element(s): ['Si'] AFLOW prototype label: A_tP106_137_a5g4h Parameter names: ['a', 'c/a', 'y2', 'z2', 'y3', 'z3', 'y4', 'z4', 'y5', 'z5', 'y6', 'z6', 'x7', 'y7', 'z7', 'x8', 'y8', 'z8', 'x9', 'y9', 'z9', 'x10', 'y10', 'z10'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['10.1614', '2.3850257', '0.93992864', '0.19609985', '0.87847441', '0.10226691', '0.13030281', '0.77487209', '0.98453855', '0.85341975', '0.13332475', '0.92680675', '0.43292986', '0.065760748', '0.72131569', '0.45643579', '0.87171028', '0.86152967', '0.57092716', '0.9958931', '0.93303081', '0.43052092', '0.13256247', '0.98508065'] model name: Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 ==== Building ASE atoms object with: ==== representative atom symbols = ['Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si', 'Si'] representative atom coordinates = [[0. 0. 0. ] [0. 0.18992864 0.94609985] [0. 0.12847441 0.85226691] [0. 0.38030281 0.52487209] [0. 0.23453855 0.60341975] [0. 0.38332475 0.67680675] [0.18292986 0.31576075 0.47131569] [0.20643579 0.12171028 0.61152967] [0.32092716 0.2458931 0.68303081] [0.18052092 0.38256247 0.73508065]] spacegroup = 137 cell = [[10.1614, 0, 0], [0, 10.1614, 0], [0, 0, 24.2352]] ========================================= Step Time Energy fmax BFGS: 0 17:24:32 1781.622255 21.5383 BFGS: 1 17:24:33 1776.057587 21.4622 BFGS: 2 17:24:34 1770.807156 21.3883 BFGS: 3 17:24:35 1765.790565 21.3176 BFGS: 4 17:24:35 1760.980536 21.2494 BFGS: 5 17:24:36 1756.338156 21.1831 BFGS: 6 17:24:37 1751.834361 21.1188 BFGS: 7 17:24:37 1747.444468 21.0560 BFGS: 8 17:24:38 1743.152137 20.9946 BFGS: 9 17:24:38 1738.942940 20.9342 BFGS: 10 17:24:38 1734.806336 20.8749 BFGS: 11 17:24:38 1730.733463 20.8165 BFGS: 12 17:24:39 1726.716852 20.7590 BFGS: 13 17:24:39 1722.749874 20.7041 BFGS: 14 17:24:39 1718.825454 20.6500 BFGS: 15 17:24:40 1714.938791 20.6044 BFGS: 16 17:24:41 1711.085484 20.5635 BFGS: 17 17:24:41 1707.259241 20.5236 BFGS: 18 17:24:42 1703.455584 20.4843 BFGS: 19 17:24:42 1699.670939 20.4457 BFGS: 20 17:24:43 1695.902191 20.4071 BFGS: 21 17:24:43 1692.146898 20.3688 BFGS: 22 17:24:44 1688.402863 20.3304 BFGS: 23 17:24:45 1684.667949 20.2921 BFGS: 24 17:24:45 1680.940206 20.2537 BFGS: 25 17:24:46 1677.217864 20.2154 BFGS: 26 17:24:47 1673.499337 20.1770 BFGS: 27 17:24:47 1669.783425 20.1396 BFGS: 28 17:24:48 1666.070932 20.1023 BFGS: 29 17:24:48 1662.361062 20.0649 BFGS: 30 17:24:49 1658.652818 20.0281 BFGS: 31 17:24:50 1654.945338 19.9912 BFGS: 32 17:24:51 1651.237955 19.9542 BFGS: 33 17:24:52 1647.530150 19.9172 BFGS: 34 17:24:52 1643.821540 19.8802 BFGS: 35 17:24:53 1640.111839 19.8432 BFGS: 36 17:24:53 1636.400817 19.8064 BFGS: 37 17:24:54 1632.688276 19.7695 BFGS: 38 17:24:55 1628.974240 19.7325 BFGS: 39 17:24:55 1625.258826 19.6954 BFGS: 40 17:24:55 1621.542203 19.6582 BFGS: 41 17:24:56 1617.824546 19.6210 BFGS: 42 17:24:56 1614.105675 19.5837 BFGS: 43 17:24:57 1610.385432 19.5474 BFGS: 44 17:24:57 1606.663696 19.5109 BFGS: 45 17:24:58 1602.940974 19.4744 BFGS: 46 17:24:58 1599.217745 19.4377 BFGS: 47 17:24:59 1595.494464 19.4009 BFGS: 48 17:25:00 1591.771571 19.3639 BFGS: 49 17:25:00 1588.049489 19.3269 BFGS: 50 17:25:01 1584.328630 19.2897 BFGS: 51 17:25:01 1580.609384 19.2525 BFGS: 52 17:25:01 1576.892125 19.2151 BFGS: 53 17:25:02 1573.177209 19.1776 BFGS: 54 17:25:02 1569.464968 19.1401 BFGS: 55 17:25:03 1565.755710 19.1024 BFGS: 56 17:25:03 1562.049722 19.0647 BFGS: 57 17:25:04 1558.347213 19.0275 BFGS: 58 17:25:04 1554.647216 18.9918 BFGS: 59 17:25:05 1550.948648 18.9559 BFGS: 60 17:25:05 1547.251703 18.9200 BFGS: 61 17:25:05 1543.556629 18.8841 BFGS: 62 17:25:06 1539.863989 18.8485 BFGS: 63 17:25:06 1536.176453 18.8129 BFGS: 64 17:25:07 1532.494384 18.7773 BFGS: 65 17:25:07 1528.818004 18.7416 BFGS: 66 17:25:08 1525.147527 18.7058 BFGS: 67 17:25:08 1521.483154 18.6700 BFGS: 68 17:25:09 1517.825065 18.6343 BFGS: 69 17:25:09 1514.173418 18.5991 BFGS: 70 17:25:09 1510.528476 18.5638 BFGS: 71 17:25:10 1506.890383 18.5285 BFGS: 72 17:25:10 1503.259270 18.4931 BFGS: 73 17:25:10 1499.635255 18.4577 BFGS: 74 17:25:11 1496.018443 18.4222 BFGS: 75 17:25:11 1492.408929 18.3866 BFGS: 76 17:25:12 1488.806936 18.3525 BFGS: 77 17:25:12 1485.215127 18.3193 BFGS: 78 17:25:13 1481.634099 18.2860 BFGS: 79 17:25:13 1478.063680 18.2527 BFGS: 80 17:25:13 1474.503694 18.2193 BFGS: 81 17:25:14 1470.953958 18.1859 BFGS: 82 17:25:14 1467.414282 18.1524 BFGS: 83 17:25:14 1463.884475 18.1189 BFGS: 84 17:25:15 1460.364340 18.0853 BFGS: 85 17:25:15 1456.853678 18.0517 BFGS: 86 17:25:15 1453.352288 18.0180 BFGS: 87 17:25:16 1449.859934 17.9848 BFGS: 88 17:25:16 1446.376693 17.9516 BFGS: 89 17:25:16 1442.902324 17.9187 BFGS: 90 17:25:16 1439.436492 17.8860 BFGS: 91 17:25:17 1435.978998 