( 6.009 -0.000 -6.133) 8.586 9.074 ( 0.906 -0.000 6.192) 6.258 9.194 ( -0.422 0.000 1.994) 2.038 9.350 ( -0.666 0.000 -0.852) 1.082 9.769 ( 2.261 -0.000 -0.317) 2.283 10.018 ( -3.849 0.000 1.879) 4.283 10.076 ( -0.901 0.000 -3.282) 3.403 10.713 ( 0.341 -0.000 -1.841) 1.872 10.745 ( 1.301 -0.000 8.493) 8.592 11.111 ( 0.827 -0.000 3.008) 3.120 11.384 ( 2.466 -0.000 -3.105) 3.965 11.653 ( 2.772 -0.000 1.108) 2.985 11.714 ( 1.264 -0.000 1.478) 1.945 12.370 ( -2.784 0.000 -1.371) 3.104 12.508 ( -1.485 0.000 -3.152) 3.485 13.421 ( -12.490 0.000 12.323) 17.546 13.549 ( -13.786 0.000 -11.428) 17.907 14.788 ( 11.689 -0.000 12.859) 17.378 14.824 ( 21.997 -0.000 -12.810) 25.455 15.805 ( 1.374 -0.000 4.216) 4.434 15.814 ( -2.515 0.000 -3.527) 4.333 ======================= Grid point 318 (156/160) ======================= q-point: (-0.22 -0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.534 ( -11.865 -1.282 -4.669) 12.815 1.994 ( 10.171 -1.594 -4.349) 11.176 2.362 ( -9.874 1.571 3.454) 10.578 2.439 ( -2.850 0.046 2.075) 3.526 2.536 ( 10.001 3.402 -4.021) 11.303 2.776 ( -2.253 -0.945 4.493) 5.114 3.032 ( 2.750 2.391 2.662) 4.513 3.078 ( 9.234 -1.922 5.612) 10.975 3.165 ( 0.748 3.122 -1.059) 3.380 3.322 ( -1.505 -2.934 2.944) 4.421 3.421 ( 1.707 0.269 3.365) 3.783 3.611 ( 4.056 -0.731 -5.719) 7.049 3.806 ( -12.680 0.497 -0.189) 12.691 3.924 ( 4.836 -1.353 7.220) 8.794 4.035 ( 1.243 2.884 7.436) 8.072 4.103 ( 2.206 -3.169 -6.061) 7.186 4.188 ( 3.931 2.843 3.966) 6.266 4.415 ( -9.279 -3.054 13.065) 16.314 4.552 ( -0.275 -0.070 -14.477) 14.480 4.604 ( 3.412 -0.556 2.025) 4.007 4.752 ( -0.730 0.773 0.815) 1.340 4.914 ( 0.455 -0.205 -9.044) 9.058 5.394 ( 2.931 -0.424 -6.863) 7.475 5.495 ( 3.010 -0.064 -2.728) 4.063 5.986 ( -2.191 0.479 4.398) 4.937 6.015 ( -0.330 -0.475 1.470) 1.580 6.676 ( -2.826 0.637 2.865) 4.074 6.703 ( -1.725 0.260 -0.392) 1.787 7.117 ( -0.966 2.181 5.786) 6.258 7.126 ( 1.699 -0.218 -3.854) 4.218 7.182 ( -4.945 -2.414 25.470) 26.057 7.827 ( 5.419 0.063 -34.376) 34.801 8.758 ( 3.734 0.667 5.995) 7.095 9.049 ( -0.480 1.205 0.181) 1.309 9.090 ( -1.900 -1.290 4.733) 5.261 9.208 ( 2.697 -1.833 -1.949) 3.798 9.383 ( 2.085 0.222 -1.559) 2.613 9.729 ( -4.915 0.191 -7.119) 8.653 10.045 ( 5.095 0.077 8.563) 9.964 10.085 ( 1.429 -0.732 -4.882) 5.139 10.720 ( 0.138 -0.954 -1.883) 2.115 10.747 ( -0.970 0.178 9.214) 9.266 11.136 ( 