element(s): ['Si'] AFLOW prototype label: A_hP4_194_f Parameter names: ['a', 'c/a', 'z1'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['3.8496', '1.6527431', '0.56294015'] model name: Sim_LAMMPS_Buckingham_FreitasSantosColaco_2015_SiCaOAl__SM_154093256665_000 ==== Building ASE atoms object with: ==== representative atom symbols = ['Si'] representative atom coordinates = [[0.33333333 0.66666667 0.56294015]] spacegroup = 194 cell = [[3.8496, 0, 0], [-1.9248, 3.3338513944086, 0], [0, 0, 6.3624]] ========================================= Step Time Energy fmax BFGS: 0 11:50:58 -163.260257 37.2222 BFGS: 1 11:50:58 -161.259252 35.2940 BFGS: 2 11:50:58 -159.320731 33.4968 BFGS: 3 11:50:58 -157.441768 30.7540 BFGS: 4 11:50:58 -155.626232 29.2121 BFGS: 5 11:50:58 -153.868447 27.7728 BFGS: 6 11:50:58 -152.165359 26.4274 BFGS: 7 11:50:58 -150.514390 25.1687 BFGS: 8 11:50:58 -148.913212 23.9911 BFGS: 9 11:50:58 -147.360305 22.8883 BFGS: 10 11:50:58 -145.853894 21.8548 BFGS: 11 11:50:58 -144.392528 20.8858 BFGS: 12 11:50:58 -142.974715 19.9767 BFGS: 13 11:50:58 -141.599140 19.1234 BFGS: 14 11:50:58 -140.264543 18.3221 BFGS: 15 11:50:58 -138.969581 17.5692 BFGS: 16 11:50:58 -137.712997 16.5820 BFGS: 17 11:50:58 -136.498300 15.9261 BFGS: 18 11:50:58 -135.320233 15.3093 BFGS: 19 11:50:58 -134.177614 14.7292 BFGS: 20 11:50:58 -133.069446 14.1833 BFGS: 21 11:50:58 -131.994704 13.6695 BFGS: 22 11:50:58 -130.952463 13.1855 BFGS: 23 11:50:58 -129.941782 12.7296 BFGS: 24 11:50:58 -128.961633 12.3000 BFGS: 25 11:50:58 -128.011233 12.1167 BFGS: 26 11:50:58 -127.083882 11.5098 BFGS: 27 11:50:58 -126.190345 11.1491 BFGS: 28 11:50:58 -125.323927 10.8085 BFGS: 29 11:50:58 -124.483792 10.4866 BFGS: 30 11:50:58 -123.669292 10.1818 BFGS: 31 11:50:58 -122.879345 9.8939 BFGS: 32 11:50:58 -122.113305 9.6214 BFGS: 33 11:50:58 -121.370448 9.3631 BFGS: 34 11:50:58 -120.650029 9.1183 BFGS: 35 11:50:58 -119.951297 8.4402 BFGS: 36 11:50:58 -119.291694 8.2227 BFGS: 37 11:50:58 -118.652614 8.0163 BFGS: 38 11:50:58 -118.033505 7.8203 BFGS: 39 11:50:59 -117.433750 7.6337 BFGS: 40 11:50:59 -116.852706 7.4559 BFGS: 41 11:50:59 -116.289752 7.2862 BFGS: 42 11:50:59 -115.744216 7.1243 BFGS: 43 11:50:59 -115.215508 6.9694 BFGS: 44 11:50:59 -114.702995 6.8211 BFGS: 45 11:50:59 -114.205866 7.1500 BFGS: 46 11:50:59 -113.649366 6.5246 BFGS: 47 11:50:59 -113.134250 6.8541 BFGS: 48 11:50:59 -112.564951 6.2269 BFGS: 49 11:50:59 -112.038789 6.0832 BFGS: 50 11:50:59 -111.526639 5.9456 BFGS: 51 11:50:59 -111.028097 5.8134 BFGS: 52 11:50:59 -110.542775 5.6864 BFGS: 53 11:50:59 -110.070183 5.7958 BFGS: 54 11:50:59 -109.582640 5.4420 BFGS: 55 11:50:59 -109.122861 5.3258 BFGS: 56 11:50:59 -108.674835 5.2137 BFGS: 57 11:50:59 -108.237832 5.1059 BFGS: 58 11:50:59 -107.811673 5.0018 BFGS: 59 11:50:59 -107.395977 4.9013 BFGS: 60 11:50:59 -106.990542 5.0031 BFGS: 61 11:50:59 -106.570182 4.7065 BFGS: 62 11:50:59 -106.174522 4.6131 BFGS: 63 11:50:59 -105.788061 4.5229 BFGS: 64 11:50:59 -105.410514 4.4355 BFGS: 65 11:50:59 -105.041619 4.3508 BFGS: 66 11:50:59 -104.681055 4.2686 BFGS: 67 11:50:59 -104.328684 4.3581 BFGS: 68 11:50:59 -103.962885 4.1084 BFGS: 69 11:50:59 -103.618918 4.1923 BFGS: 70 11:50:59 -103.261932 3.8918 BFGS: 71 11:50:59 -102.931455 3.8202 BFGS: 72 11:50:59 -102.607890 3.7509 BFGS: 73 11:50:59 -102.290765 3.6837 BFGS: 74 11:50:59 -101.980075 3.6182 BFGS: 75 11:50:59 -101.675609 3.5544 BFGS: 76 11:50:59 -101.377114 3.4921 BFGS: 77 11:50:59 -101.084424 3.4313 BFGS: 78 11:50:59 -100.797353 3.3718 BFGS: 79 11:50:59 -100.515693 3.3137 BFGS: 80 11:50:59 -100.239262 3.2568 BFGS: 81 11:50:59 -99.967895 3.2012 BFGS: 82 11:50:59 -99.701432 3.1467 BFGS: 83 11:50:59 -99.439696 3.0933 BFGS: 84 11:50:59 -99.182518 3.0409 BFGS: 85 11:50:59 -98.929756 2.9896 BFGS: 86 11:50:59 -98.681269 2.9393 BFGS: 87 11:50:59 -98.436916 2.8899 BFGS: 88 11:50:59 -98.196569 2.8415 BFGS: 89 11:50:59 -97.960071 2.7939 BFGS: 90 11:50:59 -97.727516 2.6544 BFGS: 91 11:50:59 -97.507901 2.7016 BFGS: 92 11:50:59 -97.280804 2.5634 BFGS: 93 11:50:59 -97.066971 2.5191 BFGS: 94 11:50:59 -96.856230 2.5695 BFGS: 