17.8532 BFGS: 92 17:25:17 1432.529647 17.8204 BFGS: 93 17:25:17 1429.088240 17.7876 BFGS: 94 17:25:17 1425.654572 17.7547 BFGS: 95 17:25:18 1422.228439 17.7218 BFGS: 96 17:25:18 1418.809642 17.6888 BFGS: 97 17:25:18 1415.397981 17.6558 BFGS: 98 17:25:18 1411.993262 17.6228 BFGS: 99 17:25:19 1408.595298 17.5896 BFGS: 100 17:25:19 1405.203901 17.5567 BFGS: 101 17:25:19 1401.818653 17.5249 BFGS: 102 17:25:19 1398.437800 17.4931 BFGS: 103 17:25:19 1395.061399 17.4615 BFGS: 104 17:25:20 1391.689565 17.4298 BFGS: 105 17:25:20 1388.322115 17.3981 BFGS: 106 17:25:20 1384.958905 17.3663 BFGS: 107 17:25:20 1381.599824 17.3344 BFGS: 108 17:25:21 1378.244785 17.3025 BFGS: 109 17:25:21 1374.893702 17.2710 BFGS: 110 17:25:21 1371.546440 17.2394 BFGS: 111 17:25:21 1368.202967 17.2078 BFGS: 112 17:25:21 1364.863276 17.1761 BFGS: 113 17:25:22 1361.527382 17.1444 BFGS: 114 17:25:22 1358.195320 17.1127 BFGS: 115 17:25:22 1354.867145 17.0809 BFGS: 116 17:25:22 1351.542929 17.0491 BFGS: 117 17:25:23 1348.222761 17.0173 BFGS: 118 17:25:23 1344.906750 16.9854 BFGS: 119 17:25:23 1341.595018 16.9535 BFGS: 120 17:25:23 1338.287706 16.9215 BFGS: 121 17:25:24 1334.984966 16.8895 BFGS: 122 17:25:24 1331.686968 16.8575 BFGS: 123 17:25:24 1328.393892 16.8255 BFGS: 124 17:25:24 1325.105932 16.7934 BFGS: 125 17:25:24 1321.823291 16.7613 BFGS: 126 17:25:25 1318.546183 16.7292 BFGS: 127 17:25:25 1315.274830 16.6970 BFGS: 128 17:25:25 1312.009460 16.6649 BFGS: 129 17:25:25 1308.750308 16.6327 BFGS: 130 17:25:26 1305.497612 16.6005 BFGS: 131 17:25:26 1302.251613 16.5683 BFGS: 132 17:25:26 1299.012549 16.5362 BFGS: 133 17:25:26 1295.780671 16.5042 BFGS: 134 17:25:27 1292.556305 16.4722 BFGS: 135 17:25:27 1289.339684 16.4402 BFGS: 136 17:25:27 1286.131028 16.4083 BFGS: 137 17:25:27 1282.930552 16.3764 BFGS: 138 17:25:28 1279.738457 16.3444 BFGS: 139 17:25:28 1276.554938 16.3125 BFGS: 140 17:25:28 1273.380176 16.2806 BFGS: 141 17:25:28 1270.214340 16.2487 BFGS: 142 17:25:28 1267.057587 16.2169 BFGS: 143 17:25:29 1263.910059 16.1851 BFGS: 144 17:25:29 1260.771882 16.1532 BFGS: 145 17:25:29 1257.643167 16.1214 BFGS: 146 17:25:29 1254.524010 16.0897 BFGS: 147 17:25:29 1251.414486 16.0579 BFGS: 148 17:25:30 1248.314655 16.0262 BFGS: 149 17:25:30 1245.224558 15.9945 BFGS: 150 17:25:30 1242.144245 15.9631 BFGS: 151 17:25:30 1239.074004 15.9320 BFGS: 152 17:25:31 1236.013990 15.9008 BFGS: 153 17:25:31 1232.964213 15.8698 BFGS: 154 17:25:31 1229.924648 15.8391 BFGS: 155 17:25:31 1226.895385 15.8085 BFGS: 156 17:25:32 1223.876383 15.7780 BFGS: 157 17:25:32 1220.867581 15.7474 BFGS: 158 17:25:32 1217.868858 15.7174 BFGS: 159 17:25:33 1214.879950 15.6874 BFGS: 160 17:25:33 1211.900764 15.6575 BFGS: 161 17:25:33 1208.931203 15.6276 BFGS: 162 17:25:33 1205.971246 15.5979 BFGS: 163 17:25:34 1203.020855 15.5683 BFGS: 164 17:25:34 1200.079848 15.5388 BFGS: 165 17:25:34 1197.148021 15.5097 BFGS: 166 17:25:34 1194.225254 15.4807 BFGS: 167 17:25:34 1191.311342 15.4517 BFGS: 168 17:25:35 1188.406066 15.4227 BFGS: 169 17:25:35 1185.509201 15.3938 BFGS: 170 17:25:35 1182.620509 15.3649 BFGS: 171 17:25:35 1179.739745 15.3361 BFGS: 172 17:25:35 1176.866654 15.3074 BFGS: 173 17:25:35 1174.000990 15.2787 BFGS: 174 17:25:36 1171.142487 15.2500 BFGS: 175 17:25:36 1168.290862 15.2214 BFGS: 176 17:25:36 1165.445827 15.1928 BFGS: 177 17:25:36 1162.607081 15.1641 BFGS: 178 17:25:36 1159.774318 15.1355 BFGS: 179 17:25:37 1156.947228 15.1069 BFGS: 180 17:25:37 1154.125493 15.0783 BFGS: 181 17:25:37 1151.308796 15.0497 BFGS: 182 17:25:37 1148.496813 15.0210 BFGS: 183 17:25:37 1145.689229 14.9924 BFGS: 184 17:25:38 1142.886599 14.9641 BFGS: 185 17:25:38 1140.091143 14.9356 BFGS: 186 17:25:38 1137.302460 14.9071 BFGS: 187 17:25:38 1134.520159 14.8785 BFGS: 188 17:25:38 1131.743853 14.8498 BFGS: 189 17:25:39 1128.973215 14.8214 BFGS: 190 17:25:39 1126.209208 14.7937 BFGS: 191 17:25:39 1123.453010 14.7659 BFGS: 192 17:25:39 1120.704075 14.7380 BFGS: 193 17:25:39 1117.961916 14.7100 BFGS: 194 17:25:40 1115.226036 14.6820 BFGS: 195 17:25:40 1112.495647 14.6540 BFGS: 196 17:25:40 1109.770315 14.6258 BFGS: 197 17:25:40 1107.049713 14.5976 BFGS: 198 17:25:40 1104.333537 14.5693 BFGS: 199 17:25:41 1101.621511 14.5409 BFGS: 200 17:25:41 1098.913383 14.5124 BFGS: 201 17:25:41 1096.208874 14.4845 BFGS: 202 17:25:41 1093.507734 14.4567 BFGS: 203 17:25:42 1090.809196 14.4292 BFGS: 204 17:25:42 1088.112795 14.4015 BFGS: 205 17:25:42 1085.418339 14.3738 BFGS: 206 17:25:42 1082.725401 14.3460 BFGS: 207 17:25:43 1080.033898 14.3180 BFGS: 208 17:25:43 1077.343809 14.2898 BFGS: 209 17:25:43 1074.655145 14.2614 BFGS: 210 17:25:43 1071.967947 14.2329 BFGS: 211 17:25:44 1069.282283 14.2041 BFGS: 212 17:25:44 1066.598104 14.1759 BFGS: 213 17:25:44 1063.913913 