element(s): ['O', 'Si'] AFLOW prototype label: A2B_hR72_148_8f_4f Parameter names: ['a', 'c/a', 'x1', 'y1', 'z1', 'x2', 'y2', 'z2', 'x3', 'y3', 'z3', 'x4', 'y4', 'z4', 'x5', 'y5', 'z5', 'x6', 'y6', 'z6', 'x7', 'y7', 'z7', 'x8', 'y8', 'z8', 'x9', 'y9', 'z9', 'x10', 'y10', 'z10', 'x11', 'y11', 'z11', 'x12', 'y12', 'z12'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['13.794229', '1.434787', '0.85893138', '0.22979394', '0.11991875', '0.75467824', '0.29022042', '0.40040932', '0.73596048', '0.94768126', '0.89719171', '0.75960952', '0.041023857', '0.33359589', '0.84471815', '0.51843482', '0.43865797', '0.70571111', '0.44872596', '0.061254388', '0.98092357', '0.34918425', '0.28372019', '0.61326156', '0.24118526', '0.21965969', '0.99737508', '0.23783748', '0.17967101', '0.67143124', '0.18054872', '0.35784479', '0.88150258', '0.36337612', '0.41793163', '0.71060037', '0.28965427', '0.090649953'] model name: Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 ==== Building ASE atoms object with: ==== representative atom symbols = ['O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'Si', 'Si', 'Si', 'Si'] representative atom coordinates = [[0.45605002 0.28296261 0.40288136] [0.27290891 0.08136001 0.48176933] [0.87568266 0.96308611 0.86027782] [0.3815331 0.04448053 0.37807642] [0.2441145 0.16194568 0.60060365] [0.30048062 0.3439761 0.40523049] [0.4429809 0.25422248 0.53794267] [0.25522606 0.13837581 0.3580355 ] [0.52574722 0.29195685 0.47162786] [0.26815632 0.04543013 0.40327492] [0.32723247 0.13633848 0.55427011] [0.34696551 0.27298491 0.36363486]] spacegroup = 148 cell = [[13.7942, 0, 0], [-6.8971, 11.946127624883, 0], [0, 0, 19.7918]] ========================================= Step Time Energy fmax BFGS: 0 19:30:32 -1396.787505 3.7347 BFGS: 1 19:30:32 -1407.245618 2.2817 BFGS: 2 19:30:32 -1412.770795 1.3659 BFGS: 3 19:30:32 -1415.774081 0.9786 BFGS: 4 19:30:32 -1416.897327 0.9940 BFGS: 5 19:30:32 -1418.283768 0.9352 BFGS: 6 19:30:33 -1419.369462 0.8530 BFGS: 7 19:30:33 -1420.232007 0.7614 BFGS: 8 19:30:33 -1420.821362 0.6647 BFGS: 9 19:30:33 -1421.150974 0.5887 BFGS: 10 19:30:33 -1421.367134 0.5557 BFGS: 11 19:30:33 -1421.645121 0.5352 BFGS: 12 19:30:33 -1421.833617 0.5261 BFGS: 13 19:30:33 -1421.952924 0.5314 BFGS: 14 19:30:33 -1422.035665 0.5338 BFGS: 15 19:30:33 -1422.124390 0.5362 BFGS: 16 19:30:33 -1422.210721 0.5322 BFGS: 17 19:30:33 -1422.294862 0.5269 BFGS: 18 19:30:33 -1422.375325 0.5203 BFGS: 19 19:30:33 -1422.451206 0.5134 BFGS: 20 19:30:34 -1422.522125 0.5063 BFGS: 21 19:30:34 -1422.588285 0.4994 BFGS: 22 19:30:34 -1422.650139 0.4927 BFGS: 23 19:30:34 -1422.708394 0.4862 BFGS: 24 19:30:34 -1422.763809 0.4799 BFGS: 25 19:30:34 -1422.817151 0.4738 BFGS: 26 19:30:34 -1422.869085 0.4679 BFGS: 27 19:30:34 -1422.920166 0.4622 BFGS: 28 19:30:34 -1422.970808 0.4567 BFGS: 29 19:30:34 -1423.021314 0.4513 BFGS: 30 19:30:34 -1423.071886 0.4460 BFGS: 31 19:30:34 -1423.122657 0.4409 BFGS: 32 19:30:34 -1423.173703 0.4358 BFGS: 33 19:30:34 -1423.225064 0.4309 BFGS: 34 19:30:35 -1423.276754 0.4260 BFGS: 35 19:30:35 -1423.328773 0.4213 BFGS: 36 19:30:35 -1423.381107 0.4166 BFGS: 37 19:30:35 -1423.433737 0.4120 BFGS: 38 19:30:35 -1423.486641 0.4074 BFGS: 39 19:30:35 -1423.539793 0.4029 BFGS: 40 19:30:35 -1423.593169 0.3984 BFGS: 41 19:30:35 -1423.646744 0.3940 BFGS: 42 19:30:35 -1423.700494 0.3897 BFGS: 43 19:30:35 -1423.754395 0.3854 BFGS: 44 19:30:35 -1423.808425 0.3811 BFGS: 45 19:30:35 -1423.862563 0.3769 BFGS: 46 19:30:35 -1423.916789 0.3727 BFGS: 47 19:30:35 -1423.971085 0.3686 BFGS: 48 19:30:36 -1424.025432 0.3644 BFGS: 49 19:30:36 -1424.079813 0.3604 BFGS: 50 19:30:36 -1424.134211 0.3563 BFGS: 51 19:30:36 -1424.188611 0.3523 BFGS: 52 19:30:36 -1424.242998 0.3483 BFGS: 53 19:30:36 -1424.297358 0.3444 BFGS: 54 19:30:36 -1424.351675 0.3405 BFGS: 55 19:30:36 -1424.405937 0.3366 BFGS: 56 19:30:36 -1424.460130 0.3327 BFGS: 57 19:30:36 -1424.514241 0.3289 BFGS: 58 19:30:36 -1424.568256 0.3251 BFGS: 59 19:30:36 -1424.622162 0.3213 BFGS: 60 19:30:36 -1424.675948 0.3176 BFGS: 61 19:30:37 -1424.729601 0.3139 BFGS: 62 19:30:37 -1424.783107 0.3102 