1.339 -0.317 3.215) 3.497 11.419 ( 2.277 1.427 -3.593) 4.487 11.689 ( 1.661 1.536 1.301) 2.610 11.741 ( 0.379 -3.051 2.226) 3.795 12.371 ( 2.812 -0.772 -1.928) 3.496 12.481 ( -1.687 -0.238 -3.365) 3.772 13.190 ( -12.046 3.807 7.583) 14.734 13.309 ( -12.133 0.724 -6.432) 13.752 14.923 ( 2.433 -0.446 16.402) 16.587 15.143 ( 14.712 -1.182 -12.458) 19.314 15.769 ( -1.207 1.664 -2.723) 3.412 15.838 ( 1.396 -0.865 -0.871) 1.859 ======================= Grid point 319 (157/160) ======================= q-point: (-0.11 -0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.380 ( -10.132 -6.366 -1.863) 12.110 2.135 ( -1.050 -1.574 -0.136) 1.896 2.166 ( -6.804 -0.478 2.651) 7.318 2.352 ( -7.843 -0.327 -2.693) 8.299 2.515 ( -3.837 5.976 -3.067) 7.736 2.779 ( -6.028 -5.478 1.363) 8.258 2.935 ( -2.759 1.624 -3.548) 4.779 3.120 ( -7.036 -0.566 -1.772) 7.278 3.305 ( 12.175 1.768 5.502) 13.476 3.385 ( 5.681 -0.734 4.178) 7.090 3.435 ( 3.425 4.060 1.395) 5.492 3.660 ( -2.981 -0.614 4.718) 5.615 3.666 ( 1.897 -0.030 -3.314) 3.819 3.992 ( -1.957 2.652 12.136) 12.575 4.010 ( 3.017 1.467 7.657) 8.360 4.153 ( -0.702 -1.794 -4.729) 5.106 4.237 ( 1.754 -0.713 -1.346) 2.324 4.331 ( -2.129 -3.635 12.235) 12.940 4.566 ( 2.145 -0.548 -13.228) 13.412 4.636 ( 0.341 1.399 1.968) 2.438 4.743 ( 0.457 0.242 1.115) 1.229 4.908 ( -1.148 -0.095 -8.982) 9.056 5.475 ( 6.006 0.591 -5.346) 8.062 5.555 ( 4.537 0.925 -5.755) 7.386 5.951 ( -1.773 -0.309 3.466) 3.906 6.027 ( 0.816 -0.879 0.448) 1.281 6.633 ( -1.389 0.275 3.149) 3.453 6.690 ( 0.252 -0.167 0.331) 0.448 7.079 ( 0.322 2.167 15.586) 15.739 7.154 ( 0.928 -0.567 -5.267) 5.378 7.166 ( 0.207 -0.128 16.434) 16.435 7.942 ( 9.065 1.072 -32.793) 34.040 8.795 ( 2.219 2.244 4.225) 5.274 9.028 ( -1.297 1.104 2.247) 2.819 9.086 ( -0.257 -3.471 5.404) 6.428 9.257 ( 1.165 -0.004 -2.299) 2.577 9.377 ( -2.317 0.692 -1.196) 2.698 9.661 ( -3.620 -2.454 -8.667) 9.708 10.126 ( 4.915 2.817 8.462) 10.183 10.134 ( 3.809 -0.129 -4.554) 5.939 10.717 ( -1.993 0.640 8.809) 9.054 10.747 ( 0.778 -3.500 -2.780) 4.537 11.145 ( -0.991 -0.399 3.287) 3.456 11.418 ( -0.243 2.925 -4.049) 5.001 11.682 ( -0.766 0.699 3.008) 3.182 11.785 ( 1.972 -1.946 1.335) 3.076 12.461 ( 3.026 -0.455 -1.265) 3.311 12.471 ( 3.159 -1.078 -3.299) 4.693 12.982 ( -7.606 2.616 3.440) 8.748 13.171 ( -3.934 -2.163 -2.200) 5.000 14.858 ( -10.706 0.268 17.502) 20.518 15.328 ( 5.959 -0.855 -12.654) 14.013 15.740 ( 0.047 2.742 -1.837) 3.300 15.856 ( -0.304 -0.709 -4.050) 4.123 ======================= Grid point 327 (158/160) ======================= q-point: (-0.22 -0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.311 ( -12.268 0.000 -2.988) 12.627 2.115 ( -6.253 0.000 1.588) 6.451 2.166 ( -1.719 0.000 -0.944) 1.961 2.342 ( -8.576 0.000 -2.251) 8.867 2.608 ( -6.853 0.000 0.508) 6.872 2.696 ( -5.305 0.000 -0.597) 5.339 2.960 ( -3.876 0.000 -7.010) 8.010 3.104 ( -8.041 0.000 -0.381) 8.050 3.343 ( 13.991 -0.000 7.174) 15.724 3.357 ( 6.787 -0.000 5.652) 8.832 3.493 ( 5.791 -0.000 -0.083) 5.791 3.633 ( -2.638 0.000 2.277) 3.485 3.677 ( -0.562 0.000 -4.848) 4.881 4.000 ( 2.331 -0.000 13.725) 13.922 4.050 ( -1.537 0.000 9.332) 9.458 4.125 ( 1.739 -0.000 -7.553) 7.750 4.231 ( -7.014 0.000 14.340) 15.963 4.294 ( 6.081 -0.000 3.005) 6.783 4.559 ( 1.953 -0.000 -15.062) 15.188 4.650 ( 1.240 -0.000 0.286) 1.272 4.745 ( -0.535 0.000 3.165) 3.210 4.906 ( -0.603 0.000 -9.758) 9.777 5.479 ( 6.395 -0.000 -5.212) 8.250 5.565 ( 5.145 -0.000 -6.516) 8.302 5.949 ( -2.263 0.000 3.921) 4.527 6.018 ( 0.599 -0.000 0.529) 0.799 6.637 ( -1.892 0.000 3.325) 3.826 6.687 ( -0.174 0.000 0.055) 0.182 7.109 ( -0.185 0.000 14.053) 14.054 7.141 ( 0.196 -0.000 1.202) 1.218 7.165 ( 2.854 -0.000 10.500) 10.881 7.953 ( 9.748 -0.000 -32.725) 34.146 8.829 ( 3.329 -0.000 7.102) 7.843 9.002 ( -2.205 0.000 0.252) 2.220 9.084 ( -0.751 0.000 6.243) 6.288 9.253 ( 2.951 -0.000 -3.965) 4.943 9.384 ( -2.075 0.000 -1.944) 2.843 9.630 ( -5.235 0.000 -8.688) 10.144 10.134 ( 4.535 -0.000 -5.608) 7.212 10.155 ( 6.701 -0.000 10.107) 12.127 10.709 ( -0.504 0.000 -2.482) 2.532 10.723 ( -1.971 0.000 9.440) 9.643 11.142 ( -0.880 0.000 4.057) 4.152 11.451 ( -0.004 0.000 -5.178) 5.178 11.696 ( -1.324 0.000 4.118) 4.326 11.755 ( 3.145 -0.000 0.503) 3.185 12.452 ( 6.968 -0.000 -3.439) 7.771 12.460 ( -0.045 0.000 -1.457) 1.458 13.023 ( -9.742 0.000 5.585) 11.229 13.143 ( -6.674 0.000 -4.347) 7.965 14.861 ( -10.321 0.000 17.860) 20.628 15.319 ( 6.875 -0.000 -11.172) 13.118 15.774 ( 0.854 -0.000 -3.534) 3.636 15.843 ( -0.787 0.000 -4.694) 4.759 ======================= Grid point 328 (159/160) ======================= q-point: (-0.11 -0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( -8.181 -5.207 0.169) 9.699 1.873 ( -15.981 -2.495 10.735) 19.413 2.155 ( -12.431 0.038 -2.491) 12.678 2.234 ( 1.118 1.536 -6.232) 6.515 2.395 ( -12.305 -0.559 -1.850) 12.456 2.598 ( -8.460 -2.557 -4.065) 9.728 2.892 ( -11.108 0.479 -1.927) 11.284 2.911 ( -7.198 -0.190 -8.470) 11.117 3.477 ( 4.761 0.043 9.867) 10.955 3.543 ( 10.243 2.771 2.631) 10.933 3.588 ( 6.253 2.848 3.307) 7.625 3.648 ( 4.405 -1.995 1.880) 5.188 3.678 ( 0.125 0.289 -2.713) 2.731 3.899 ( -11.298 -2.400 17.777) 21.200 4.020 ( -0.302 2.063 3.205) 3.823 4.196 ( 6.849 1.109 9.439) 11.714 4.221 ( 1.132 -1.044 -5.036) 5.267 4.384 ( 4.185 0.395 1.867) 4.600 4.606 ( 2.524 1.277 -6.777) 7.344 4.656 ( 1.454 -0.565 -3.567) 3.893 4.742 ( -0.381 -0.804 4.191) 4.284 4.886 ( -1.677 0.495 -10.072) 10.222 5.577 ( 4.890 0.325 -1.711) 5.190 5.654 ( 5.688 1.011 -9.355) 10.995 5.919 ( -1.506 -0.507 3.475) 3.821 6.025 ( -0.379 -0.721 0.257) 0.854 6.629 ( 0.999 -0.107 3.153) 3.309 6.697 ( 0.954 -0.514 0.403) 1.156 7.122 ( 1.175 1.241 -0.430) 1.762 7.147 ( 0.077 -0.822 -1.100) 1.375 7.267 ( 10.699 1.601 23.178) 25.578 8.120 ( 10.675 1.347 -28.545) 30.506 8.854 ( 1.213 2.296 5.506) 6.088 8.995 ( -1.227 -1.318 -0.572) 1.890 9.061 ( -1.573 -0.475 6.127) 6.344 9.286 ( 1.295 0.807 -2.482) 2.913 9.328 ( -3.060 0.468 -1.880) 3.622 9.578 ( -2.090 -2.419 -8.472) 9.055 10.224 ( 6.316 0.580 -4.883) 8.005 10.247 ( 5.265 3.408 10.292) 12.053 10.688 ( -1.734 0.601 7.268) 7.496 10.723 ( 0.579 -3.579 -1.977) 4.129 11.108 ( -2.838 -0.281 3.809) 4.758 11.401 ( -4.691 1.515 -5.700) 7.536 11.690 ( 1.550 1.208 5.586) 5.921 11.833 ( 5.734 -1.196 0.494) 5.878 12.491 ( 3.421 0.015 1.313) 3.664 12.582 ( 7.558 0.402 -4.475) 8.793 12.883 ( -5.647 0.358 2.787) 6.308 13.109 ( 0.789 -4.342 -2.277) 4.966 14.585 ( -22.196 0.112 17.600) 28.327 15.344 ( -4.877 0.629 -16.564) 17.278 15.774 ( 0.257 3.078 -1.961) 3.658 15.827 ( -0.723 -2.064 -3.549) 4.169 ======================= Grid point 337 (160/160) ======================= q-point: (-0.11 -0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.64e-04 1.64e-04 1.64e-04 1.64e-04 3.43e-04 3.43e-04 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.050 ( -0.481 0.000 3.568) 3.600 1.601 ( -14.372 0.000 13.487) 19.709 1.906 ( -15.430 0.000 4.962) 16.208 2.174 ( -9.729 0.000 -2.831) 10.132 2.250 ( -3.479 0.000 -15.989) 16.363 2.428 ( -10.365 0.000 -2.506) 10.663 2.667 ( -9.914 0.000 -1.693) 10.057 2.841 ( -4.481 0.000 -7.940) 9.117 