14.1477 BFGS: 214 17:25:44 1061.229289 14.1192 BFGS: 215 17:25:45 1058.544502 14.0906 BFGS: 216 17:25:45 1055.859572 14.0617 BFGS: 217 17:25:45 1053.172172 14.0332 BFGS: 218 17:25:45 1050.482018 14.0053 BFGS: 219 17:25:46 1047.785168 13.9779 BFGS: 220 17:25:46 1045.078076 13.9505 BFGS: 221 17:25:46 1042.360075 13.9230 BFGS: 222 17:25:46 1039.630267 13.8953 BFGS: 223 17:25:46 1036.887176 13.8672 BFGS: 224 17:25:47 1034.128124 13.8388 BFGS: 225 17:25:47 1031.346895 13.8103 BFGS: 226 17:25:47 1028.524426 13.7814 BFGS: 227 17:25:47 1025.613739 13.7520 BFGS: 228 17:25:48 1022.589552 13.7221 BFGS: 229 17:25:48 1019.625490 13.6932 BFGS: 230 17:25:48 1016.711550 13.6649 BFGS: 231 17:25:48 1013.842341 13.6371 BFGS: 232 17:25:48 1011.020981 13.6096 BFGS: 233 17:25:49 1008.267369 13.5827 BFGS: 234 17:25:49 1005.414079 13.5534 BFGS: 235 17:25:49 1002.398520 13.5215 BFGS: 236 17:25:50 999.607672 13.4906 BFGS: 237 17:25:50 997.047851 13.4608 BFGS: 238 17:25:50 994.625905 13.4318 BFGS: 239 17:25:50 992.281329 13.4032 BFGS: 240 17:25:51 989.979732 13.3749 BFGS: 241 17:25:51 987.702682 13.3467 BFGS: 242 17:25:51 985.440398 13.3185 BFGS: 243 17:25:51 983.187584 13.2904 BFGS: 244 17:25:52 980.941268 13.2623 BFGS: 245 17:25:52 978.699689 13.2342 BFGS: 246 17:25:52 976.461735 13.2061 BFGS: 247 17:25:52 974.226659 13.1780 BFGS: 248 17:25:52 971.993932 13.1499 BFGS: 249 17:25:53 969.762923 13.1222 BFGS: 250 17:25:53 967.529036 13.0945 BFGS: 251 17:25:53 965.293471 13.0668 BFGS: 252 17:25:53 963.057108 13.0390 BFGS: 253 17:25:53 960.820645 13.0112 BFGS: 254 17:25:53 958.584694 12.9834 BFGS: 255 17:25:53 956.349835 12.9555 BFGS: 256 17:25:54 954.116653 12.9276 BFGS: 257 17:25:54 951.885756 12.8997 BFGS: 258 17:25:54 949.657785 12.8718 BFGS: 259 17:25:54 947.433406 12.8438 BFGS: 260 17:25:54 945.213312 12.8158 BFGS: 261 17:25:54 942.998205 12.7878 BFGS: 262 17:25:54 940.788724 12.7606 BFGS: 263 17:25:54 938.585136 12.7337 BFGS: 264 17:25:55 936.387388 12.7069 BFGS: 265 17:25:55 934.209377 12.6803 BFGS: 266 17:25:55 932.047831 12.6537 BFGS: 267 17:25:55 929.899990 12.6273 BFGS: 268 17:25:55 927.763835 12.6009 BFGS: 269 17:25:56 925.637890 12.5746 BFGS: 270 17:25:56 923.521244 12.5484 BFGS: 271 17:25:56 921.401273 12.5221 BFGS: 272 17:25:56 919.280292 12.4959 BFGS: 273 17:25:56 917.161515 12.4697 BFGS: 274 17:25:57 915.047072 12.4435 BFGS: 275 17:25:57 912.938202 12.4173 BFGS: 276 17:25:57 910.835960 12.3913 BFGS: 277 17:25:57 908.739462 12.3658 BFGS: 278 17:25:57 906.646352 12.3407 BFGS: 279 17:25:57 904.556956 12.3156 BFGS: 280 17:25:57 902.473185 12.2905 BFGS: 281 17:25:58 900.396605 12.2655 BFGS: 282 17:25:58 898.328465 12.2405 BFGS: 283 17:25:58 896.269567 12.2162 BFGS: 284 17:25:58 894.223562 12.1922 BFGS: 285 17:25:58 892.191141 12.1682 BFGS: 286 17:25:58 890.171917 12.1444 BFGS: 287 17:25:58 888.165494 12.1205 BFGS: 288 17:25:58 886.171488 12.0971 BFGS: 289 17:25:59 884.187199 12.0737 BFGS: 290 17:25:59 882.212216 12.0508 BFGS: 291 17:25:59 880.251646 12.0283 BFGS: 292 17:25:59 878.309020 12.0059 BFGS: 293 17:25:59 876.382595 11.9836 BFGS: 294 17:25:59 874.470822 11.9614 BFGS: 295 17:25:59 872.572163 11.9401 BFGS: 296 17:25:59 870.679755 11.9190 BFGS: 297 17:26:00 868.792845 11.8980 BFGS: 298 17:26:00 866.911224 11.8774 BFGS: 299 17:26:00 865.041500 11.8569 BFGS: 300 17:26:00 863.182190 11.8364 BFGS: 301 17:26:00 861.331895 11.8162 BFGS: 302 17:26:00 859.489643 11.7960 BFGS: 303 17:26:00 857.654111 11.7763 BFGS: 304 17:26:00 855.824742 11.7568 BFGS: 305 17:26:00 854.000804 11.7373 BFGS: 306 17:26:00 852.181459 11.7180 BFGS: 307 17:26:01 850.365869 11.6990 BFGS: 308 17:26:01 848.554590 11.6801 BFGS: 309 17:26:01 846.747023 11.6612 BFGS: 310 17:26:01 844.942483 11.6424 BFGS: 311 17:26:01 843.140335 11.6237 BFGS: 312 17:26:01 841.340007 11.6049 BFGS: 313 17:26:01 839.540998 11.5862 BFGS: 314 17:26:02 837.742883 11.5676 BFGS: 315 17:26:02 835.945320 11.5490 BFGS: 316 17:26:02 834.148060 11.5304 BFGS: 317 17:26:02 832.350948 11.5119 BFGS: 318 17:26:02 830.553928 11.4934 BFGS: 319 17:26:02 828.757043 11.4749 BFGS: 320 17:26:02 826.960436 11.4565 BFGS: 321 17:26:02 825.164340 11.4381 BFGS: 322 17:26:03 823.369076 11.4198 BFGS: 323 17:26:03 821.575070 11.4016 BFGS: 324 17:26:03 819.781087 11.3838 BFGS: 325 17:26:03 817.985745 11.3659 BFGS: 326 17:26:03 816.190285 11.3481 BFGS: 327 17:26:03 814.400412 11.3303 BFGS: 328 17:26:03 812.623391 11.3127 BFGS: 329 17:26:03 810.858112 11.2951 BFGS: 330 17:26:03 809.103521 11.2777 BFGS: 331 17:26:04 807.358641 11.2602 BFGS: 332 17:26:04 805.622590 11.2428 BFGS: 333 17:26:04 803.894579 11.2254 BFGS: 334 17:26:04 802.173921 11.2080 BFGS: 335 17:26:04 800.460027 11.1906 BFGS: 336 17:26:04 798.752397 11.1731 BFGS: 337 17:26:04 797.050619 11.1556 BFGS: 