95 11:50:59 -96.637584 2.4329 BFGS: 96 11:50:59 -96.432082 2.4845 BFGS: 97 11:50:59 -96.218286 2.3490 BFGS: 98 11:50:59 -96.017957 2.3081 BFGS: 99 11:50:59 -95.820474 2.2681 BFGS: 100 11:50:59 -95.625793 2.2288 BFGS: 101 11:50:59 -95.433988 2.1900 BFGS: 102 11:50:59 -95.244654 2.1520 BFGS: 103 11:50:59 -95.057783 2.2086 BFGS: 104 11:50:59 -94.861691 2.0772 BFGS: 105 11:50:59 -94.679272 2.0403 BFGS: 106 11:50:59 -94.499145 2.0044 BFGS: 107 11:50:59 -94.320944 1.8473 BFGS: 108 11:50:59 -94.160652 1.8122 BFGS: 109 11:50:59 -94.002556 1.7780 BFGS: 110 11:50:59 -93.846636 1.7444 BFGS: 111 11:50:59 -93.693149 1.8355 BFGS: 112 11:50:59 -93.525670 1.6781 BFGS: 113 11:50:59 -93.377029 1.6454 BFGS: 114 11:50:59 -93.230277 1.6135 BFGS: 115 11:50:59 -93.085666 1.7085 BFGS: 116 11:50:59 -92.926418 1.5507 BFGS: 117 11:50:59 -92.786987 1.6470 BFGS: 118 11:50:59 -92.631986 1.4892 BFGS: 119 11:50:59 -92.497534 1.5871 BFGS: 120 11:50:59 -92.346863 1.4294 BFGS: 121 11:50:59 -92.217094 1.4002 BFGS: 122 11:50:59 -92.088794 1.3717 BFGS: 123 11:50:59 -91.961948 1.3436 BFGS: 124 11:50:59 -91.836536 1.3159 BFGS: 125 11:50:59 -91.712502 1.2886 BFGS: 126 11:50:59 -91.589802 1.2615 BFGS: 127 11:50:59 -91.468398 1.2348 BFGS: 128 11:50:59 -91.348244 1.2084 BFGS: 129 11:50:59 -91.229298 1.1823 BFGS: 130 11:50:59 -91.111517 1.1565 BFGS: 131 11:50:59 -90.994871 1.1310 BFGS: 132 11:50:59 -90.879310 1.1058 BFGS: 133 11:50:59 -90.764802 1.0809 BFGS: 134 11:50:59 -90.651316 1.0563 BFGS: 135 11:50:59 -90.538815 1.0320 BFGS: 136 11:50:59 -90.427256 1.0079 BFGS: 137 11:50:59 -90.316615 0.9841 BFGS: 138 11:50:59 -90.206860 0.9605 BFGS: 139 11:50:59 -90.097959 0.9373 BFGS: 140 11:50:59 -89.989883 0.9143 BFGS: 141 11:50:59 -89.882601 0.8915 BFGS: 142 11:50:59 -89.776084 0.8690 BFGS: 143 11:50:59 -89.670307 0.8468 BFGS: 144 11:50:59 -89.565896 0.7437 BFGS: 145 11:50:59 -89.476043 0.7214 BFGS: 146 11:50:59 -89.387045 0.6996 BFGS: 147 11:50:59 -89.298934 0.6781 BFGS: 148 11:50:59 -89.211701 0.6568 BFGS: 149 11:50:59 -89.125327 0.6357 BFGS: 150 11:50:59 -89.039787 0.6149 BFGS: 151 11:50:59 -88.955061 0.5943 BFGS: 152 11:50:59 -88.871147 0.5739 BFGS: 153 11:50:59 -88.788020 0.5537 BFGS: 154 11:50:59 -88.705655 0.5337 BFGS: 155 11:50:59 -88.624051 0.5140 BFGS: 156 11:50:59 -88.543351 0.4941 BFGS: 157 11:50:59 -88.463229 0.4748 BFGS: 158 11:50:59 -88.383829 0.4556 BFGS: 159 11:50:59 -88.305124 0.4367 BFGS: 160 11:50:59 -88.227129 0.4179 BFGS: 161 11:50:59 -88.149823 0.3994 BFGS: 162 11:50:59 -88.073207 0.3810 BFGS: 163 11:50:59 -87.997263 0.3695 BFGS: 164 11:50:59 -87.922005 0.3634 BFGS: 165 11:50:59 -87.847419 0.3569 BFGS: 166 11:50:59 -87.773521 0.3502 BFGS: 167 11:50:59 -87.700288 0.3431 BFGS: 168 11:50:59 -87.627755 0.3358 BFGS: 169 11:50:59 -87.555911 0.3281 BFGS: 170 11:50:59 -87.484778 0.3202 BFGS: 171 11:50:59 -87.414371 0.3119 BFGS: 172 11:50:59 -87.344702 0.3033 BFGS: 173 11:50:59 -87.275812 0.2944 BFGS: 174 11:50:59 -87.207726 0.2851 BFGS: 175 11:50:59 -87.140479 0.2755 BFGS: 176 11:50:59 -87.074134 0.2656 BFGS: 177 11:50:59 -87.008755 0.2554 BFGS: 178 11:50:59 -86.944424 0.2447 BFGS: 179 11:50:59 -86.881238 0.2337 BFGS: 180 11:50:59 -86.819345 0.2223 BFGS: 181 11:50:59 -86.758925 0.2104 BFGS: 182 11:50:59 -86.698574 0.3995 BFGS: 183 11:50:59 -86.690887 0.3856 BFGS: 184 11:50:59 -86.693481 0.3674 BFGS: 185 11:50:59 -86.713103 0.3464 BFGS: 186 11:50:59 -86.758033 0.3215 BFGS: 187 11:50:59 -86.844465 0.2901 BFGS: 188 11:50:59 -87.012222 0.2461 BFGS: 189 11:50:59 -87.380796 0.1728 BFGS: 190 11:50:59 -87.871444 0.1498 BFGS: 191 11:50:59 -88.063979 0.1353 BFGS: 192 11:50:59 -88.242766 0.1203 BFGS: 193 11:50:59 -88.415180 0.1052 BFGS: 194 11:50:59 -88.407889 0.0866 BFGS: 195 11:50:59 -88.444966 0.1257 BFGS: 196 11:50:59 -88.499221 0.1393 BFGS: 197 11:50:59 -88.566898 0.1506 BFGS: 198 11:50:59 -88.655337 0.0653 BFGS: 199 11:51:00 -88.612704 0.0746 BFGS: 200 11:51:00 -88.534193 0.1415 BFGS: 201 11:51:00 -88.579803 0.1465 BFGS: 202 11:51:00 -88.679499 0.0718 BFGS: 203 11:51:00 -88.633676 0.0785 BFGS: 204 11:51:00 -88.540818 0.1401 BFGS: 205 11:51:00 -88.595775 