BFGS: 63 19:30:37 -1424.836456 0.3065 BFGS: 64 19:30:37 -1424.889633 0.3028 BFGS: 65 19:30:37 -1424.942627 0.2992 BFGS: 66 19:30:37 -1424.995425 0.2956 BFGS: 67 19:30:37 -1425.048016 0.2920 BFGS: 68 19:30:37 -1425.100386 0.2884 BFGS: 69 19:30:37 -1425.152523 0.2849 BFGS: 70 19:30:37 -1425.204416 0.2813 BFGS: 71 19:30:37 -1425.256051 0.2778 BFGS: 72 19:30:37 -1425.307416 0.2743 BFGS: 73 19:30:37 -1425.358498 0.2709 BFGS: 74 19:30:37 -1425.409286 0.2674 BFGS: 75 19:30:38 -1425.459767 0.2640 BFGS: 76 19:30:38 -1425.509929 0.2605 BFGS: 77 19:30:38 -1425.559758 0.2571 BFGS: 78 19:30:38 -1425.609244 0.2538 BFGS: 79 19:30:38 -1425.658372 0.2504 BFGS: 80 19:30:38 -1425.707132 0.2470 BFGS: 81 19:30:38 -1425.755511 0.2437 BFGS: 82 19:30:38 -1425.803497 0.2404 BFGS: 83 19:30:38 -1425.851077 0.2371 BFGS: 84 19:30:38 -1425.898240 0.2338 BFGS: 85 19:30:38 -1425.944973 0.2305 BFGS: 86 19:30:38 -1425.991265 0.2273 BFGS: 87 19:30:38 -1426.037104 0.2240 BFGS: 88 19:30:39 -1426.082479 0.2208 BFGS: 89 19:30:39 -1426.127376 0.2176 BFGS: 90 19:30:39 -1426.171787 0.2144 BFGS: 91 19:30:39 -1426.215698 0.2112 BFGS: 92 19:30:39 -1426.259099 0.2080 BFGS: 93 19:30:39 -1426.301979 0.2049 BFGS: 94 19:30:39 -1426.344327 0.2017 BFGS: 95 19:30:39 -1426.386132 0.1986 BFGS: 96 19:30:39 -1426.427385 0.1955 BFGS: 97 19:30:39 -1426.468074 0.1924 BFGS: 98 19:30:39 -1426.508190 0.1893 BFGS: 99 19:30:39 -1426.547723 0.1862 BFGS: 100 19:30:39 -1426.586663 0.1833 BFGS: 101 19:30:40 -1426.625001 0.1809 BFGS: 102 19:30:40 -1426.662728 0.1785 BFGS: 103 19:30:40 -1426.699836 0.1760 BFGS: 104 19:30:40 -1426.736316 0.1736 BFGS: 105 19:30:40 -1426.772159 0.1712 BFGS: 106 19:30:40 -1426.807359 0.1687 BFGS: 107 19:30:40 -1426.841910 0.1663 BFGS: 108 19:30:40 -1426.875805 0.1639 BFGS: 109 19:30:40 -1426.909043 0.1615 BFGS: 110 19:30:40 -1426.941619 0.1590 BFGS: 111 19:30:40 -1426.973515 0.1566 BFGS: 112 19:30:40 -1427.004714 0.1541 BFGS: 113 19:30:40 -1427.035202 0.1517 BFGS: 114 19:30:41 -1427.064973 0.1492 BFGS: 115 19:30:41 -1427.094020 0.1467 BFGS: 116 19:30:41 -1427.122339 0.1442 BFGS: 117 19:30:41 -1427.149923 0.1417 BFGS: 118 19:30:41 -1427.176770 0.1391 BFGS: 119 19:30:41 -1427.202874 0.1366 BFGS: 120 19:30:41 -1427.228234 0.1341 BFGS: 121 19:30:41 -1427.252846 0.1315 BFGS: 122 19:30:41 -1427.276707 0.1290 BFGS: 123 19:30:41 -1427.299816 0.1264 BFGS: 124 19:30:41 -1427.322170 0.1238 BFGS: 125 19:30:41 -1427.343770 0.1213 BFGS: 126 19:30:42 -1427.364614 0.1187 BFGS: 127 19:30:42 -1427.384702 0.1161 BFGS: 128 19:30:42 -1427.404035 0.1135 BFGS: 129 19:30:42 -1427.422615 0.1109 BFGS: 130 19:30:42 -1427.440444 0.1083 BFGS: 131 19:30:42 -1427.457525 0.1057 BFGS: 132 19:30:42 -1427.473863 0.1031 BFGS: 133 19:30:42 -1427.489463 0.1005 BFGS: 134 19:30:42 -1427.504331 0.0979 BFGS: 135 19:30:42 -1427.518475 0.0953 BFGS: 136 19:30:42 -1427.531906 0.0927 BFGS: 137 19:30:42 -1427.544635 0.0901 BFGS: 138 19:30:42 -1427.556676 0.0875 BFGS: 139 19:30:43 -1427.568047 0.0848 BFGS: 140 19:30:43 -1427.578768 0.0822 BFGS: 141 19:30:43 -1427.588864 0.0796 BFGS: 142 19:30:43 -1427.598364 0.0769 BFGS: 143 19:30:43 -1427.607304 0.0743 BFGS: 144 19:30:43 -1427.615728 0.0716 BFGS: 145 19:30:43 -1427.623689 0.0690 BFGS: 146 19:30:43 -1427.631251 0.0664 BFGS: 147 19:30:43 -1427.638496 0.0637 BFGS: 148 19:30:43 -1427.645522 0.0610 BFGS: 149 19:30:43 -1427.652452 0.0584 BFGS: 150 19:30:43 -1427.659438 0.0557 BFGS: 151 19:30:43 -1427.666667 0.0533 BFGS: 152 19:30:44 -1427.674370 0.0555 BFGS: 153 19:30:44 -1427.682833 0.0576 BFGS: 154 19:30:44 -1427.692420 0.0594 BFGS: 155 19:30:44 -1427.703618 0.0609 BFGS: 156 19:30:44 -1427.717131 0.0620 BFGS: 157 19:30:44 -1427.734125 0.0637 BFGS: 158 19:30:44 -1427.757021 0.0712 BFGS: 159 19:30:44 -1427.791025 0.0814 BFGS: 160 19:30:44 -1427.814997 0.0831 BFGS: 161 19:30:44 -1427.827329 0.0796 BFGS: 162 19:30:44 -1427.837370 0.0746 BFGS: 163 19:30:44 -1427.846303 0.0688 BFGS: 164 19:30:45 -1427.854384 0.0623 BFGS: 165 19:30:45 -1427.861724 0.0551 BFGS: 166 19:30:45 -1427.868448 0.0469 BFGS: 167 19:30:45 -1427.874832 0.0449 BFGS: 168 19:30:45 -1427.881727 0.0461 BFGS: 169 