338 17:26:04 795.354356 11.1381 BFGS: 339 17:26:05 793.663342 11.1205 BFGS: 340 17:26:05 791.977374 11.1028 BFGS: 341 17:26:05 790.296299 11.0851 BFGS: 342 17:26:05 788.620014 11.0673 BFGS: 343 17:26:05 786.948451 11.0495 BFGS: 344 17:26:05 785.281573 11.0316 BFGS: 345 17:26:05 783.620272 11.0136 BFGS: 346 17:26:05 781.966963 10.9957 BFGS: 347 17:26:06 780.321404 10.9780 BFGS: 348 17:26:06 778.682558 10.9603 BFGS: 349 17:26:06 777.050268 10.9426 BFGS: 350 17:26:06 775.424458 10.9248 BFGS: 351 17:26:06 773.805058 10.9071 BFGS: 352 17:26:06 772.192002 10.8893 BFGS: 353 17:26:06 770.585230 10.8715 BFGS: 354 17:26:07 768.984672 10.8538 BFGS: 355 17:26:07 767.389069 10.8365 BFGS: 356 17:26:07 765.796831 10.8192 BFGS: 357 17:26:07 764.208359 10.8018 BFGS: 358 17:26:07 762.624052 10.7844 BFGS: 359 17:26:07 761.044298 10.7670 BFGS: 360 17:26:07 759.469472 10.7495 BFGS: 361 17:26:07 757.899925 10.7320 BFGS: 362 17:26:08 756.335987 10.7144 BFGS: 363 17:26:08 754.777961 10.6968 BFGS: 364 17:26:08 753.226121 10.6792 BFGS: 365 17:26:08 751.680716 10.6615 BFGS: 366 17:26:08 750.141963 10.6437 BFGS: 367 17:26:08 748.610053 10.6259 BFGS: 368 17:26:08 747.085148 10.6080 BFGS: 369 17:26:08 745.567384 10.5901 BFGS: 370 17:26:09 744.056857 10.5722 BFGS: 371 17:26:09 742.551947 10.5544 BFGS: 372 17:26:09 741.052408 10.5364 BFGS: 373 17:26:09 739.558399 10.5185 BFGS: 374 17:26:09 738.070068 10.5004 BFGS: 375 17:26:09 736.587558 10.4823 BFGS: 376 17:26:09 735.111009 10.4642 BFGS: 377 17:26:10 733.638792 10.4463 BFGS: 378 17:26:10 732.166758 10.4283 BFGS: 379 17:26:10 730.695289 10.4102 BFGS: 380 17:26:10 729.224824 10.3920 BFGS: 381 17:26:10 727.755844 10.3737 BFGS: 382 17:26:10 726.289463 10.3555 BFGS: 383 17:26:10 724.828821 10.3371 BFGS: 384 17:26:10 723.374440 10.3187 BFGS: 385 17:26:11 721.926819 10.3003 BFGS: 386 17:26:11 720.486426 10.2817 BFGS: 387 17:26:11 719.053686 10.2631 BFGS: 388 17:26:11 717.628978 10.2444 BFGS: 389 17:26:11 716.212627 10.2257 BFGS: 390 17:26:11 714.804901 10.2069 BFGS: 391 17:26:11 713.406001 10.1880 BFGS: 392 17:26:12 712.015863 10.1695 BFGS: 393 17:26:12 710.632599 10.1511 BFGS: 394 17:26:12 709.256492 10.1326 BFGS: 395 17:26:12 707.888042 10.1140 BFGS: 396 17:26:12 706.527694 10.0953 BFGS: 397 17:26:12 705.175829 10.0766 BFGS: 398 17:26:12 703.832760 10.0578 BFGS: 399 17:26:12 702.498738 10.0392 BFGS: 400 17:26:13 701.174647 10.0214 BFGS: 401 17:26:13 699.870937 10.0035 BFGS: 402 17:26:13 698.588415 9.9855 BFGS: 403 17:26:13 697.327140 9.9674 BFGS: 404 17:26:13 696.086366 9.9492 BFGS: 405 17:26:13 694.864456 9.9309 BFGS: 406 17:26:13 693.658988 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8.5141 BFGS: 488 17:26:24 593.693661 8.4976 BFGS: 489 17:26:24 592.664427 8.4810 BFGS: 490 17:26:24 591.670866 8.4642 BFGS: 491 17:26:24 590.701312 8.4475 BFGS: 492 17:26:25 589.743345 8.4307 BFGS: 493 17:26:25 588.790637 8.4140 BFGS: 494 17:26:25 587.840593 8.3973 BFGS: 495 17:26:25 586.891855 8.3807 BFGS: 496 17:26:25 585.943563 8.3641 BFGS: 497 17:26:25 584.994936 8.3475 BFGS: 498 17:26:25 584.045394 8.3310 BFGS: 499 17:26:25 583.094504 8.3144 BFGS: 500 17:26:26 582.141948 8.2979 BFGS: 501 17:26:26 581.187502 8.2814 BFGS: 502 17:26:26 580.231020 8.2648 BFGS: 503 17:26:26 579.272427 8.2483 BFGS: 504 17:26:26 578.311706 8.2318 BFGS: 505 17:26:26 577.348891 8.2152 BFGS: 506 17:26:26 576.384059 8.1987 BFGS: 507 17:26:26 575.417326 8.1821 BFGS: 508 17:26:27 574.448834 8.1656 BFGS: 509 17:26:27 573.478753 8.1490 BFGS: 510 17:26:27 572.507269 8.1324 BFGS: 511 17:26:27 571.534582 8.1158 BFGS: 512 17:26:27 570.560858 8.0996 BFGS: 513 17:26:27 569.585652 8.0836 BFGS: 514 17:26:27 568.608906 8.0676 BFGS: 515 17:26:27 567.630966 8.0516 BFGS: 516 17:26:28 566.652170 8.0356 BFGS: 517 17:26:28 565.672839 8.0195 BFGS: 518 17:26:28 564.693283 8.0034 BFGS: 519 17:26:28 563.713789 7.9874 BFGS: 520 17:26:28 562.734621 7.9712 BFGS: 521 17:26:28 561.756020 7.9551 BFGS: 522 17:26:28 560.778195 7.9390 BFGS: 523 17:26:28 559.801331 7.9228 BFGS: 524 17:26:28 558.825450 7.9070 BFGS: 525 17:26:29 557.857195 7.8916 BFGS: 526 17:26:29 556.905532 7.8761 BFGS: 527 17:26:29 555.971493 7.8606 BFGS: 528 17:26:29 555.054560 7.8451 BFGS: 529 17:26:29 554.152250 7.8296 BFGS: 530 17:26:29 553.260454 7.8146 BFGS: 531 17:26:29 552.388414 7.7999 BFGS: 532 17:26:29 551.545185 7.7851 BFGS: 533 17:26:30 550.713441 7.7703 BFGS: 534 17:26:30 549.884316 7.7555 BFGS: 535 17:26:30 549.060222 7.7406 BFGS: 536 17:26:30 548.261304 7.7257 BFGS: 537 17:26:30 547.460947 7.7108 BFGS: 538 17:26:30 546.665847 7.6959 BFGS: 539 17:26:30 545.871765 7.6810 BFGS: 540 17:26:30 545.077410 7.6661 BFGS: 541 17:26:31 544.281665 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7.3575 BFGS: 569 17:26:34 520.401786 7.3494 