3.500 ( -3.694 0.000 19.697) 20.041 3.606 ( -1.725 0.000 12.324) 12.444 3.629 ( 1.654 -0.000 -5.076) 5.339 3.694 ( -6.986 0.000 16.529) 17.945 3.766 ( 7.069 -0.000 -9.352) 11.723 3.796 ( 7.100 -0.000 -4.279) 8.290 4.063 ( 4.225 -0.000 3.488) 5.479 4.244 ( 2.556 -0.000 -7.024) 7.474 4.336 ( 7.671 -0.000 10.336) 12.872 4.444 ( 2.671 -0.000 0.670) 2.753 4.654 ( 0.598 -0.000 -3.398) 3.450 4.673 ( 1.407 -0.000 -2.439) 2.815 4.725 ( -0.293 0.000 4.755) 4.764 4.843 ( -3.566 0.000 -10.125) 10.735 5.635 ( 1.662 -0.000 2.661) 3.137 5.746 ( 4.579 -0.000 -11.410) 12.295 5.895 ( -0.974 0.000 3.834) 3.956 6.002 ( -1.648 0.000 -0.069) 1.650 6.663 ( 2.573 -0.000 2.067) 3.300 6.713 ( 1.202 -0.000 0.485) 1.297 7.137 ( -0.332 0.000 -0.360) 0.490 7.144 ( 0.617 -0.000 -5.601) 5.635 7.543 ( 18.845 -0.000 21.326) 28.459 8.290 ( 8.429 -0.000 -22.904) 24.406 8.857 ( -1.931 0.000 6.517) 6.797 8.969 ( -2.110 0.000 -4.451) 4.926 9.027 ( -1.780 0.000 4.976) 5.284 9.248 ( -4.155 0.000 -3.196) 5.242 9.361 ( 5.073 -0.000 -1.272) 5.230 9.553 ( 0.164 -0.000 -5.521) 5.524 10.342 ( 6.720 -0.000 -3.936) 7.788 10.342 ( 2.597 -0.000 11.395) 11.687 10.704 ( 1.085 -0.000 -1.460) 1.819 10.705 ( 2.364 -0.000 3.918) 4.577 11.065 ( -1.441 0.000 3.204) 3.513 11.300 ( -7.020 0.000 -5.222) 8.749 11.788 ( 9.716 -0.000 6.642) 11.769 11.956 ( 9.261 -0.000 2.016) 9.478 12.573 ( 5.409 -0.000 3.221) 6.295 12.702 ( 5.441 -0.000 -4.844) 7.285 12.814 ( -2.078 0.000 1.523) 2.577 13.141 ( 6.889 -0.000 -1.830) 7.128 14.130 ( -31.226 0.000 15.068) 34.671 15.117 ( -22.722 0.000 -22.997) 32.329 15.788 ( 0.165 -0.000 2.863) 2.868 15.830 ( 1.910 -0.000 -3.479) 3.968 =================== 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 3/30618 10.0 255.747 239.446 199.158 0.000 -20.512 -0.000 3/30618 20.0 51.787 41.969 36.601 0.000 -3.627 -0.000 3/30618 30.0 20.099 14.941 14.164 0.000 -1.299 -0.000 3/30618 40.0 11.004 7.738 7.955 0.000 -0.640 -0.000 3/30618 50.0 7.276 4.962 5.463 0.000 -0.393 -0.000 3/30618 60.0 5.371 3.602 4.204 0.000 -0.278 -0.000 3/30618 70.0 4.249 2.820 3.463 0.000 -0.216 -0.000 3/30618 80.0 3.522 2.320 2.980 0.000 -0.178 -0.000 3/30618 90.0 3.018 1.975 2.639 0.000 -0.152 -0.000 3/30618 100.0 2.652 1.724 2.384 0.000 -0.133 -0.000 3/30618 110.0 2.375 1.533 2.184 0.000 -0.119 -0.000 3/30618 120.0 2.161 1.384 2.023 0.000 -0.108 -0.000 3/30618 130.0 1.989 1.263 1.889 0.000 -0.099 -0.000 3/30618 140.0 1.849 1.164 1.775 0.000 -0.092 -0.000 3/30618 150.0 1.732 1.081 1.676 0.000 -0.086 -0.000 3/30618 160.0 1.633 1.011 1.590 0.000 -0.081 -0.000 3/30618 170.0 1.548 0.949 1.514 0.000 -0.076 -0.000 3/30618 180.0 1.473 0.896 1.445 0.000 -0.072 -0.000 3/30618 190.0 1.407 0.849 1.383 0.000 -0.068 -0.000 3/30618 200.0 1.348 0.807 1.326 0.000 -0.065 -0.000 3/30618 210.0 1.294 0.769 1.275 0.000 -0.062 -0.000 3/30618 220.0 1.245 0.735 1.227 0.000 -0.060 -0.000 3/30618 230.0 1.200 0.704 1.183 0.000 -0.057 -0.000 3/30618 240.0 1.158 0.676 1.142 0.000 -0.055 -0.000 3/30618 250.0 1.120 0.650 1.103 0.000 -0.053 -0.000 3/30618 260.0 1.084 0.626 1.068 0.000 -0.051 -0.000 3/30618 270.0 1.050 0.603 1.034 0.000 -0.050 -0.000 3/30618 280.0 1.019 0.583 1.003 0.000 -0.048 -0.000 3/30618 290.0 0.989 0.563 0.973 0.000 -0.047 -0.000 3/30618 300.0 0.961 0.545 0.945 0.000 -0.045 -0.000 3/30618 310.0 0.935 0.529 0.918 0.000 -0.044 -0.000 3/30618 320.0 0.910 0.513 0.893 0.000 -0.043 -0.000 3/30618 330.0 0.886 0.498 0.870 0.000 -0.042 -0.000 3/30618 340.0 0.864 0.484 0.847 0.000 -0.040 -0.000 3/30618 350.0 0.842 0.470 0.826 0.000 -0.039 -0.000 3/30618 360.0 0.822 0.458 0.805 0.000 -0.038 -0.000 3/30618 370.0 0.802 0.446 0.786 0.000 -0.037 -0.000 3/30618 380.0 0.783 0.435 0.767 0.000 -0.037 -0.000 3/30618 390.0 0.766 0.424 0.749 0.000 -0.036 -0.000 3/30618 400.0 0.749 0.414 0.732 0.000 -0.035 -0.000 3/30618 410.0 0.732 0.404 0.716 0.000 -0.034 -0.000 3/30618 420.0 0.717 0.395 0.701 0.000 -0.033 -0.000 3/30618 430.0 0.702 0.386 0.686 0.000 -0.033 -0.000 3/30618 440.0 0.687 0.377 0.671 0.000 -0.032 -0.000 3/30618 450.0 0.673 0.369 0.658 0.000 -0.031 -0.000 3/30618 460.0 0.660 0.361 0.644 0.000 -0.031 -0.000 3/30618 470.0 0.647 0.354 0.632 0.000 -0.030 -0.000 3/30618 480.0 0.635 0.347 0.619 0.000 -0.029 -0.000 3/30618 490.0 0.623 0.340 0.608 0.000 -0.029 -0.000 3/30618 500.0 0.612 0.333 0.596 0.000 -0.028 -0.000 3/30618 510.0 0.601 0.327 0.585 0.000 -0.028 -0.000 3/30618 520.0 0.590 0.321 0.575 0.000 -0.027 -0.000 3/30618 530.0 0.579 0.315 0.565 0.000 -0.027 -0.000 3/30618 540.0 0.570 0.309 0.555 0.000 -0.026 -0.000 3/30618 550.0 0.560 0.304 0.545 0.000 -0.026 -0.000 3/30618 560.0 0.551 0.298 0.536 0.000 -0.025 -0.000 3/30618 570.0 0.541 0.293 0.527 0.000 -0.025 -0.000 3/30618 580.0 0.533 0.288 0.518 0.000 -0.025 -0.000 3/30618 590.0 