19:30:45 -1427.889257 0.0476 BFGS: 170 19:30:45 -1427.904259 0.0471 BFGS: 171 19:30:45 -1427.914352 0.0528 BFGS: 172 19:30:45 -1427.923012 0.0556 BFGS: 173 19:30:45 -1427.931065 0.0571 BFGS: 174 19:30:45 -1427.938694 0.0578 BFGS: 175 19:30:45 -1427.945956 0.0579 BFGS: 176 19:30:45 -1427.952878 0.0578 BFGS: 177 19:30:46 -1427.959476 0.0574 BFGS: 178 19:30:46 -1427.965764 0.0569 BFGS: 179 19:30:46 -1427.971754 0.0562 BFGS: 180 19:30:46 -1427.977464 0.0553 BFGS: 181 19:30:46 -1427.982908 0.0543 BFGS: 182 19:30:46 -1427.988108 0.0531 BFGS: 183 19:30:46 -1427.993085 0.0518 BFGS: 184 19:30:46 -1427.997868 0.0503 BFGS: 185 19:30:46 -1428.002491 0.0485 BFGS: 186 19:30:46 -1428.006994 0.0466 BFGS: 187 19:30:46 -1428.011434 0.0443 BFGS: 188 19:30:46 -1428.015881 0.0417 BFGS: 189 19:30:47 -1428.020439 0.0387 BFGS: 190 19:30:47 -1428.025263 0.0350 BFGS: 191 19:30:47 -1428.030628 0.0330 BFGS: 192 19:30:47 -1428.037133 0.0338 BFGS: 193 19:30:47 -1428.045094 0.0322 BFGS: 194 19:30:47 -1428.051138 0.0278 BFGS: 195 19:30:47 -1428.055099 0.0264 BFGS: 196 19:30:47 -1428.058107 0.0290 BFGS: 197 19:30:47 -1428.060478 0.0313 BFGS: 198 19:30:47 -1428.062268 0.0334 BFGS: 199 19:30:47 -1428.063492 0.0354 BFGS: 200 19:30:47 -1428.064190 0.0370 BFGS: 201 19:30:47 -1428.064548 0.0372 BFGS: 202 19:30:48 -1428.065906 0.0361 BFGS: 203 19:30:48 -1428.066899 0.0339 BFGS: 204 19:30:48 -1428.067522 0.0316 BFGS: 205 19:30:48 -1428.067777 0.0307 BFGS: 206 19:30:48 -1428.068051 0.0305 BFGS: 207 19:30:48 -1428.068468 0.0309 BFGS: 208 19:30:48 -1428.068955 0.0321 BFGS: 209 19:30:48 -1428.069329 0.0334 BFGS: 210 19:30:48 -1428.069582 0.0342 BFGS: 211 19:30:48 -1428.069852 0.0346 BFGS: 212 19:30:48 -1428.070268 0.0347 BFGS: 213 19:30:48 -1428.070827 0.0342 BFGS: 214 19:30:49 -1428.071373 0.0336 BFGS: 215 19:30:49 -1428.071762 0.0331 BFGS: 216 19:30:49 -1428.072042 0.0334 BFGS: 217 19:30:49 -1428.072311 0.0337 BFGS: 218 19:30:49 -1428.072606 0.0345 BFGS: 219 19:30:49 -1428.072936 0.0350 BFGS: 220 19:30:49 -1428.073340 0.0350 BFGS: 221 19:30:49 -1428.073867 0.0337 BFGS: 222 19:30:49 -1428.074495 0.0311 BFGS: 223 19:30:49 -1428.075128 0.0273 BFGS: 224 19:30:49 -1428.075712 0.0237 BFGS: 225 19:30:49 -1428.076293 0.0204 BFGS: 226 19:30:49 -1428.076933 0.0181 BFGS: 227 19:30:50 -1428.077631 0.0185 BFGS: 228 19:30:50 -1428.078373 0.0224 BFGS: 229 19:30:50 -1428.079205 0.0190 BFGS: 230 19:30:50 -1428.080250 0.0199 BFGS: 231 19:30:50 -1428.081275 0.0220 BFGS: 232 19:30:50 -1428.082353 0.0265 BFGS: 233 19:30:50 -1428.083491 0.0314 BFGS: 234 19:30:50 -1428.084679 0.0348 BFGS: 235 19:30:50 -1428.085906 0.0370 BFGS: 236 19:30:50 -1428.087161 0.0382 BFGS: 237 19:30:50 -1428.088435 0.0388 BFGS: 238 19:30:50 -1428.089719 0.0389 BFGS: 239 19:30:51 -1428.091009 0.0387 BFGS: 240 19:30:51 -1428.092298 0.0383 BFGS: 241 19:30:51 -1428.093585 0.0376 BFGS: 242 19:30:51 -1428.094867 0.0369 BFGS: 243 19:30:51 -1428.096142 0.0361 BFGS: 244 19:30:51 -1428.097408 0.0353 BFGS: 245 19:30:51 -1428.098664 0.0344 BFGS: 246 19:30:51 -1428.099909 0.0335 BFGS: 247 19:30:51 -1428.101142 0.0327 BFGS: 248 19:30:51 -1428.102361 0.0318 BFGS: 249 19:30:51 -1428.103566 0.0309 BFGS: 250 19:30:51 -1428.104755 0.0301 BFGS: 251 19:30:51 -1428.105927 0.0292 BFGS: 252 19:30:52 -1428.107080 0.0284 BFGS: 253 19:30:52 -1428.108213 0.0276 BFGS: 254 19:30:52 -1428.109325 0.0267 BFGS: 255 19:30:52 -1428.110413 0.0259 BFGS: 256 19:30:52 -1428.111476 0.0250 BFGS: 257 19:30:52 -1428.112513 0.0242 BFGS: 258 19:30:52 -1428.113521 0.0237 BFGS: 259 19:30:52 -1428.114498 0.0230 BFGS: 260 19:30:52 -1428.115443 0.0223 BFGS: 261 19:30:52 -1428.116353 0.0216 BFGS: 262 19:30:52 -1428.117227 0.0208 BFGS: 263 19:30:52 -1428.118062 0.0199 BFGS: 264 19:30:53 -1428.118855 0.0190 BFGS: 265 19:30:53 -1428.119605 0.0180 BFGS: 266 19:30:53 -1428.120309 0.0169 BFGS: 267 19:30:53 -1428.120964 0.0158 BFGS: 268 19:30:53 -1428.121568 0.0146 BFGS: 269 19:30:53 -1428.122117 0.0135 BFGS: 270 19:30:53 -1428.122609 0.0123 BFGS: 271 19:30:53 -1428.123040 0.0109 BFGS: 272 19:30:53 -1428.123407 0.0095 BFGS: 273 19:30:53 -1428.123703 0.0080 BFGS: 274 19:30:53 -1428.123925 