BFGS: 570 17:26:34 519.473421 7.3411 BFGS: 571 17:26:35 518.536527 7.3325 BFGS: 572 17:26:35 517.590463 7.3238 BFGS: 573 17:26:35 516.634587 7.3148 BFGS: 574 17:26:35 515.668284 7.3056 BFGS: 575 17:26:35 514.691003 7.2962 BFGS: 576 17:26:35 513.702301 7.2865 BFGS: 577 17:26:35 512.701905 7.2766 BFGS: 578 17:26:35 511.689770 7.2665 BFGS: 579 17:26:36 510.666141 7.2561 BFGS: 580 17:26:36 509.631536 7.2460 BFGS: 581 17:26:36 508.580882 7.2361 BFGS: 582 17:26:36 507.510644 7.2258 BFGS: 583 17:26:36 506.427962 7.2151 BFGS: 584 17:26:36 505.349601 7.2043 BFGS: 585 17:26:36 504.281630 7.1934 BFGS: 586 17:26:37 503.221772 7.1824 BFGS: 587 17:26:37 502.167740 7.1713 BFGS: 588 17:26:37 501.117326 7.1601 BFGS: 589 17:26:37 500.068465 7.1488 BFGS: 590 17:26:37 499.019283 7.1373 BFGS: 591 17:26:37 497.968122 7.1258 BFGS: 592 17:26:37 496.913024 7.1149 BFGS: 593 17:26:37 495.849796 7.1038 BFGS: 594 17:26:37 494.780919 7.0927 BFGS: 595 17:26:37 493.726564 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5.8335 BFGS: 704 17:26:49 392.801632 5.8247 BFGS: 705 17:26:49 392.005174 5.8160 BFGS: 706 17:26:49 391.215966 5.8072 BFGS: 707 17:26:49 390.433481 5.7984 BFGS: 708 17:26:49 389.657079 5.7900 BFGS: 709 17:26:49 388.885948 5.7815 BFGS: 710 17:26:49 388.119745 5.7731 BFGS: 711 17:26:50 387.358294 5.7646 BFGS: 712 17:26:50 386.601520 5.7560 BFGS: 713 17:26:50 385.849410 5.7475 BFGS: 714 17:26:50 385.101992 5.7389 BFGS: 715 17:26:50 384.359317 5.7303 BFGS: 716 17:26:50 383.621449 5.7217 BFGS: 717 17:26:50 382.888457 5.7131 BFGS: 718 17:26:50 382.160411 5.7044 BFGS: 719 17:26:50 381.437371 5.6957 BFGS: 720 17:26:50 380.719385 5.6869 BFGS: 721 17:26:51 380.006481 5.6781 BFGS: 722 17:26:51 379.298661 5.6693 BFGS: 723 17:26:51 378.595892 5.6604 BFGS: 724 17:26:51 377.898100 5.6515 BFGS: 725 17:26:51 377.205147 5.6427 BFGS: 726 17:26:51 376.520347 5.6339 BFGS: 727 17:26:51 375.844430 5.6255 BFGS: 728 17:26:51 375.127150 5.6169 BFGS: 729 17:26:51 374.355100 5.6079 BFGS: 730 17:26:51 373.524884 5.5984 BFGS: 731 17:26:52 372.641900 5.5884 BFGS: 732 17:26:52 371.725823 5.5780 BFGS: 733 17:26:52 370.797090 5.5676 BFGS: 734 17:26:52 369.854967 5.5570 BFGS: 735 17:26:52 368.901524 5.5462 BFGS: 736 17:26:52 367.948535 5.5352 BFGS: 737 17:26:52 366.999298 5.5245 BFGS: 738 17:26:52 366.048279 5.5138 BFGS: 739 17:26:52 365.099923 5.5028 BFGS: 740 17:26:53 364.157412 5.4918 BFGS: 741 17:26:53 363.221891 5.4806 BFGS: 742 17:26:53 362.293593 5.4693 BFGS: 743 17:26:53 361.372434 5.4579 BFGS: 744 17:26:53 360.458273 5.4464 BFGS: 745 17:26:53 359.551008 5.4348 BFGS: 746 17:26:53 358.650589 5.4231 BFGS: 747 17:26:53 357.757012 5.4112 BFGS: 748 17:26:53 356.870297 5.3993 BFGS: 749 17:26:53 355.990477 5.3873 BFGS: 750 17:26:54 355.117592 5.3752 BFGS: 751 17:26:54 354.252265 5.3630 BFGS: 752 17:26:54 353.455928 5.3515 BFGS: 753 17:26:54 352.607577 5.3392 BFGS: 754 17:26:54 351.796407 5.3272 BFGS: 755 17:26:54 350.963675 5.3147 BFGS: 756 17:26:54 350.158271 5.3025 BFGS: 757 17:26:54 349.341110 5.2899 BFGS: 758 17:26:54 348.544671 5.2774 BFGS: 759 17:26:55 347.742757 5.2649 BFGS: 760 17:26:55 346.956516 5.2527 BFGS: 761 17:26:55 346.167889 5.2404 BFGS: 762 17:26:55 345.392915 5.2286 BFGS: 763 17:26:55 344.615558 5.2169 BFGS: 764 17:26:55 343.850053 5.2052 BFGS: 765 17:26:55 343.087122 5.1938 BFGS: 766 17:26:55 342.329986 5.1825 BFGS: 767 17:26:55 341.576738 5.1713 BFGS: 768 17:26:56 340.829793 5.1610 BFGS: 769 17:26:56 340.073510 5.1505 BFGS: 770 17:26:56 339.331966 5.1401 BFGS: 771 17:26:56 338.586935 5.1295 BFGS: 772 17:26:56 337.852609 5.1191 BFGS: 773 17:26:56 337.118727 5.1085 BFGS: 774 17:26:56 336.392809 5.0980 BFGS: 775 17:26:56 335.669632 5.0875 BFGS: 776 17:26:57 334.952791 5.0770 BFGS: 777 17:26:57 334.239856 5.0664 BFGS: 778 17:26:57 333.530057 5.0561 BFGS: 779 17:26:57 332.796025 5.0456 BFGS: 780 17:26:57 332.108560 5.0353 BFGS: 781 17:26:57 331.387407 5.0247 BFGS: 782 17:26:57 330.645959 5.0138 BFGS: 783 17:26:57 329.928554 5.0031 BFGS: 784 17:26:57 329.190619 4.9921 BFGS: 785 17:26:58 328.469168 4.9812 BFGS: 786 17:26:58 327.741109 4.9706 BFGS: 787 17:26:58 327.032799 4.9600 BFGS: 788 17:26:58 326.321076 4.9494 BFGS: 789 17:26:58 325.616186 4.9389 BFGS: 790 17:26:58 324.915085 4.9283 BFGS: 791 17:26:58 324.218821 4.9177 BFGS: 792 17:26:58 323.526996 4.9071 BFGS: 793 17:26:58 322.839649 4.8966 BFGS: 794 17:26:58 322.156684 4.8860 BFGS: 795 17:26:59 321.478031 4.8755 BFGS: 796 17:26:59 320.803607 4.8650 BFGS: 797 17:26:59 320.133323 4.8545 BFGS: 798 17:26:59 319.467837 4.8453 BFGS: 799 17:26:59 318.815459 4.8364 BFGS: 800 17:26:59 318.166465 4.8274 BFGS: 801 17:26:59 317.521667 4.8185 BFGS: 802 17:26:59 316.880983 4.8095 BFGS: 803 17:26:59 316.244240 4.8006 BFGS: 804 17:26:59 315.611264 4.7917 