0.1443 BFGS: 206 11:51:00 -88.704999 0.0757 BFGS: 207 11:51:00 -88.655259 0.0810 BFGS: 208 11:51:00 -88.551618 0.1394 BFGS: 209 11:51:00 -88.612823 0.1427 BFGS: 210 11:51:00 -88.730569 0.0788 BFGS: 211 11:51:00 -88.676822 0.0831 BFGS: 212 11:51:00 -88.564104 0.1388 BFGS: 213 11:51:00 -88.630160 0.1413 BFGS: 214 11:51:00 -88.755643 0.0815 BFGS: 215 11:51:00 -88.697983 0.0850 BFGS: 216 11:51:00 -88.577229 0.1382 BFGS: 217 11:51:00 -88.647350 0.1400 BFGS: 218 11:51:00 -88.779929 0.0841 BFGS: 219 11:51:00 -88.718503 0.0869 BFGS: 220 11:51:00 -88.590429 0.1375 BFGS: 221 11:51:00 -88.664110 0.1386 BFGS: 222 11:51:00 -88.803298 0.0865 BFGS: 223 11:51:00 -88.738253 0.0887 BFGS: 224 11:51:00 -88.603370 0.1367 BFGS: 225 11:51:00 -88.680268 0.1373 BFGS: 226 11:51:00 -88.825679 0.0889 BFGS: 227 11:51:00 -88.757141 0.0905 BFGS: 228 11:51:00 -88.615850 0.1360 BFGS: 229 11:51:00 -88.695715 0.1360 BFGS: 230 11:51:00 -88.847012 0.0913 BFGS: 231 11:51:00 -88.775114 0.0923 BFGS: 232 11:51:00 -88.627732 0.1352 BFGS: 233 11:51:00 -88.712183 0.0930 BFGS: 234 11:51:00 -88.676754 0.1349 BFGS: 235 11:51:00 -88.696218 0.1347 BFGS: 236 11:51:00 -88.859446 0.1150 BFGS: 237 11:51:00 -88.776709 0.0946 BFGS: 238 11:51:00 -88.616258 0.1352 BFGS: 239 11:51:00 -88.707546 0.1337 BFGS: 240 11:51:00 -88.875961 0.1169 BFGS: 241 11:51:00 -88.790063 0.0960 BFGS: 242 11:51:00 -88.624347 0.1347 BFGS: 243 11:51:00 -88.718062 0.1328 BFGS: 244 11:51:00 -88.891526 0.1187 BFGS: 245 11:51:00 -88.802499 0.1173 BFGS: 246 11:51:00 -88.630444 0.1344 BFGS: 247 11:51:00 -88.720158 0.1321 BFGS: 248 11:51:00 -88.899226 0.1204 BFGS: 249 11:51:00 -88.807483 0.1184 BFGS: 250 11:51:00 -88.629380 0.1343 BFGS: 251 11:51:00 -88.722332 0.1316 BFGS: 252 11:51:00 -88.906784 0.1219 BFGS: 253 11:51:00 -88.812345 0.1194 BFGS: 254 11:51:00 -88.628535 0.1343 BFGS: 255 11:51:00 -88.724482 0.1312 BFGS: 256 11:51:00 -88.914116 0.1232 BFGS: 257 11:51:00 -88.817019 0.1202 BFGS: 258 11:51:00 -88.627786 0.1343 BFGS: 259 11:51:00 -88.726537 0.1308 BFGS: 260 11:51:00 -88.921249 0.1887 BFGS: 261 11:51:00 -88.803627 0.1203 BFGS: 262 11:51:00 -88.612345 0.1350 BFGS: 263 11:51:00 -88.713412 0.1311 BFGS: 264 11:51:00 -88.912029 0.1248 BFGS: 265 11:51:00 -88.811514 0.1845 BFGS: 266 11:51:00 -88.544990 0.1446 BFGS: 267 11:51:00 -88.660749 0.1372 BFGS: 268 11:51:00 -88.929563 0.1296 BFGS: 269 11:51:00 -88.795903 0.1202 BFGS: 270 11:51:00 -88.529052 0.1462 BFGS: 271 11:51:00 -88.673398 0.1362 BFGS: 272 11:51:00 -88.943804 0.1312 BFGS: 273 11:51:00 -88.808189 0.1214 BFGS: 274 11:51:00 -88.539414 0.1454 BFGS: 275 11:51:00 -88.683795 0.1353 BFGS: 276 11:51:00 -88.956217 0.1325 BFGS: 277 11:51:00 -88.818591 0.1224 BFGS: 278 11:51:00 -88.547754 0.1448 BFGS: 279 11:51:00 -88.692409 0.1345 BFGS: 280 11:51:00 -88.966837 0.1337 BFGS: 281 11:51:00 -88.827344 0.1233 BFGS: 282 11:51:00 -88.554466 0.1442 BFGS: 283 11:51:00 -88.699523 0.1338 BFGS: 284 11:51:00 -88.975917 0.1348 BFGS: 285 11:51:00 -88.834704 0.1242 BFGS: 286 11:51:00 -88.559814 0.1438 BFGS: 287 11:51:00 -88.705373 0.1332 BFGS: 288 11:51:00 -88.983689 0.1357 BFGS: 289 11:51:00 -88.840886 0.1249 BFGS: 290 11:51:00 -88.564019 0.1434 BFGS: 291 11:51:00 -88.710158 0.1327 BFGS: 292 11:51:00 -88.990354 0.1365 BFGS: 293 11:51:00 -88.846151 0.1890 BFGS: 294 11:51:00 -88.508580 0.1514 BFGS: 295 11:51:00 -88.655933 0.1390 BFGS: 296 11:51:00 -88.996412 0.1395 BFGS: 297 11:51:00 -88.823889 0.1237 BFGS: 298 11:51:00 -88.487078 0.1535 BFGS: 299 11:51:00 -88.670008 0.1377 BFGS: 300 11:51:00 -89.010043 0.1411 BFGS: 301 11:51:00 -88.836201 0.1250 BFGS: 302 11:51:00 -88.499396 0.1523 BFGS: 303 11:51:00 -88.680959 0.1365 BFGS: 304 11:51:00 -89.020915 0.1423 BFGS: 305 11:51:00 -88.845891 0.1261 BFGS: 306 11:51:00 -88.508983 0.1513 BFGS: 307 11:51:00 -88.689530 0.1356 BFGS: 308 11:51:00 -89.029456 0.1433 BFGS: 309 11:51:00 -88.853486 0.1270 BFGS: 310 11:51:00 -88.516463 0.1505 BFGS: 311 11:51:00 -88.696231 0.1349 BFGS: 312 11:51:00 -89.036223 0.2079 BFGS: 313 11:51:00 -88.829420 0.1249 BFGS: 314 11:51:00 -88.514276 0.1506 BFGS: 315 11:51:00 -88.683772 0.1359 BFGS: 316 11:51:00 -89.023117 0.1430 BFGS: 317 11:51:00 -88.848153 0.1902 BFGS: 318 11:51:00 -88.461046 0.1579 BFGS: 319 11:51:00 -88.632964 0.1419 BFGS: 320 11:51:00 -89.023026 0.1448 BFGS: 321 11:51:00 -88.824881 0.1246 BFGS: 322 11:51:00 -88.439556 0.1600 BFGS: 323 11:51:00 -88.651809 0.1399 BFGS: 324 11:51:00 -89.040058 0.1467 BFGS: 325 11:51:00 -88.840622 0.1897 BFGS: 326 11:51:00 -88.412802 0.1645 BFGS: 327 11:51:00 -88.606656 0.1453 BFGS: 328 11:51:00 -89.037988 0.1479 BFGS: 329 11:51:00 -88.819417 0.1242 BFGS: 330 11:51:00 -88.394243 0.1663 BFGS: 331 11:51:00 -88.632133 0.1426 BFGS: 332 11:51:00 -89.060393 0.1505 BFGS: 333 11:51:00 -88.839985 0.1266 BFGS: 334 11:51:00 -88.417225 0.1638 BFGS: 335 11:51:00 -88.650687 0.1405 BFGS: 336 11:51:00 -89.076231 0.1522 BFGS: 337 11:51:00 -88.854800 0.1283 BFGS: 338 11:51:00 -88.434342 0.1619 BFGS: 339 11:51:00 -88.664279 0.1390 BFGS: 340 11:51:00 -89.087270 0.1534 BFGS: 341 11:51:00 -88.865446 0.1295 BFGS: 342 11:51:01 -88.447220 0.1604 BFGS: 343 11:51:01 -88.674275 0.1379 BFGS: 344 11:51:01 -89.094836 0.1543 BFGS: 345 11:51:01 -88.873068 0.1304 BFGS: 346 11:51:01 -88.457014 0.1592 BFGS: 347 11:51:01 -88.681661 0.1371 BFGS: 348 11:51:01 -89.099890 0.1548 BFGS: 349 11:51:01 -88.878493 0.1311 BFGS: 350 11:51:01 -88.464557 0.1583 BFGS: 351 11:51:01 -88.687146 0.1364 BFGS: 352 11:51:01 -89.103132 0.1551 BFGS: 353 11:51:01 -88.882320 0.1315 BFGS: 354 11:51:01 -88.470447 0.1576 BFGS: 355 11:51:01 -88.691240 0.1359 BFGS: 356 11:51:01 -89.105064 0.1553 BFGS: 357 11:51:01 -88.884986 0.1319 BFGS: 358 11:51:01 -88.475118 0.1570 BFGS: 359 11:51:01 -88.694316 0.1355 BFGS: 360 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11:52:07 -88.854402 0.1300 BFGS: 8070 11:52:07 -88.385263 0.1677 BFGS: 8071 11:52:07 -88.645103 0.1406 BFGS: 8072 11:52:07 -89.116855 0.1599 BFGS: 8073 11:52:07 -88.867516 0.1314 BFGS: 8074 11:52:07 -88.398510 0.1663 BFGS: 8075 11:52:07 -88.656236 0.1395 BFGS: 8076 11:52:07 -89.127806 0.1611 BFGS: 8077 11:52:07 -88.876848 0.1325 BFGS: 8078 11:52:07 -88.408025 0.1653 BFGS: 8079 11:52:07 -88.664186 0.1386 BFGS: 8080 11:52:07 -89.135637 0.2254 BFGS: 8081 11:52:07 -88.845022 0.1289 BFGS: 8082 11:52:07 -88.443960 0.1616 BFGS: 8083 11:52:07 -88.663420 0.1387 BFGS: 8084 11:52:07 -89.134477 0.1619 BFGS: 8085 11:52:07 -88.882721 0.1332 BFGS: 8086 11:52:07 -88.414414 0.1646 BFGS: 8087 11:52:07 -88.669341 0.1381 BFGS: 8088 11:52:07 -89.140260 0.2259 BFGS: 8089 11:52:07 -88.849351 0.1294 BFGS: 8090 11:52:07 -88.446661 0.1613 BFGS: 8091 11:52:07 -88.666512 0.1384 BFGS: 8092 11:52:07 -89.137018 0.1622 BFGS: 8093 11:52:07 -88.885125 0.1334 BFGS: 8094 11:52:07 -88.417366 0.1643 BFGS: 8095 11:52:07 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0.1319 BFGS: 8122 11:52:07 -88.403289 0.1658 BFGS: 8123 11:52:07 -88.659764 0.1391 BFGS: 8124 11:52:07 -89.130232 0.1614 BFGS: 8125 11:52:07 -88.879415 0.1328 BFGS: 8126 11:52:07 -88.411685 0.1649 BFGS: 8127 11:52:07 -88.666769 0.1383 BFGS: 8128 11:52:07 -89.137029 0.1621 BFGS: 8129 11:52:07 -88.885256 0.1334 BFGS: 8130 11:52:07 -88.417741 0.1642 BFGS: 8131 11:52:07 -88.671788 0.1378 BFGS: 8132 11:52:07 -89.141819 0.1627 BFGS: 8133 11:52:07 -88.889412 0.1339 BFGS: 8134 11:52:07 -88.422128 0.1638 BFGS: 8135 11:52:07 -88.675389 0.1374 BFGS: 8136 11:52:07 -89.145179 0.1631 BFGS: 8137 11:52:07 -88.892366 0.1342 BFGS: 8138 11:52:07 -88.425326 0.1634 BFGS: 8139 11:52:07 -88.677979 0.1372 BFGS: 8140 11:52:07 -89.147601 0.2267 BFGS: 8141 11:52:07 -88.856483 0.1302 BFGS: 8142 11:52:07 -88.451356 0.1607 BFGS: 8143 11:52:07 -88.671698 0.1378 BFGS: 8144 11:52:07 -89.140878 0.1625 BFGS: 8145 11:52:07 -88.889016 0.1339 BFGS: 8146 11:52:07 -88.422572 0.1637 BFGS: 8147 11:52:07 -88.675372 0.1374 BFGS: 8148 11:52:07 -89.144314 0.1629 BFGS: 8149 11:52:07 -88.892115 0.1974 BFGS: 8150 11:52:07 -88.423640 0.1637 BFGS: 8151 11:52:07 -88.632096 0.1420 BFGS: 8152 11:52:07 -89.102706 0.2216 BFGS: 8153 11:52:07 -88.816731 0.1257 BFGS: 8154 11:52:07 -88.428436 0.1632 BFGS: 8155 11:52:07 -88.643898 0.1408 BFGS: 8156 11:52:07 -89.114227 0.1595 BFGS: 8157 11:52:07 -88.865958 0.1313 