0.0062 BFGS: 275 19:30:53 -1428.124063 0.0043 BFGS: 276 19:30:54 -1428.124105 0.0031 BFGS: 277 19:30:54 -1428.124119 0.0025 BFGS: 278 19:30:54 -1428.124155 0.0009 BFGS: 279 19:30:54 -1428.124163 0.0006 BFGS: 280 19:30:54 -1428.124165 0.0004 BFGS: 281 19:30:54 -1428.124165 0.0003 BFGS: 282 19:30:54 -1428.124165 0.0002 BFGS: 283 19:30:54 -1428.124165 0.0002 BFGS: 284 19:30:54 -1428.124166 0.0001 BFGS: 285 19:30:54 -1428.124166 0.0001 BFGS: 286 19:30:54 -1428.124166 0.0000 BFGS: 287 19:30:54 -1428.124166 0.0000 BFGS: 288 19:30:55 -1428.124166 0.0000 BFGS: 289 19:30:55 -1428.124166 0.0000 BFGS: 290 19:30:55 -1428.124166 0.0000 BFGS: 291 19:30:55 -1428.124166 0.0000 BFGS: 292 19:30:55 -1428.124166 0.0000 BFGS: 293 19:30:55 -1428.124166 0.0000 BFGS: 294 19:30:55 -1428.124166 0.0000 BFGS: 295 19:30:55 -1428.124166 0.0000 BFGS: 296 19:30:55 -1428.124166 0.0000 BFGS: 297 19:30:55 -1428.124166 0.0000 BFGS: 298 19:30:55 -1428.124166 0.0000 BFGS: 299 19:30:55 -1428.124166 0.0000 BFGS: 300 19:30:56 -1428.124166 0.0000 BFGS: 301 19:30:56 -1428.124166 0.0000 BFGS: 302 19:30:56 -1428.124166 0.0000 BFGS: 303 19:30:56 -1428.124166 0.0000 BFGS: 304 19:30:56 -1428.124166 0.0000 BFGS: 305 19:30:56 -1428.124166 0.0000 BFGS: 306 19:30:56 -1428.124166 0.0000 BFGS: 307 19:30:56 -1428.124166 0.0000 BFGS: 308 19:30:56 -1428.124166 0.0000 BFGS: 309 19:30:56 -1428.124166 0.0000 BFGS: 310 19:30:56 -1428.124166 0.0000 BFGS: 311 19:30:56 -1428.124166 0.0000 BFGS: 312 19:30:56 -1428.124166 0.0000 BFGS: 313 19:30:57 -1428.124166 0.0000 BFGS: 314 19:30:57 -1428.124166 0.0000 BFGS: 315 19:30:57 -1428.124166 0.0000 Minimization converged after 315 steps. Maximum force component: 7.948738470671866e-09 eV/Angstrom Maximum stress component: 9.180408154356552e-12 eV/Angstrom^3 ==== Minimized structure obtained from ASE ==== symbols = ['O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si'] basis = [[0.45950737 0.28308721 0.39653585] [0.71691279 0.17642016 0.39653585] [0.82357984 0.54049263 0.39653585] [0.12617404 0.61642055 0.72986918] [0.38357945 0.50975349 0.72986918] [0.49024651 0.87382596 0.72986918] [0.7928407 0.94975388 0.06320252] [0.05024612 0.84308683 0.06320252] [0.15691317 0.2071593 0.06320252] [0.54049263 0.71691279 0.60346415] [0.28308721 0.82357984 0.60346415] [0.17642016 0.45950737 0.60346415] [0.2071593 0.05024612 0.93679748] [0.94975388 0.15691317 0.93679748] [0.84308683 0.7928407 0.93679748] [0.87382596 0.38357945 0.27013082] [0.61642055 0.49024651 0.27013082] [0.50975349 0.12617404 0.27013082] [0.26641926 0.06431675 0.484311 ] [0.93568325 0.20210251 0.484311 ] [0.79789749 0.73358074 0.484311 ] [0.93308593 0.39765008 0.81764434] [0.60234992 0.53543585 0.81764434] [0.46456415 0.06691407 0.81764434] [0.59975259 0.73098341 0.15097767] [0.26901659 0.86876918 0.15097767] [0.13123082 0.40024741 0.15097767] [0.73358074 0.93568325 0.515689 ] [0.06431675 0.79789749 0.515689 ] [0.20210251 0.26641926 0.515689 ] [0.40024741 0.26901659 0.84902233] [0.73098341 0.13123082 0.84902233] [0.86876918 0.59975259 0.84902233] [0.06691407 0.60234992 0.18235566] [0.39765008 0.46456415 0.18235566] [0.53543585 0.93308593 0.18235566] [0.88559341 0.96070725 0.86856414] [0.03929275 0.92488615 0.86856414] [0.07511385 0.11440659 0.86856414] [0.55226007 0.29404059 0.20189747] [0.70595941 0.25821949 0.20189747] [0.74178051 0.44773993 0.20189747] [0.21892674 0.62737392 0.5352308 ] [0.37262608 0.59155282 0.5352308 ] [0.40844718 0.78107326 0.5352308 ] [0.11440659 0.03929275 0.13143586] [0.96070725 0.07511385 0.13143586] [0.92488615 0.88559341 0.13143586] [0.78107326 0.37262608 0.4647692 ] [0.62737392 0.40844718 0.4647692 ] [0.59155282 0.21892674 0.4647692 ] [0.44773993 0.70595941 0.79810253] [0.29404059 0.74178051 0.79810253] [0.25821949 0.55226007 0.79810253] [0.36959509 0.03157824 0.37343396] [0.96842176 0.33801685 0.37343396] [0.66198315 0.63040491 0.37343396] [0.03626176 0.36491157 0.70676729] [0.63508843 0.67135019 0.70676729] [0.32864981 0.96373824 0.70676729] [0.70292843 0.69824491 0.04010062] [0.30175509 0.00468352 0.04010062] [0.99531648 0.29707157 0.04010062] [0.63040491 