BFGS: 805 17:27:00 314.981890 4.7828 BFGS: 806 17:27:00 314.355959 4.7739 BFGS: 807 17:27:00 313.733311 4.7651 BFGS: 808 17:27:00 313.113731 4.7565 BFGS: 809 17:27:00 312.496878 4.7485 BFGS: 810 17:27:00 311.882858 4.7405 BFGS: 811 17:27:00 311.271655 4.7326 BFGS: 812 17:27:00 310.663185 4.7246 BFGS: 813 17:27:00 310.057341 4.7166 BFGS: 814 17:27:00 309.454014 4.7086 BFGS: 815 17:27:01 308.853095 4.7007 BFGS: 816 17:27:01 308.254478 4.6927 BFGS: 817 17:27:01 307.658063 4.6847 BFGS: 818 17:27:01 307.063757 4.6767 BFGS: 819 17:27:01 306.471468 4.6687 BFGS: 820 17:27:01 305.881111 4.6607 BFGS: 821 17:27:01 305.292575 4.6529 BFGS: 822 17:27:01 304.705254 4.6452 BFGS: 823 17:27:01 304.118943 4.6375 BFGS: 824 17:27:01 303.533866 4.6298 BFGS: 825 17:27:02 302.950107 4.6221 BFGS: 826 17:27:02 302.367675 4.6144 BFGS: 827 17:27:02 301.786543 4.6067 BFGS: 828 17:27:02 301.206669 4.5990 BFGS: 829 17:27:02 300.627676 4.5919 BFGS: 830 17:27:02 300.047122 4.5849 BFGS: 831 17:27:02 299.467079 4.5778 BFGS: 832 17:27:02 298.887655 4.5713 BFGS: 833 17:27:02 298.308145 4.5648 BFGS: 834 17:27:03 297.729213 4.5583 BFGS: 835 17:27:03 297.150982 4.5517 BFGS: 836 17:27:03 296.573429 4.5452 BFGS: 837 17:27:03 295.997229 4.5386 BFGS: 838 17:27:03 295.422768 4.5320 BFGS: 839 17:27:03 294.849970 4.5253 BFGS: 840 17:27:03 294.278767 4.5186 BFGS: 841 17:27:03 293.709057 4.5120 BFGS: 842 17:27:03 293.143160 4.5054 BFGS: 843 17:27:03 292.578981 4.4988 BFGS: 844 17:27:04 292.016107 4.4921 BFGS: 845 17:27:04 291.454507 4.4854 BFGS: 846 17:27:04 290.894135 4.4786 BFGS: 847 17:27:04 290.334905 4.4720 BFGS: 848 17:27:04 289.787522 4.4663 BFGS: 849 17:27:04 289.281641 4.4612 BFGS: 850 17:27:04 288.729281 4.4552 BFGS: 851 17:27:04 288.203635 4.4496 BFGS: 852 17:27:04 287.714965 4.4445 BFGS: 853 17:27:05 287.224465 4.4394 BFGS: 854 17:27:05 286.743669 4.4345 BFGS: 855 17:27:05 286.262282 4.4297 BFGS: 856 17:27:05 285.790208 4.4251 BFGS: 857 17:27:05 285.304249 4.4202 BFGS: 858 17:27:05 284.836799 4.4156 BFGS: 859 17:27:05 284.355213 4.4106 BFGS: 860 17:27:05 283.886635 4.4058 BFGS: 861 17:27:05 283.411937 4.4008 BFGS: 862 17:27:06 282.940410 4.3958 BFGS: 863 17:27:06 282.466522 4.3907 BFGS: 864 17:27:06 281.992085 4.3855 BFGS: 865 17:27:06 281.516268 4.3802 BFGS: 866 17:27:06 281.039099 4.3748 BFGS: 867 17:27:06 280.560486 4.3694 BFGS: 868 17:27:06 280.080400 4.3638 BFGS: 869 17:27:06 279.598846 4.3582 BFGS: 870 17:27:06 279.115861 4.3524 BFGS: 871 17:27:06 278.631509 4.3466 BFGS: 872 17:27:07 278.145875 4.3407 BFGS: 873 17:27:07 277.659063 4.3348 BFGS: 874 17:27:07 277.171187 4.3287 BFGS: 875 17:27:07 276.682370 4.3226 BFGS: 876 17:27:07 276.192736 4.3164 BFGS: 877 17:27:07 275.702410 4.3102 BFGS: 878 17:27:07 275.211516 4.3039 BFGS: 879 17:27:07 274.720119 4.2976 BFGS: 880 17:27:07 274.233275 4.2913 BFGS: 881 17:27:07 273.752899 4.2851 BFGS: 882 17:27:08 273.276283 4.2789 BFGS: 883 17:27:08 272.800925 4.2726 BFGS: 884 17:27:08 272.325434 4.2666 BFGS: 885 17:27:08 271.851398 4.2606 BFGS: 886 17:27:08 271.377404 4.2545 BFGS: 887 17:27:08 270.902901 4.2483 BFGS: 888 17:27:08 270.427778 4.2421 BFGS: 889 17:27:08 269.952077 4.2359 BFGS: 890 17:27:08 269.475884 4.2296 BFGS: 891 17:27:09 268.999299 4.2232 BFGS: 892 17:27:09 268.522414 4.2168 BFGS: 893 17:27:09 268.045319 4.2104 BFGS: 894 17:27:09 267.568094 4.2039 BFGS: 895 17:27:09 267.090811 4.1973 BFGS: 896 17:27:09 266.613536 4.1908 BFGS: 897 17:27:09 266.136327 4.1842 BFGS: 898 17:27:09 265.659236 4.1775 BFGS: 899 17:27:10 265.182311 4.1709 BFGS: 900 17:27:10 264.705594 4.1642 BFGS: 901 17:27:10 264.229124 4.1574 BFGS: 902 17:27:10 263.752936 4.1507 BFGS: 903 17:27:10 263.277061 4.1439 BFGS: 904 17:27:10 262.801529 4.1371 BFGS: 905 17:27:10 262.326367 4.1303 BFGS: 906 17:27:11 261.851598 4.1234 BFGS: 907 17:27:11 261.377245 4.1166 BFGS: 908 17:27:11 260.903328 4.1097 BFGS: 909 17:27:11 260.429863 4.1028 BFGS: 910 17:27:11 259.956869 4.0959 BFGS: 911 17:27:11 259.484358 4.0889 BFGS: 912 17:27:11 259.012345 4.0820 BFGS: 913 17:27:11 258.540839 4.0750 BFGS: 914 17:27:12 258.069845 4.0681 BFGS: 915 17:27:12 257.601374 4.0612 BFGS: 916 17:27:12 257.131807 4.0549 BFGS: 917 17:27:12 256.637631 4.0482 BFGS: 918 17:27:12 256.170414 4.0419 BFGS: 919 17:27:12 255.687332 4.0353 BFGS: 920 17:27:12 255.224937 4.0291 BFGS: 921 17:27:12 254.745004 4.0226 BFGS: 922 17:27:13 254.287401 4.0164 BFGS: 923 17:27:13 253.811714 4.0099 BFGS: 924 17:27:13 253.358837 4.0037 BFGS: 925 17:27:13 252.888095 3.9973 BFGS: 926 17:27:13 252.439821 3.9912 BFGS: 927 17:27:13 251.974304 3.9851 BFGS: 928 17:27:13 251.533722 3.9800 BFGS: 929 17:27:13 251.067118 3.9745 BFGS: 930 17:27:14 250.638767 3.9695 BFGS: 931 17:27:14 250.173646 3.9640 BFGS: 932 17:27:14 249.746079 3.9591 BFGS: 933 