BFGS: 8158 11:52:07 -88.398358 0.1663 BFGS: 8159 11:52:07 -88.655448 0.1395 BFGS: 8160 11:52:07 -89.125603 0.1608 BFGS: 8161 11:52:07 -88.875653 0.1323 BFGS: 8162 11:52:07 -88.408224 0.1652 BFGS: 8163 11:52:07 -88.663706 0.1387 BFGS: 8164 11:52:07 -89.133668 0.1617 BFGS: 8165 11:52:08 -88.882639 0.1964 BFGS: 8166 11:52:08 -88.413129 0.1648 BFGS: 8167 11:52:08 -88.623329 0.1429 BFGS: 8168 11:52:08 -89.094924 0.1573 BFGS: 8169 11:52:08 -88.849066 0.1293 BFGS: 8170 11:52:08 -88.380226 0.1682 BFGS: 8171 11:52:08 -88.640714 0.1411 BFGS: 8172 11:52:08 -89.112185 0.1593 BFGS: 8173 11:52:08 -88.863709 0.1310 BFGS: 8174 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9618 11:52:22 -88.441909 0.1615 BFGS: 9619 11:52:22 -88.657863 0.1391 BFGS: 9620 11:52:22 -89.121880 0.1603 BFGS: 9621 11:52:22 -88.875399 0.1956 BFGS: 9622 11:52:22 -88.411987 0.1646 BFGS: 9623 11:52:22 -88.619845 0.1431 BFGS: 9624 11:52:22 -89.085379 0.2195 BFGS: 9625 11:52:22 -88.804364 0.1876 BFGS: 9626 11:52:22 -88.341904 0.1718 BFGS: 9627 11:52:22 -88.558104 0.1495 BFGS: 9628 11:52:22 -89.022746 0.1490 BFGS: 9629 11:52:22 -88.791032 0.1229 BFGS: 9630 11:52:22 -88.328973 0.1731 BFGS: 9631 11:52:22 -88.593960 0.1458 BFGS: 9632 11:52:22 -89.058705 0.1531 BFGS: 9633 11:52:22 -88.821527 0.1895 BFGS: 9634 11:52:22 -88.357248 0.1703 BFGS: 9635 11:52:22 -88.572299 0.1481 BFGS: 9636 11:52:22 -89.038823 0.2142 BFGS: 9637 11:52:22 -88.763025 0.1198 BFGS: 9638 11:52:22 -88.399415 0.1659 BFGS: 9639 11:52:22 -88.606428 0.1445 BFGS: 9640 11:52:22 -89.072947 0.1548 BFGS: 9641 11:52:22 -88.832713 0.1276 BFGS: 9642 11:52:22 -88.368835 0.1691 BFGS: 9643 11:52:22 -88.628617 0.1422 BFGS: 9644 11:52:22 -89.095120 0.1573 BFGS: 9645 11:52:22 -88.851491 0.1297 BFGS: 9646 11:52:22 -88.387642 0.1671 BFGS: 9647 11:52:22 -88.644533 0.1405 BFGS: 9648 11:52:22 -89.110951 0.1591 BFGS: 9649 11:52:22 -88.864938 0.1312 BFGS: 9650 11:52:22 -88.401167 0.1657 BFGS: 9651 11:52:22 -88.655953 0.1393 BFGS: 9652 11:52:22 -89.122247 0.1604 BFGS: 9653 11:52:22 -88.874560 0.1323 BFGS: 9654 11:52:22 -88.410913 0.1647 BFGS: 9655 11:52:22 -88.664145 0.1385 BFGS: 9656 11:52:22 -89.130378 0.2247 BFGS: 9657 11:52:22 -88.843255 0.1288 BFGS: 9658 11:52:22 -88.445470 0.1612 BFGS: 9659 11:52:22 -88.663086 0.1386 BFGS: 9660 11:52:22 -89.128980 0.1612 BFGS: 9661 11:52:23 -88.880445 0.1330 BFGS: 9662 11:52:23 -88.417204 0.1640 BFGS: 9663 11:52:23 -88.669282 0.1379 BFGS: 9664 11:52:23 -89.135012 0.1618 BFGS: 9665 11:52:23 -88.885629 0.1335 BFGS: 9666 11:52:23 -88.422561 0.1635 BFGS: 9667 11:52:23 -88.673739 0.1375 BFGS: 9668 11:52:23 -89.139287 0.1623 BFGS: 9669 11:52:23 -88.889416 0.1972 BFGS: 9670 11:52:23 -88.424567 0.1634 BFGS: 9671 11:52:23 -88.631426 0.1419 BFGS: 9672 11:52:23 -89.098298 0.1577 BFGS: 9673 11:52:23 -88.854018 0.1300 BFGS: 9674 11:52:23 -88.389805 0.1669 BFGS: 9675 11:52:23 -88.646545 0.1403 BFGS: 9676 11:52:23 -89.113406 0.2228 BFGS: 9677 11:52:23 -88.828072 0.1271 BFGS: 9678 11:52:23 -88.436556 0.1621 BFGS: 9679 11:52:23 -88.652403 0.1397 BFGS: 9680 11:52:23 -89.118987 0.1600 BFGS: 9681 11:52:23 -88.871670 0.1320 BFGS: 9682 11:52:23 -88.407733 0.1651 BFGS: 9683 11:52:23 -88.661594 0.1388 BFGS: 9684 11:52:23 -89.128041 0.1611 BFGS: 9685 11:52:23 -88.879396 0.1328 BFGS: 9686 11:52:23 -88.415607 0.1642 BFGS: 9687 11:52:23 -88.668191 0.1381 BFGS: 9688 11:52:23 -89.134478 0.1618 BFGS: 9689 11:52:23 -88.885001 0.1967 BFGS: 9690 11:52:23 -88.419413 0.1639 BFGS: 9691 11:52:23 -88.627215 0.1424 BFGS: 9692 11:52:23 -89.094842 0.1573 BFGS: 9693 11:52:23 -88.850752 0.1296 BFGS: 9694 11:52:23 -88.385793 0.1674 BFGS: 9695 11:52:23 -88.643509 0.1407 BFGS: 9696 11:52:23 -89.111053 0.1592 BFGS: 9697 11:52:23 -88.864594 0.1944 BFGS: 9698 11:52:23 -88.397706 0.1662 BFGS: 9699 11:52:23 -88.608761 0.1443 BFGS: 9700 11:52:23 -89.077744 0.1554 BFGS: 9701 11:52:23 -88.835676 0.1279 BFGS: 9702 11:52:23 -88.369369 0.1691 BFGS: 9703 11:52:23 -88.630260 0.1421 BFGS: 9704 11:52:23 -89.099215 0.1578 BFGS: 9705 11:52:23 -88.853849 0.1300 BFGS: 9706 11:52:23 -88.387578 0.1673 BFGS: 9707 11:52:23 -88.645651 0.1405 BFGS: 