0.96842176 0.62656604] [0.03157824 0.66198315 0.62656604] [0.33801685 0.36959509 0.62656604] [0.29707157 0.30175509 0.95989938] [0.69824491 0.99531648 0.95989938] [0.00468352 0.70292843 0.95989938] [0.96373824 0.63508843 0.29323271] [0.36491157 0.32864981 0.29323271] [0.67135019 0.03626176 0.29323271] [0.25804328 0.16907525 0.59125945] [0.83092475 0.08896803 0.59125945] [0.91103197 0.74195672 0.59125945] [0.92470995 0.50240858 0.92459279] [0.49759142 0.42230136 0.92459279] [0.57769864 0.07529005 0.92459279] [0.59137661 0.83574192 0.25792612] [0.16425808 0.7556347 0.25792612] [0.2443653 0.40862339 0.25792612] [0.74195672 0.83092475 0.40874055] [0.16907525 0.91103197 0.40874055] [0.08896803 0.25804328 0.40874055] [0.40862339 0.16425808 0.74207388] [0.83574192 0.2443653 0.74207388] [0.7556347 0.59137661 0.74207388] [0.07529005 0.49759142 0.07540721] [0.50240858 0.57769864 0.07540721] [0.42230136 0.92470995 0.07540721] [0.30320535 0.33732977 0.40766276] [0.66267023 0.96587558 0.40766276] [0.03412442 0.69679465 0.40766276] [0.96987202 0.6706631 0.7409961 ] [0.3293369 0.29920891 0.7409961 ] [0.70079109 0.03012798 0.7409961 ] [0.63653868 0.00399644 0.07432943] [0.99600356 0.63254225 0.07432943] [0.36745775 0.36346132 0.07432943] [0.69679465 0.66267023 0.59233724] [0.33732977 0.03412442 0.59233724] [0.96587558 0.30320535 0.59233724] [0.36346132 0.99600356 0.92567057] [0.00399644 0.36745775 0.92567057] [0.63254225 0.63653868 0.92567057] [0.03012798 0.3293369 0.2590039 ] [0.6706631 0.70079109 0.2590039 ] [0.29920891 0.96987202 0.2590039 ] [0.44143093 0.23254014 0.52536242] [0.76745986 0.20889078 0.52536242] [0.79110922 0.55856907 0.52536242] [0.10809759 0.56587348 0.85869575] [0.43412652 0.54222412 0.85869575] [0.45777588 0.89190241 0.85869575] [0.77476426 0.89920681 0.19202909] [0.10079319 0.87555745 0.19202909] [0.12444255 0.22523574 0.19202909] [0.55856907 0.76745986 0.47463758] [0.23254014 0.79110922 0.47463758] [0.20889078 0.44143093 0.47463758] [0.22523574 0.10079319 0.80797091] [0.89920681 0.12444255 0.80797091] [0.87555745 0.77476426 0.80797091] [0.89190241 0.43412652 0.14130425] [0.56587348 0.45777588 0.14130425] [0.54222412 0.10809759 0.14130425] [0.26959388 0.13965146 0.37029923] [0.86034854 0.12994242 0.37029923] [0.87005758 0.73040612 0.37029923] [0.93626055 0.47298479 0.70363256] [0.52701521 0.46327576 0.70363256] [0.53672424 0.06373945 0.70363256] [0.60292721 0.80631812 0.03696589] [0.19368188 0.79660909 0.03696589] [0.20339091 0.39707279 0.03696589] [0.73040612 0.86034854 0.62970077] [0.13965146 0.87005758 0.62970077] [0.12994242 0.26959388 0.62970077] [0.39707279 0.19368188 0.96303411] [0.80631812 0.20339091 0.96303411] [0.79660909 0.60292721 0.96303411] [0.06373945 0.52701521 0.29636744] [0.47298479 0.53672424 0.29636744] [0.46327576 0.93626055 0.29636744] [0.52373791 0.2843333 0.46312286] [0.7156667 0.23940461 0.46312286] [0.76059539 0.47626209 0.46312286] [0.19040457 0.61766663 0.79645619] [0.38233337 0.57273794 0.79645619] [0.42726206 0.80959543 0.79645619] [0.85707124 0.95099997 0.12978952] [0.04900003 0.90607128 0.12978952] [0.09392872 0.14292876 0.12978952] [0.47626209 0.7156667 0.53687714] [0.2843333 0.76059539 0.53687714] [0.23940461 0.52373791 0.53687714] [0.14292876 0.04900003 0.87021048] [0.95099997 0.09392872 0.87021048] [0.90607128 0.85707124 0.87021048] [0.80959543 0.38233337 0.20354381] [0.61766663 0.42726206 0.20354381] [0.57273794 0.19040457 0.20354381] [0.26792984 0.03683906 0.40722272] [0.96316094 0.23109078 0.40722272] [0.76890922 0.73207016 0.40722272] [0.93459651 0.3701724 0.74055605] [0.6298276 0.56442411 0.74055605] [0.43557589 0.06540349 0.74055605] [0.60126318 0.70350573 0.07388938] [0.29649427 0.89775745 0.07388938] [0.10224255 0.39873682 0.07388938] [0.73207016 0.96316094 0.59277728] [0.03683906 0.76890922 0.59277728] [0.23109078 0.26792984 0.59277728] [0.39873682 0.29649427 0.92611062] [0.70350573 0.10224255 0.92611062] [0.89775745 0.60126318 0.92611062] [0.06540349 0.6298276 0.25944395] [0.3701724 0.43557589 0.25944395] [0.56442411 0.93459651 0.25944395] [0.32860114 0.1268955 0.55064841] [0.8731045 