17:27:14 249.325197 3.9542 BFGS: 934 17:27:14 248.898686 3.9493 BFGS: 935 17:27:14 248.483577 3.9445 BFGS: 936 17:27:14 248.057245 3.9395 BFGS: 937 17:27:14 247.647540 3.9349 BFGS: 938 17:27:15 247.223212 3.9303 BFGS: 939 17:27:15 246.814872 3.9260 BFGS: 940 17:27:15 246.398374 3.9215 BFGS: 941 17:27:15 245.991281 3.9171 BFGS: 942 17:27:15 245.579362 3.9127 BFGS: 943 17:27:15 245.173358 3.9084 BFGS: 944 17:27:15 244.764800 3.9040 BFGS: 945 17:27:15 244.359930 3.8997 BFGS: 946 17:27:15 243.953983 3.8953 BFGS: 947 17:27:16 243.550350 3.8910 BFGS: 948 17:27:16 243.146511 3.8867 BFGS: 949 17:27:16 242.745577 3.8826 BFGS: 950 17:27:16 242.345194 3.8784 BFGS: 951 17:27:16 241.945581 3.8743 BFGS: 952 17:27:16 241.546567 3.8702 BFGS: 953 17:27:16 241.148220 3.8661 BFGS: 954 17:27:17 240.750464 3.8620 BFGS: 955 17:27:17 240.353312 3.8578 BFGS: 956 17:27:17 239.956723 3.8537 BFGS: 957 17:27:17 239.560691 3.8496 BFGS: 958 17:27:17 239.165189 3.8456 BFGS: 959 17:27:17 238.770204 3.8415 BFGS: 960 17:27:17 238.375715 3.8374 BFGS: 961 17:27:18 237.981708 3.8333 BFGS: 962 17:27:18 237.588164 3.8292 BFGS: 963 17:27:18 237.195069 3.8251 BFGS: 964 17:27:18 236.802404 3.8210 BFGS: 965 17:27:18 236.410156 3.8169 BFGS: 966 17:27:18 236.018309 3.8128 BFGS: 967 17:27:18 235.627171 3.8097 BFGS: 968 17:27:18 235.199075 3.8058 BFGS: 969 17:27:19 234.785143 3.8023 BFGS: 970 17:27:19 234.375269 3.7987 BFGS: 971 17:27:19 233.965866 3.7952 BFGS: 972 17:27:19 233.557115 3.7917 BFGS: 973 17:27:19 233.147953 3.7882 BFGS: 974 17:27:19 232.738229 3.7847 BFGS: 975 17:27:19 232.329567 3.7811 BFGS: 976 17:27:19 231.921509 3.7775 BFGS: 977 17:27:20 231.514155 3.7740 BFGS: 978 17:27:20 231.107455 3.7704 BFGS: 979 17:27:20 230.701407 3.7668 BFGS: 980 17:27:20 230.295998 3.7632 BFGS: 981 17:27:20 229.891221 3.7595 BFGS: 982 17:27:20 229.487070 3.7559 BFGS: 983 17:27:20 229.083538 3.7522 BFGS: 984 17:27:20 228.680624 3.7486 BFGS: 985 17:27:20 228.278324 3.7449 BFGS: 986 17:27:20 227.876637 3.7412 BFGS: 987 17:27:21 227.475564 3.7375 BFGS: 988 17:27:21 227.075103 3.7338 BFGS: 989 17:27:21 226.675258 3.7300 BFGS: 990 17:27:21 226.276030 3.7263 BFGS: 991 17:27:21 225.877423 3.7225 BFGS: 992 17:27:21 225.479439 3.7187 BFGS: 993 17:27:21 225.082083 3.7149 BFGS: 994 17:27:21 224.685360 3.7111 BFGS: 995 17:27:21 224.289274 3.7073 BFGS: 996 17:27:21 223.893833 3.7035 BFGS: 997 17:27:21 223.499047 3.6996 BFGS: 998 17:27:22 223.102571 3.6957 BFGS: 999 17:27:22 222.705303 3.6918 BFGS: 1000 17:27:22 222.310356 3.6879 BFGS: 1001 17:27:22 221.914879 3.6839 BFGS: 1002 17:27:22 221.521443 3.6800 BFGS: 1003 17:27:22 221.127684 3.6760 BFGS: 1004 17:27:22 220.735778 3.6720 BFGS: 1005 17:27:22 220.343716 3.6679 BFGS: 1006 17:27:22 219.953370 3.6639 BFGS: 1007 17:27:22 219.563013 3.6598 BFGS: 1008 17:27:22 219.174257 3.6557 BFGS: 1009 17:27:23 218.785626 3.6516 BFGS: 1010 17:27:23 218.398489 3.6475 BFGS: 1011 17:27:23 218.011615 3.6433 BFGS: 1012 17:27:23 217.626126 3.6391 BFGS: 1013 17:27:23 217.241037 3.6349 BFGS: 1014 17:27:23 216.857224 3.6307 BFGS: 1015 17:27:23 216.473946 3.6265 BFGS: 1016 17:27:23 216.091837 3.6222 BFGS: 1017 17:27:23 215.710386 3.6180 BFGS: 1018 17:27:23 215.330010 3.6136 BFGS: 1019 17:27:24 214.950244 3.6094 BFGS: 1020 17:27:24 214.587850 3.6057 BFGS: 1021 17:27:24 214.200447 3.6016 BFGS: 1022 17:27:24 213.809624 3.5974 BFGS: 1023 17:27:24 213.416496 3.5931 BFGS: 1024 17:27:24 213.021529 3.5887 BFGS: 1025 17:27:24 212.625038 3.5843 BFGS: 1026 17:27:24 212.227522 3.5798 BFGS: 1027 17:27:24 211.828912 3.5752 BFGS: 1028 17:27:24 211.428995 3.5707 BFGS: 1029 17:27:25 211.046066 3.5666 BFGS: 1030 17:27:25 210.682760 3.5627 BFGS: 1031 17:27:25 210.290835 3.5583 BFGS: 1032 17:27:25 209.926434 3.5546 BFGS: 1033 17:27:25 209.566130 3.5512 BFGS: 1034 17:27:25 209.201773 3.5476 BFGS: 1035 17:27:25 208.839966 3.5441 BFGS: 1036 17:27:25 208.479547 3.5406 BFGS: 1037 17:27:25 208.129633 3.5375 BFGS: 1038 17:27:25 207.791110 3.5346 BFGS: 1039 17:27:25 207.440226 3.5313 BFGS: 1040 17:27:26 207.107719 3.5284 BFGS: 1041 17:27:26 206.765363 3.5252 BFGS: 1042 17:27:26 206.437314 3.5223 BFGS: 1043 17:27:26 206.102791 3.5192 BFGS: 1044 17:27:26 205.777832 3.5162 BFGS: 1045 17:27:26 205.449628 3.5131 BFGS: 1046 17:27:26 205.126741 3.5101 BFGS: 1047 17:27:26 204.803327 3.5070 BFGS: 1048 17:27:26 204.482266 3.5039 BFGS: 1049 17:27:26 204.162012 3.5008 BFGS: 1050 17:27:26 203.842910 3.4977 BFGS: 1051 17:27:27 203.524702 3.4945 BFGS: 1052 17:27:27 203.207250 3.4913 BFGS: 1053 17:27:27 202.890376 3.4881 BFGS: 1054 17:27:27 202.573880 3.4849 BFGS: 1055 17:27:27 202.257527 3.4816 BFGS: 1056 17:27:27 201.941039 3.4783 BFGS: 1057 17:27:27 201.624080 3.4749 BFGS: 1058 17:27:27 201.306237 3.4715 BFGS: 1059 17:27:27 200.986989 3.4680 BFGS: 