9708 11:52:23 -89.114595 0.2230 BFGS: 9709 11:52:23 -88.827984 0.1270 BFGS: 9710 11:52:23 -88.435482 0.1623 BFGS: 9711 11:52:23 -88.651970 0.1398 BFGS: 9712 11:52:23 -89.120638 0.1603 BFGS: 9713 11:52:23 -88.872104 0.1320 BFGS: 9714 11:52:23 -88.406109 0.1653 BFGS: 9715 11:52:23 -88.661197 0.1388 BFGS: 9716 11:52:23 -89.129726 0.1613 BFGS: 9717 11:52:23 -88.879854 0.1329 BFGS: 9718 11:52:23 -88.414009 0.1645 BFGS: 9719 11:52:23 -88.667809 0.1381 BFGS: 9720 11:52:23 -89.136174 0.1621 BFGS: 9721 11:52:23 -88.885383 0.1335 BFGS: 9722 11:52:23 -88.419710 0.1639 BFGS: 9723 11:52:23 -88.672552 0.1376 BFGS: 9724 11:52:23 -89.140735 0.1626 BFGS: 9725 11:52:23 -88.889328 0.1340 BFGS: 9726 11:52:23 -88.423842 0.1635 BFGS: 9727 11:52:23 -88.675961 0.1373 BFGS: 9728 11:52:23 -89.143948 0.1629 BFGS: 9729 11:52:23 -88.892138 0.1343 BFGS: 9730 11:52:23 -88.426851 0.1631 BFGS: 9731 11:52:23 -88.678415 0.1370 BFGS: 9732 11:52:23 -89.146197 0.1632 BFGS: 9733 11:52:23 -88.894138 0.1345 BFGS: 9734 11:52:23 -88.429057 0.1629 BFGS: 9735 11:52:23 -88.680186 0.1368 BFGS: 9736 11:52:24 -89.147757 0.1633 BFGS: 9737 11:52:24 -88.895559 0.1347 BFGS: 9738 11:52:24 -88.430689 0.1627 BFGS: 9739 11:52:24 -88.681470 0.1367 BFGS: 9740 11:52:24 -89.148824 0.1635 BFGS: 9741 11:52:24 -88.896565 0.1348 BFGS: 9742 11:52:24 -88.431911 0.1626 BFGS: 9743 11:52:24 -88.682405 0.1366 BFGS: 9744 11:52:24 -89.149540 0.1635 BFGS: 9745 11:52:24 -88.897275 0.1348 BFGS: 9746 11:52:24 -88.432838 0.1625 BFGS: 9747 11:52:24 -88.683089 0.1365 BFGS: 9748 11:52:24 -89.150003 0.1636 BFGS: 9749 11:52:24 -88.897773 0.1349 BFGS: 9750 11:52:24 -88.433556 0.1624 BFGS: 9751 11:52:24 -88.683595 0.1365 BFGS: 9752 11:52:24 -89.150286 0.1636 BFGS: 9753 11:52:24 -88.898119 0.1349 BFGS: 9754 11:52:24 -88.434122 0.1624 BFGS: 9755 11:52:24 -88.683972 0.1364 BFGS: 9756 11:52:24 -89.150525 0.2270 BFGS: 9757 11:52:24 -88.860712 0.1307 BFGS: 9758 11:52:24 -88.455205 0.1602 BFGS: 9759 11:52:24 -88.675134 0.1373 BFGS: 9760 11:52:24 -89.141272 0.1625 BFGS: 9761 11:52:24 -88.890748 0.1341 BFGS: 9762 11:52:24 -88.427284 0.1630 BFGS: 9763 11:52:24 -88.677934 0.1370 BFGS: 9764 11:52:24 -89.143875 0.1628 BFGS: 9765 11:52:24 -88.893127 0.1976 BFGS: 9766 11:52:24 -88.427924 0.1630 BFGS: 9767 11:52:24 -88.634512 0.1416 BFGS: 9768 11:52:24 -89.101733 0.1581 BFGS: 9769 11:52:24 -88.856778 0.1303 BFGS: 9770 11:52:24 -88.392218 0.1667 BFGS: 9771 11:52:24 -88.648766 0.1401 BFGS: 9772 11:52:24 -89.115887 0.1597 BFGS: 9773 11:52:24 -88.868809 0.1316 BFGS: 9774 11:52:24 -88.404340 0.1655 BFGS: 9775 11:52:24 -88.658985 0.1391 BFGS: 9776 11:52:24 -89.125977 0.1608 BFGS: 9777 11:52:24 -88.877488 0.1958 BFGS: 9778 11:52:24 -88.411193 0.1648 BFGS: 9779 11:52:24 -88.620317 0.1431 BFGS: 9780 11:52:24 -89.088675 0.1566 BFGS: 9781 11:52:24 -88.845212 0.1290 BFGS: 9782 11:52:24 -88.379530 0.1681 BFGS: 9783 11:52:24 -88.638565 0.1412 BFGS: 9784 11:52:24 -89.106860 0.1587 BFGS: 9785 11:52:24 -88.860628 0.1307 BFGS: 9786 11:52:24 -88.395005 0.1665 BFGS: 9787 11:52:24 -88.651637 0.1399 BFGS: 9788 11:52:24 -89.119821 0.1602 BFGS: 9789 11:52:24 -88.871648 0.1319 BFGS: 9790 11:52:24 -88.406130 0.1653 BFGS: 9791 11:52:24 -88.660999 0.1389 BFGS: 9792 11:52:24 -89.129047 0.1612 BFGS: 9793 11:52:24 -88.879594 0.1961 BFGS: 9794 11:52:24 -88.412274 0.1648 BFGS: 9795 11:52:24 -88.621677 0.1430 BFGS: 9796 11:52:24 -89.091067 0.1569 BFGS: 9797 11:52:24 -88.846771 0.1291 BFGS: 9798 11:52:24 -88.380071 0.1681 BFGS: 9799 11:52:24 -88.639517 0.1411 BFGS: 9800 11:52:24 -89.108839 0.1589 BFGS: 9801 11:52:24 -88.861915 0.1941 BFGS: 9802 11:52:24 -88.393298 0.1668 BFGS: 9803 11:52:24 -88.605622 0.1447 BFGS: 9804 11:52:24 -89.076361 0.1553 BFGS: 9805 11:52:24 -88.833734 0.1277 BFGS: 9806 11:52:24 -88.365687 0.1696 BFGS: 9807 11:52:24 -88.628006 0.1424 BFGS: 9808 11:52:24 -89.098725 0.1578 BFGS: 9809 11:52:24 -88.852643 0.1298 BFGS: 9810 11:52:24 -88.384629 0.1677 BFGS: 9811 11:52:25 -88.644005 0.1407 BFGS: 9812 11:52:25 -89.114719 0.2230 BFGS: 9813 11:52:25 -88.827223 0.1901 BFGS: 9814 11:52:25 -88.359658 0.1702 BFGS: 9815 11:52:25 -88.575794 