0.20170564 0.55064841] [0.79829436 0.67139886 0.55064841] [0.99526781 0.46022883 0.88398174] [0.53977117 0.53503897 0.88398174] [0.46496103 0.00473219 0.88398174] [0.66193447 0.79356216 0.21731508] [0.20643784 0.86837231 0.21731508] [0.13162769 0.33806553 0.21731508] [0.67139886 0.8731045 0.44935159] [0.1268955 0.79829436 0.44935159] [0.20170564 0.32860114 0.44935159] [0.33806553 0.20643784 0.78268492] [0.79356216 0.13162769 0.78268492] [0.86837231 0.66193447 0.78268492] [0.00473219 0.53977117 0.11601826] [0.46022883 0.46496103 0.11601826] [0.53503897 0.99526781 0.11601826] [0.34830001 0.27132762 0.36450213] [0.72867238 0.07697239 0.36450213] [0.92302761 0.65169999 0.36450213] [0.01496668 0.60466095 0.69783546] [0.39533905 0.41030573 0.69783546] [0.58969427 0.98503332 0.69783546] [0.68163335 0.93799429 0.0311688 ] [0.06200571 0.74363906 0.0311688 ] [0.25636094 0.31836665 0.0311688 ] [0.65169999 0.72867238 0.63549787] [0.27132762 0.92302761 0.63549787] [0.07697239 0.34830001 0.63549787] [0.31836665 0.06200571 0.9688312 ] [0.93799429 0.25636094 0.9688312 ] [0.74363906 0.68163335 0.9688312 ] [0.98503332 0.39533905 0.30216454] [0.60466095 0.58969427 0.30216454] [0.41030573 0.01496668 0.30216454]] cellpar = Cell([[14.264722221538902, -3.828240501684332e-13, -2.9591779795984076e-16], [-7.132361110769114, 12.353611821781296, -4.532731190163666e-16], [2.3374326186607687e-15, -6.275083316515513e-17, 20.60639649491254]]) forces = [[-3.63981456e-10 -2.67904465e-09 2.04194072e-10] [ 2.50211145e-09 1.02430514e-09 2.04194072e-10] [-2.13812999e-09 1.65473951e-09 2.04194072e-10] [-3.63981456e-10 -2.67904465e-09 2.04194072e-10] [ 2.50211145e-09 1.02430514e-09 2.04194072e-10] [-2.13812999e-09 1.65473951e-09 2.04194072e-10] [-3.63981456e-10 -2.67904465e-09 2.04194072e-10] [ 2.50211145e-09 1.02430514e-09 2.04194072e-10] [-2.13812999e-09 1.65473951e-09 2.04194072e-10] [ 3.63981456e-10 2.67904465e-09 -2.04194072e-10] [-2.50211145e-09 -1.02430514e-09 -2.04194072e-10] [ 2.13812999e-09 -1.65473951e-09 -2.04194072e-10] [ 3.63981456e-10 2.67904465e-09 -2.04194072e-10] [-2.50211145e-09 -1.02430514e-09 -2.04194072e-10] [ 2.13812999e-09 -1.65473951e-09 -2.04194072e-10] [ 3.63981456e-10 2.67904465e-09 -2.04194072e-10] [-2.50211145e-09 -1.02430514e-09 -2.04194072e-10] [ 2.13812999e-09 -1.65473951e-09 -2.04194072e-10] [ 1.63207769e-09 -4.21766329e-09 1.02254647e-09] [ 2.83656470e-09 3.52225238e-09 1.02254647e-09] [-4.46864240e-09 6.95410901e-10 1.02254647e-09] [ 1.63207769e-09 -4.21766329e-09 1.02254647e-09] [ 2.83656470e-09 3.52225238e-09 1.02254647e-09] [-4.46864240e-09 6.95410901e-10 1.02254647e-09] [ 1.63207769e-09 -4.21766329e-09 1.02254647e-09] [ 2.83656470e-09 3.52225238e-09 1.02254647e-09] [-4.46864240e-09 6.95410901e-10 1.02254647e-09] [-1.63207769e-09 4.21766329e-09 -1.02254647e-09] [-2.83656470e-09 -3.52225238e-09 -1.02254647e-09] [ 4.46864240e-09 -6.95410901e-10 -1.02254647e-09] [-1.63207769e-09 4.21766329e-09 -1.02254647e-09] [-2.83656470e-09 -3.52225238e-09 -1.02254647e-09] [ 4.46864240e-09 -6.95410901e-10 -1.02254647e-09] [-1.63207769e-09 4.21766329e-09 -1.02254647e-09] [-2.83656470e-09 -3.52225238e-09 -1.02254647e-09] [ 4.46864240e-09 -6.95410901e-10 -1.02254647e-09] [-1.94747522e-09 -1.90925305e-09 -3.16382324e-09] [ 2.62719925e-09 -7.31936491e-10 -3.16382324e-09] [-6.79724031e-10 2.64118954e-09 -3.16382324e-09] [-1.94747522e-09 -1.90925305e-09 -3.16382324e-09] [ 2.62719925e-09 -7.31936491e-10 -3.16382324e-09] [-6.79724031e-10 2.64118954e-09 -3.16382324e-09] [-1.94747522e-09 -1.90925305e-09 -3.16382324e-09] [ 2.62719925e-09 -7.31936491e-10 -3.16382324e-09] [-6.79724031e-10 2.64118954e-09 -3.16382324e-09] [ 1.94747522e-09 1.90925305e-09 3.16382324e-09] [-2.62719925e-09 7.31936491e-10 3.16382324e-09] [ 6.79724031e-10 -2.64118954e-09 3.16382324e-09] [ 1.94747522e-09 1.90925305e-09 3.16382324e-09] [-2.62719925e-09 7.31936491e-10 3.16382324e-09] [ 6.79724031e-10 -2.64118954e-09 3.16382324e-09] [ 1.94747522e-09 1.90925305e-09 3.16382324e-09] [-2.62719925e-09 7.31936491e-10 3.16382324e-09] [ 6.79724031e-10 -2.64118954e-09 3.16382324e-09] [-2.33210732e-09 -5.89774098e-09 1.12626436e-09] [ 6.27364718e-09 9.29206313e-10 1.12626436e-09] [-3.94153986e-09 4.96853467e-09 1.12626436e-09] [-2.33210732e-09 -5.89774098e-09 1.12626436e-09] [ 6.27364718e-09 9.29206313e-10 1.12626436e-09] [-3.94153986e-09 4.96853467e-09 1.12626436e-09] [-2.33210732e-09 -5.89774098e-09 1.12626436e-09] [ 6.27364718e-09 9.29206313e-10 1.12626436e-09] [-3.94153986e-09 4.96853467e-09 1.12626436e-09] [ 2.33210732e-09 5.89774098e-09 -1.12626436e-09] [-6.27364718e-09 -9.29206313e-10 -1.12626436e-09] [ 3.94153986e-09 -4.96853467e-09 -1.12626436e-09] [ 2.33210732e-09 5.89774098e-09 -1.12626436e-09] [-6.27364718e-09 -9.29206313e-10 -1.12626436e-09] [ 3.94153986e-09 -4.96853467e-09 -1.12626436e-09] [ 2.33210732e-09 5.89774098e-09 -1.12626436e-09] [-6.27364718e-09 -9.29206313e-10 -1.12626436e-09] [ 3.94153986e-09 -4.96853467e-09 -1.12626436e-09] [ 1.33600481e-09 5.90398341e-09 -1.86709456e-09] [-5.78100202e-09 -1.79497760e-09 -1.86709456e-09] [ 4.44499721e-09 -4.10900581e-09 -1.86709456e-09] [ 1.33600481e-09 5.90398341e-09 -1.86709456e-09] [-5.78100202e-09 -1.79497760e-09 -1.86709456e-09] [ 4.44499721e-09 -4.10900581e-09 -1.86709456e-09] [ 1.33600481e-09 5.90398341e-09 -1.86709456e-09] [-5.78100202e-09 -1.79497760e-09 -1.86709456e-09] [ 4.44499721e-09 -4.10900581e-09 -1.86709456e-09] [-1.33600481e-09 -5.90398341e-09 1.86709456e-09] [ 5.78100202e-09 1.79497760e-09 1.86709456e-09] [-4.44499721e-09 4.10900581e-09 1.86709456e-09] [-1.33600481e-09 -5.90398341e-09 1.86709456e-09] [ 5.78100202e-09 1.79497760e-09 1.86709456e-09] [-4.44499721e-09 4.10900581e-09 1.86709456e-09] [-1.33600481e-09 -5.90398341e-09 1.86709456e-09] [ 5.78100202e-09 1.79497760e-09 1.86709456e-09] [-4.44499721e-09 4.10900581e-09 1.86709456e-09] [-1.81116744e-09 5.02779651e-09 2.18822414e-09] [-3.44861578e-09 -4.08241526e-09 2.18822414e-09] [ 5.25978322e-09 -9.45381243e-10 2.18822414e-09] [-1.81116744e-09 5.02779651e-09 2.18822414e-09] [-3.44861578e-09 -4.08241526e-09 2.18822414e-09] [ 5.25978322e-09 -9.45381243e-10 2.18822414e-09] [-1.81116744e-09 5.02779651e-09 2.18822414e-09] [-3.44861578e-09 -4.08241526e-09 2.18822414e-09] [ 5.25978322e-09 -9.45381243e-10 2.18822414e-09] [ 1.81116744e-09 -5.02779651e-09 -2.18822414e-09] [ 3.44861578e-09 4.08241526e-09 -2.18822414e-09] [-5.25978322e-09 9.45381243e-10 -2.18822414e-09] [ 1.81116744e-09 -5.02779651e-09 -2.18822414e-09] [ 3.44861578e-09 4.08241526e-09 -2.18822414e-09] [-5.25978322e-09 9.45381243e-10 -2.18822414e-09] [ 1.81116744e-09 -5.02779651e-09 -2.18822414e-09] [ 3.44861578e-09 4.08241526e-09 -2.18822414e-09] [-5.25978322e-09 9.45381243e-10 -2.18822414e-09] [ 2.35917031e-09 -1.55377774e-09 4.95939733e-10] [ 1.66025844e-10 2.81999029e-09 4.95939733e-10] [-2.52519615e-09 -1.26621255e-09 4.95939733e-10] [ 2.35917031e-09 -1.55377774e-09 4.95939733e-10] [ 1.66025844e-10 2.81999029e-09 4.95939733e-10] [-2.52519615e-09 -1.26621255e-09 4.95939733e-10] [ 2.35917031e-09 -1.55377774e-09 4.95939733e-10] [ 1.66025844e-10 2.81999029e-09 4.95939733e-10] [-2.52519615e-09 -1.26621255e-09 4.95939733e-10] [-2.35917031e-09 1.55377774e-09 -4.95939733e-10] [-1.66025844e-10 -2.81999029e-09 -4.95939733e-10] [ 2.52519615e-09 1.26621255e-09 -4.95939733e-10] [-2.35917031e-09 1.55377774e-09 -4.95939733e-10] [-1.66025844e-10 -2.81999029e-09 -4.95939733e-10] [ 2.52519615e-09 1.26621255e-09 -4.95939733e-10] [-2.35917031e-09 1.55377774e-09 -4.95939733e-10] [-1.66025844e-10 -2.81999029e-09 -4.95939733e-10] [ 2.52519615e-09 1.26621255e-09 -4.95939733e-10] [ 3.80887693e-09 1.57243409e-09 -7.94873847e-09] [-3.26620634e-09 2.51236714e-09 -7.94873847e-09] [-5.42670595e-10 -4.08480123e-09 -7.94873847e-09] [ 3.80887693e-09 1.57243409e-09 -7.94873847e-09] [-3.26620634e-09 2.51236714e-09 -7.94873847e-09] [-5.42670595e-10 -4.08480123e-09 -7.94873847e-09] [ 3.80887693e-09 1.57243409e-09 -7.94873847e-09] [-3.26620634e-09 2.51236714e-09 -7.94873847e-09] [-5.42670595e-10 -4.08480123e-09 -7.94873847e-09] [-3.80887693e-09 -1.57243409e-09 7.94873847e-09] [ 3.26620634e-09 -2.51236714e-09 7.94873847e-09] [ 5.42670595e-10 4.08480123e-09 7.94873847e-09] [-3.80887693e-09 -1.57243409e-09 7.94873847e-09] [ 3.26620634e-09 -2.51236714e-09 7.94873847e-09] [ 5.42670595e-10 4.08480123e-09 7.94873847e-09] [-3.80887693e-09 -1.57243409e-09 7.94873847e-09] [ 3.26620634e-09 -2.51236714e-09 7.94873847e-09] [ 5.42670595e-10 4.08480123e-09 7.94873847e-09] [ 6.66600112e-10 -1.35469464e-09 9.54674414e-10] [ 8.39899915e-10 1.25463995e-09 9.54674414e-10] [-1.50650003e-09 1.00054688e-10 9.54674414e-10] [ 6.66600112e-10 -1.35469464e-09 9.54674414e-10] [ 8.39899915e-10 1.25463995e-09 9.54674414e-10] [-1.50650003e-09 1.00054688e-10 9.54674414e-10] [ 6.66600112e-10 -1.35469464e-09 9.54674414e-10] [ 8.39899915e-10 1.25463995e-09 9.54674414e-10] [-1.50650003e-09 1.00054688e-10 9.54674414e-10] [-6.66600112e-10 1.35469464e-09 -9.54674414e-10] [-8.39899915e-10 -1.25463995e-09 -9.54674414e-10] [ 1.50650003e-09 -1.00054688e-10 -9.54674414e-10] [-6.66600112e-10 1.35469464e-09 -9.54674414e-10] [-8.39899915e-10 -1.25463995e-09 -9.54674414e-10] [ 1.50650003e-09 -1.00054688e-10 -9.54674414e-10] [-6.66600112e-10 1.35469464e-09 -9.54674414e-10] [-8.39899915e-10 -1.25463995e-09 -9.54674414e-10] [ 1.50650003e-09 -1.00054688e-10 -9.54674414e-10] [-1.12544567e-09 3.24066727e-09 -1.87257808e-10] [-2.24377735e-09 -2.59499817e-09 -1.87257808e-10] [ 3.36922302e-09 -6.45669099e-10 -1.87257808e-10] [-1.12544567e-09 3.24066727e-09 -1.87257808e-10] [-2.24377735e-09 -2.59499817e-09 -1.87257808e-10] [ 3.36922302e-09 -6.45669099e-10 -1.87257808e-10] [-1.12544567e-09 3.24066727e-09 -1.87257808e-10] [-2.24377735e-09 -2.59499817e-09 -1.87257808e-10] [ 3.36922302e-09 -6.45669099e-10 -1.87257808e-10] [ 1.12544567e-09 -3.24066727e-09 1.87257808e-10] [ 2.24377735e-09 2.59499817e-09 1.87257808e-10] [-3.36922302e-09 6.45669099e-10 1.87257808e-10] [ 1.12544567e-09 -3.24066727e-09 1.87257808e-10] [ 2.24377735e-09 2.59499817e-09 1.87257808e-10] [-3.36922302e-09 6.45669099e-10 1.87257808e-10] [ 1.12544567e-09 -3.24066727e-09 1.87257808e-10] [ 2.24377735e-09 2.59499817e-09 1.87257808e-10] [-3.36922302e-09 6.45669099e-10 1.87257808e-10] [-7.18710859e-10 1.80312975e-09 -1.81998689e-09] [-1.20220074e-09 -1.52398674e-09 -1.81998689e-09] [ 1.92091160e-09 -2.79143012e-10 -1.81998689e-09] [-7.18710859e-10 1.80312975e-09 -1.81998689e-09] [-1.20220074e-09 -1.52398674e-09 -1.81998689e-09] [ 1.92091160e-09 -2.79143012e-10 -1.81998689e-09] [-7.18710859e-10 1.80312975e-09 -1.81998689e-09] [-1.20220074e-09 -1.52398674e-09 -1.81998689e-09] [ 1.92091160e-09 -2.79143012e-10 -1.81998689e-09] [ 7.18710859e-10 -1.80312975e-09 1.81998689e-09] [ 1.20220074e-09 1.52398674e-09 1.81998689e-09] [-1.92091160e-09 2.79143012e-10 1.81998689e-09] [ 7.18710859e-10 -1.80312975e-09 1.81998689e-09] [ 1.20220074e-09 1.52398674e-09 1.81998689e-09] [-1.92091160e-09 2.79143012e-10 1.81998689e-09] [ 7.18710859e-10 -1.80312975e-09 1.81998689e-09] [ 1.20220074e-09 1.52398674e-09 1.81998689e-09] [-1.92091160e-09 2.79143012e-10 1.81998689e-09] [-2.88098082e-09 3.25659919e-09 -3.11671909e-10] [-1.37980722e-09 -4.12330217e-09 -3.11671909e-10] [ 4.26078803e-09 8.66702983e-10 -3.11671909e-10] [-2.88098082e-09 3.25659919e-09 -3.11671909e-10] [-1.37980722e-09 -4.12330217e-09 -3.11671909e-10] [ 4.26078803e-09 8.66702983e-10 -3.11671909e-10] [-2.88098082e-09 3.25659919e-09 -3.11671909e-10] [-1.37980722e-09 -4.12330217e-09 -3.11671909e-10] [ 4.26078803e-09 8.66702983e-10 -3.11671909e-10] [ 2.88098082e-09 -3.25659919e-09 3.11671909e-10] [ 1.37980722e-09 4.12330217e-09 3.11671909e-10] [-4.26078803e-09 -8.66702983e-10 3.11671909e-10] [ 2.88098082e-09 -3.25659919e-09 3.11671909e-10] [ 1.37980722e-09 4.12330217e-09 3.11671909e-10] [-4.26078803e-09 -8.66702983e-10 3.11671909e-10] [ 2.88098082e-09 -3.25659919e-09 3.11671909e-10] [ 1.37980722e-09 4.12330217e-09 3.11671909e-10] [-4.26078803e-09 -8.66702983e-10 3.11671909e-10]] stress = [-9.18040815e-12 -9.18040815e-12 -4.39813783e-12 5.25301540e-27 2.85365284e-27 1.03363546e-27] energy per atom = -6.6116859517365505 =============================================== Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them. Successfully added property instance for parameter set 0