0.524 0.283 0.510 0.000 -0.024 -0.000 3/30618 600.0 0.516 0.279 0.502 0.000 -0.024 -0.000 3/30618 610.0 0.508 0.274 0.494 0.000 -0.023 -0.000 3/30618 620.0 0.500 0.270 0.487 0.000 -0.023 -0.000 3/30618 630.0 0.493 0.266 0.479 0.000 -0.023 -0.000 3/30618 640.0 0.485 0.262 0.472 0.000 -0.022 -0.000 3/30618 650.0 0.478 0.258 0.465 0.000 -0.022 -0.000 3/30618 660.0 0.471 0.254 0.458 0.000 -0.022 -0.000 3/30618 670.0 0.465 0.250 0.452 0.000 -0.021 -0.000 3/30618 680.0 0.458 0.247 0.445 0.000 -0.021 -0.000 3/30618 690.0 0.452 0.243 0.439 0.000 -0.021 -0.000 3/30618 700.0 0.446 0.240 0.433 0.000 -0.021 -0.000 3/30618 710.0 0.440 0.236 0.427 0.000 -0.020 -0.000 3/30618 720.0 0.434 0.233 0.422 0.000 -0.020 -0.000 3/30618 730.0 0.428 0.230 0.416 0.000 -0.020 -0.000 3/30618 740.0 0.423 0.227 0.411 0.000 -0.019 -0.000 3/30618 750.0 0.417 0.224 0.405 0.000 -0.019 -0.000 3/30618 760.0 0.412 0.221 0.400 0.000 -0.019 -0.000 3/30618 770.0 0.407 0.218 0.395 0.000 -0.019 -0.000 3/30618 780.0 0.402 0.215 0.390 0.000 -0.018 -0.000 3/30618 790.0 0.397 0.213 0.385 0.000 -0.018 -0.000 3/30618 800.0 0.392 0.210 0.381 0.000 -0.018 -0.000 3/30618 810.0 0.387 0.208 0.376 0.000 -0.018 -0.000 3/30618 820.0 0.383 0.205 0.372 0.000 -0.018 -0.000 3/30618 830.0 0.378 0.203 0.367 0.000 -0.017 -0.000 3/30618 840.0 0.374 0.200 0.363 0.000 -0.017 -0.000 3/30618 850.0 0.370 0.198 0.359 0.000 -0.017 -0.000 3/30618 860.0 0.366 0.196 0.355 0.000 -0.017 -0.000 3/30618 870.0 0.362 0.193 0.351 0.000 -0.017 -0.000 3/30618 880.0 0.358 0.191 0.347 0.000 -0.016 -0.000 3/30618 890.0 0.354 0.189 0.343 0.000 -0.016 -0.000 3/30618 900.0 0.350 0.187 0.339 0.000 -0.016 -0.000 3/30618 910.0 0.346 0.185 0.336 0.000 -0.016 -0.000 3/30618 920.0 0.342 0.183 0.332 0.000 -0.016 -0.000 3/30618 930.0 0.339 0.181 0.329 0.000 -0.016 -0.000 3/30618 940.0 0.335 0.179 0.325 0.000 -0.015 -0.000 3/30618 950.0 0.332 0.177 0.322 0.000 -0.015 -0.000 3/30618 960.0 0.329 0.175 0.319 0.000 -0.015 -0.000 3/30618 970.0 0.325 0.174 0.315 0.000 -0.015 -0.000 3/30618 980.0 0.322 0.172 0.312 0.000 -0.015 -0.000 3/30618 990.0 0.319 0.170 0.309 0.000 -0.015 -0.000 3/30618 1000.0 0.316 0.168 0.306 0.000 -0.015 -0.000 3/30618 Thermal conductivity related properties were written into "kappa-m997.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 20:53:00]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|