0.1478 BFGS: 9816 11:52:25 -89.045543 0.1517 BFGS: 9817 11:52:25 -88.808124 0.1248 BFGS: 9818 11:52:25 -88.341016 0.1721 BFGS: 9819 11:52:25 -88.606682 0.1446 BFGS: 9820 11:52:25 -89.076504 0.1553 BFGS: 9821 11:52:25 -88.834258 0.1277 BFGS: 9822 11:52:25 -88.367118 0.1694 BFGS: 9823 11:52:25 -88.628767 0.1423 BFGS: 9824 11:52:25 -89.098569 0.1578 BFGS: 9825 11:52:25 -88.852922 0.1298 BFGS: 9826 11:52:25 -88.385813 0.1675 BFGS: 9827 11:52:25 -88.644565 0.1406 BFGS: 9828 11:52:25 -89.114278 0.1596 BFGS: 9829 11:52:25 -88.866330 0.1946 BFGS: 9830 11:52:25 -88.397340 0.1664 BFGS: 9831 11:52:25 -88.609300 0.1443 BFGS: 9832 11:52:25 -89.080482 0.2191 BFGS: 9833 11:52:25 -88.796992 0.1235 BFGS: 9834 11:52:25 -88.416856 0.1643 BFGS: 9835 11:52:25 -88.629862 0.1422 BFGS: 9836 11:52:25 -89.100906 0.1581 BFGS: 9837 11:52:25 -88.854413 0.1932 BFGS: 9838 11:52:25 -88.384099 0.1678 BFGS: 9839 11:52:25 -88.598278 0.1455 BFGS: 9840 11:52:25 -89.070828 0.2180 BFGS: 9841 11:52:25 -88.787836 0.1225 BFGS: 9842 11:52:25 -88.410990 0.1650 BFGS: 9843 11:52:25 -88.623167 0.1429 BFGS: 9844 11:52:25 -89.095624 0.1575 BFGS: 9845 11:52:25 -88.849226 0.1294 BFGS: 9846 11:52:25 -88.379494 0.1682 BFGS: 9847 11:52:25 -88.640483 0.1411 BFGS: 9848 11:52:25 -89.112863 0.1595 BFGS: 9849 11:52:25 -88.863824 0.1311 BFGS: 9850 11:52:25 -88.394162 0.1667 BFGS: 9851 11:52:25 -88.652844 0.1398 BFGS: 9852 11:52:25 -89.125103 0.1609 BFGS: 9853 11:52:25 -88.874216 0.1323 BFGS: 9854 11:52:25 -88.404675 0.1656 BFGS: 9855 11:52:25 -88.661666 0.1389 BFGS: 9856 11:52:25 -89.133778 0.1619 BFGS: 9857 11:52:25 -88.881609 0.1331 BFGS: 9858 11:52:25 -88.412225 0.1648 BFGS: 9859 11:52:25 -88.667968 0.1382 BFGS: 9860 11:52:25 -89.139911 0.1626 BFGS: 9861 11:52:25 -88.886867 0.1337 BFGS: 9862 11:52:25 -88.417661 0.1643 BFGS: 9863 11:52:25 -88.672478 0.1377 BFGS: 9864 11:52:25 -89.144232 0.1631 BFGS: 9865 11:52:25 -88.890605 0.1341 BFGS: 9866 11:52:25 -88.421592 0.1638 BFGS: 9867 11:52:25 -88.675709 0.1374 BFGS: 9868 11:52:25 -89.147262 0.1634 BFGS: 9869 11:52:25 -88.893260 0.1344 BFGS: 9870 11:52:25 -88.424450 0.1635 BFGS: 9871 11:52:25 -88.678029 0.1371 BFGS: 9872 11:52:25 -89.149373 0.1637 BFGS: 9873 11:52:25 -88.895225 0.1979 BFGS: 9874 11:52:25 -88.424746 0.1636 BFGS: 9875 11:52:25 -88.633837 0.1418 BFGS: 9876 11:52:25 -89.106378 0.1588 BFGS: 9877 11:52:25 -88.858276 0.1305 BFGS: 9878 11:52:25 -88.388458 0.1673 BFGS: 9879 11:52:25 -88.648104 0.1403 BFGS: 9880 11:52:25 -89.120541 0.1604 BFGS: 9881 11:52:25 -88.870371 0.1950 BFGS: 9882 11:52:25 -88.398725 0.1663 BFGS: 9883 11:52:25 -88.611590 0.1442 BFGS: 9884 11:52:25 -89.085367 0.1564 BFGS: 9885 11:52:25 -88.839977 0.1284 BFGS: 9886 11:52:26 -88.368937 0.1694 BFGS: 9887 11:52:26 -88.632205 0.1420 BFGS: 9888 11:52:26 -89.105936 0.1587 BFGS: 9889 11:52:26 -88.857360 0.1303 BFGS: 9890 11:52:26 -88.386369 0.1676 BFGS: 9891 11:52:26 -88.646901 0.1404 BFGS: 9892 11:52:26 -89.120529 0.1604 BFGS: 9893 11:52:26 -88.869730 0.1317 BFGS: 9894 11:52:26 -88.398833 0.1663 BFGS: 9895 11:52:26 -88.657381 0.1393 BFGS: 9896 11:52:26 -89.130956 0.2250 BFGS: 9897 11:52:26 -88.839758 0.1284 BFGS: 9898 11:52:26 -88.439851 0.1620 BFGS: 9899 11:52:26 -88.659330 0.1391 BFGS: 9900 11:52:26 -89.132588 0.1618 BFGS: 9901 11:52:26 -88.880075 0.1329 BFGS: 9902 11:52:26 -88.409556 0.1652 BFGS: 9903 11:52:26 -88.666254 0.1384 BFGS: 9904 11:52:26 -89.139348 0.1626 BFGS: 9905 11:52:26 -88.885857 0.1336 BFGS: 9906 11:52:26 -88.415511 0.1645 BFGS: 9907 11:52:26 -88.671200 0.1379 BFGS: 9908 11:52:26 -89.144109 0.1631 BFGS: 9909 11:52:26 -88.889964 0.1340 BFGS: 9910 11:52:26 -88.419808 0.1641 BFGS: 9911 11:52:26 -88.674740 0.1375 BFGS: 9912 11:52:26 -89.147450 0.1635 BFGS: 9913 11:52:26 -88.892878 0.1344 BFGS: 9914 11:52:26 -88.422925 0.1638 BFGS: 9915 11:52:26 -88.677278 0.1372 BFGS: 9916 11:52:26 -89.149779 0.1637 BFGS: 9917 11:52:26 -88.894944 0.1346 BFGS: 9918 11:52:26 -88.425200 0.1635 BFGS: 9919 11:52:26 -88.679102 0.1370 BFGS: 9920 11:52:26 -89.151388 0.1639 BFGS: 9921 11:52:26 -88.896405 0.1348 BFGS: 9922 11:52:26 -88.426877 0.1633 BFGS: 9923 11:52:26 -88.680419 0.1369 BFGS: 9924 11:52:26 -89.152484 0.1640 BFGS: 9925 11:52:26 -88.897517 0.1981 BFGS: 9926 11:52:26 -88.426348 0.1634 BFGS: 9927 11:52:26 -88.635515 0.1416 BFGS: 9928 11:52:26 -89.108748 0.1590 BFGS: 9929 11:52:26 -88.859968 0.1306 BFGS: 9930 11:52:26 -88.389466 0.1673 BFGS: 9931 11:52:26 -88.649288 0.1402 BFGS: 9932 11:52:26 -89.122412 0.1606 BFGS: 9933 11:52:26 -88.871557 0.1319 BFGS: 9934 11:52:26 -88.401159 0.1660 BFGS: 9935 11:52:26 -88.659113 0.1392 BFGS: 9936 11:52:26 -89.132098 0.1617 BFGS: 9937 11:52:26 -88.879794 0.1329 BFGS: 9938 11:52:26 -88.409545 0.1652 BFGS: 9939 11:52:26 -88.666123 0.1384 BFGS: 9940 11:52:26 -89.138946 0.1625 BFGS: 9941 11:52:26 -88.885651 0.1335 BFGS: 9942 11:52:26 -88.415573 0.1645 BFGS: 9943 11:52:26 -88.671133 0.1379 BFGS: 9944 11:52:26 -89.143856 0.2264 BFGS: 9945 11:52:26 -88.851487 0.1297 BFGS: 9946 11:52:26 -88.446878 0.1613 BFGS: 9947 11:52:26 -88.667605 0.1382 BFGS: 9948 11:52:26 -89.140042 0.2260 BFGS: 9949 11:52:26 -88.848395 0.1925 BFGS: 9950 11:52:26 -88.379147 0.1683 BFGS: 9951 11:52:26 -88.593520 0.1460 BFGS: 9952 11:52:26 -89.064929 0.1540 BFGS: 9953 11:52:26 -88.823776 0.1265 BFGS: 9954 11:52:26 -88.355046 0.1707 BFGS: 9955 11:52:26 -88.619344 0.1433 BFGS: 9956 11:52:26 -89.090778 0.1569 BFGS: 9957 11:52:26 -88.845600 0.1290 BFGS: 9958 11:52:26 -88.376877 0.1685 BFGS: 9959 11:52:26 -88.637790 0.1414 BFGS: 9960 11:52:26 -89.109162 0.1590 BFGS: 9961 11:52:27 -88.861163 0.1308 BFGS: 9962 11:52:27 -88.392497 0.1669 BFGS: 9963 11:52:27 -88.650967 0.1400 BFGS: 9964 11:52:27 -89.122229 0.1605 BFGS: 9965 11:52:27 -88.872257 0.1320 BFGS: 9966 11:52:27 -88.403697 0.1657 BFGS: 9967 11:52:27 -88.660381 0.1390 BFGS: 9968 11:52:27 -89.131505 0.1616 BFGS: 9969 11:52:27 -88.880155 0.1329 BFGS: 9970 11:52:27 -88.411743 0.1649 BFGS: 9971 11:52:27 -88.667109 0.1383 BFGS: 9972 11:52:27 -89.138073 0.1623 BFGS: 9973 11:52:27 -88.885779 0.1336 BFGS: 9974 11:52:27 -88.417537 0.1642 BFGS: 9975 11:52:27 -88.671926 0.1378 BFGS: 9976 11:52:27 -89.142709 0.1629 BFGS: 9977 11:52:27 -88.889781 0.1340 BFGS: 9978 11:52:27 -88.421725 0.1638 BFGS: 9979 11:52:27 -88.675380 0.1374 BFGS: 9980 11:52:27 -89.145968 0.1632 BFGS: 9981 11:52:27 -88.892627 0.1343 BFGS: 9982 11:52:27 -88.424768 0.1635 BFGS: 9983 11:52:27 -88.677860 0.1371 BFGS: 9984 11:52:27 -89.148245 0.1635 BFGS: 9985 11:52:27 -88.894648 0.1346 BFGS: 9986 11:52:27 -88.426994 0.1632 BFGS: 9987 11:52:27 -88.679646 0.1369 BFGS: 9988 11:52:27 -89.149821 0.1637 BFGS: 9989 11:52:27 -88.896080 0.1347 BFGS: 9990 11:52:27 -88.428637 0.1631 BFGS: 9991 11:52:27 -88.680938 0.1368 BFGS: 9992 11:52:27 -89.150897 0.1638 BFGS: 9993 11:52:27 -88.897092 0.1348 BFGS: 9994 11:52:27 -88.429863 0.1629 BFGS: 9995 11:52:27 -88.681876 0.1367 BFGS: 9996 11:52:27 -89.151616 0.1638 BFGS: 9997 11:52:27 -88.897804 0.1349 BFGS: 9998 11:52:27 -88.430792 0.1628 BFGS: 9999 11:52:27 -88.682561 0.1366 BFGS: 10000 11:52:27 -89.152081 0.1639 Minimization converged after hitting the maximum of 10000 steps. Maximum force component: 2.284761085023939e-05 eV/Angstrom Maximum stress component: 0.001627081563526082 eV/Angstrom^3 ==== Minimized structure obtained from ASE ==== symbols = ['Si', 'Si', 'Si', 'Si'] basis = [[0.33333333 0.66666667 0.62324141] [0.66666666 0.33333334 0.12324141] [0.66666666 0.33333334 0.37675859] [0.33333333 0.66666667 0.87675859]] cellpar = Cell([[5.836605413021728, 1.4065715484987225e-16, -1.2662253510575786e-34], [-2.918302706510864, 5.054648559542583, -7.061855575997128e-34], [-1.350285742419769e-34, -3.078303345622016e-33, 20.70557653336778]]) forces = [[ 2.25303253e-23 -2.22992389e-23 -2.28476109e-05] [ 2.25303253e-23 -2.22992389e-23 -2.28476109e-05] [ 2.25303253e-23 -2.85379873e-39 2.28476109e-05] [ 2.25303253e-23 -2.85379873e-39 2.28476109e-05]] stress = [-1.62708156e-03 -1.62708156e-03 -1.46895282e-03 -2.30595094e-35 -7.86926471e-36 3.14122560e-19] energy per atom = -22.28802023815566 =============================================== Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them. Successfully added property instance for parameter set 0