1060 17:27:27 200.665668 3.4644 BFGS: 1061 17:27:27 200.341394 3.4608 BFGS: 1062 17:27:28 200.012978 3.4570 BFGS: 1063 17:27:28 199.678777 3.4531 BFGS: 1064 17:27:28 199.336457 3.4490 BFGS: 1065 17:27:28 198.982601 3.4446 BFGS: 1066 17:27:28 198.611982 3.4399 BFGS: 1067 17:27:28 198.216005 3.4348 BFGS: 1068 17:27:28 197.778785 3.4291 BFGS: 1069 17:27:28 197.268509 3.4229 BFGS: 1070 17:27:29 196.716109 3.4155 BFGS: 1071 17:27:29 196.122896 3.4078 BFGS: 1072 17:27:29 195.605330 3.4009 BFGS: 1073 17:27:29 195.070210 3.3941 BFGS: 1074 17:27:29 194.560473 3.3874 BFGS: 1075 17:27:29 194.050271 3.3807 BFGS: 1076 17:27:29 193.546422 3.3741 BFGS: 1077 17:27:29 193.042651 3.3680 BFGS: 1078 17:27:29 192.527285 3.3618 BFGS: 1079 17:27:29 192.015161 3.3557 BFGS: 1080 17:27:30 191.505880 3.3495 BFGS: 1081 17:27:30 190.999000 3.3433 BFGS: 1082 17:27:30 190.494097 3.3372 BFGS: 1083 17:27:30 189.990769 3.3310 BFGS: 1084 17:27:30 189.488637 3.3248 BFGS: 1085 17:27:30 188.987340 3.3186 BFGS: 1086 17:27:30 188.486539 3.3124 BFGS: 1087 17:27:30 187.985908 3.3062 BFGS: 1088 17:27:30 187.485139 3.3000 BFGS: 1089 17:27:31 186.983939 3.2938 BFGS: 1090 17:27:31 186.482029 3.2875 BFGS: 1091 17:27:31 185.979149 3.2813 BFGS: 1092 17:27:31 185.475056 3.2750 BFGS: 1093 17:27:31 184.969524 3.2687 BFGS: 1094 17:27:31 184.462352 3.2624 BFGS: 1095 17:27:31 183.953362 3.2560 BFGS: 1096 17:27:31 183.442404 3.2496 BFGS: 1097 17:27:31 182.929362 3.2432 BFGS: 1098 17:27:31 182.414150 3.2368 BFGS: 1099 17:27:31 181.896727 3.2304 BFGS: 1100 17:27:32 181.377087 3.2239 BFGS: 1101 17:27:32 180.855272 3.2174 BFGS: 1102 17:27:32 180.331366 3.2108 BFGS: 1103 17:27:32 179.805493 3.2043 BFGS: 1104 17:27:32 179.277820 3.1977 BFGS: 1105 17:27:32 178.748547 3.1911 BFGS: 1106 17:27:32 178.225609 3.1845 BFGS: 1107 17:27:32 177.709696 3.1781 BFGS: 1108 17:27:32 177.200227 3.1717 BFGS: 1109 17:27:32 176.696651 3.1654 BFGS: 1110 17:27:33 176.198446 3.1594 BFGS: 1111 17:27:33 175.706803 3.1540 BFGS: 1112 17:27:33 175.225118 3.1490 BFGS: 1113 17:27:33 174.751911 3.1441 BFGS: 1114 17:27:33 174.285510 3.1393 BFGS: 1115 17:27:33 173.824535 3.1344 BFGS: 1116 17:27:33 173.367890 3.1296 BFGS: 1117 17:27:33 172.914716 3.1249 BFGS: 1118 17:27:33 172.464359 3.1201 BFGS: 1119 17:27:33 172.016326 3.1153 BFGS: 1120 17:27:34 171.570247 3.1105 BFGS: 1121 17:27:34 171.125850 3.1057 BFGS: 1122 17:27:34 170.682935 3.1009 BFGS: 1123 17:27:34 170.241355 3.0961 BFGS: 1124 17:27:34 169.801007 3.0913 BFGS: 1125 17:27:34 169.361815 3.0865 BFGS: 1126 17:27:34 168.923728 3.0817 BFGS: 1127 17:27:34 168.486710 3.0768 BFGS: 1128 17:27:35 168.050740 3.0720 BFGS: 1129 17:27:35 167.615803 3.0671 BFGS: 1130 17:27:35 167.181895 3.0623 BFGS: 1131 17:27:35 166.749014 3.0574 BFGS: 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17:27:38 155.474842 2.9241 BFGS: 1159 17:27:38 155.073243 2.9191 BFGS: 1160 17:27:38 154.672775 2.9142 BFGS: 1161 17:27:39 154.273431 2.9092 BFGS: 1162 17:27:39 153.875202 2.9042 BFGS: 1163 17:27:39 153.478078 2.8993 BFGS: 1164 17:27:39 153.082048 2.8943 BFGS: 1165 17:27:39 152.687100 2.8894 BFGS: 1166 17:27:39 152.293221 2.8844 BFGS: 1167 17:27:39 151.900397 2.8794 BFGS: 1168 17:27:39 151.508613 2.8745 BFGS: 1169 17:27:39 151.117854 2.8695 BFGS: 1170 17:27:39 150.728102 2.8645 BFGS: 1171 17:27:40 150.339340 2.8595 BFGS: 1172 17:27:40 149.951550 2.8545 BFGS: 1173 17:27:40 149.564712 2.8496 BFGS: 1174 17:27:40 149.178805 2.8446 BFGS: 1175 17:27:40 148.793810 2.8396 BFGS: 1176 17:27:40 148.409705 2.8346 BFGS: 1177 17:27:40 148.026468 2.8296 BFGS: 1178 17:27:40 147.644075 2.8246 BFGS: 1179 17:27:40 147.262505 2.8196 BFGS: 1180 17:27:41 146.881734 2.8146 BFGS: 1181 17:27:41 146.501737 2.8095 BFGS: 1182 17:27:41 146.122491 2.8045 BFGS: 1183 17:27:41 145.743984 2.7997 BFGS: 1184 17:27:41 145.368405 2.7954 BFGS: 1185 17:27:41 144.994167 2.7912 BFGS: 1186 17:27:41 144.621419 2.7870 BFGS: 1187 17:27:41 144.250117 2.7828 BFGS: 1188 17:27:41 143.880170 2.7786 BFGS: 1189 17:27:42 143.511495 2.7744 BFGS: 1190 17:27:42 143.144015 2.7702 BFGS: 1191 17:27:42 142.777666 2.7660 BFGS: 1192 17:27:42 142.412394 2.7617 BFGS: 1193 17:27:42 142.048148 2.7575 BFGS: 1194 17:27:42 141.684887 2.7533 BFGS: 1195 17:27:42 141.322573 2.7490 BFGS: 1196 17:27:42 140.961171 2.7448 BFGS: 1197 17:27:42 140.600650 2.7417 BFGS: 1198 17:27:43 140.240980 2.7464 BFGS: 1199 17:27:43 139.882137 2.7509 BFGS: 1200 17:27:43 139.524095 2.7553 BFGS: 1201 17:27:43 139.166831 2.7594 BFGS: 1202 17:27:43 138.810325 2.7633 BFGS: 1203 17:27:43 138.454556 2.7671 BFGS: 1204 17:27:43 138.099507 2.7707 BFGS: 1205 17:27:43 137.745158 2.7741 BFGS: 1206 17:27:43 137.391493 2.7774 BFGS: 1207 17:27:43 137.038497 2.7804 BFGS: 1208 17:27:44 136.686153 2.7833 BFGS: 1209 17:27:44 136.334447 2.7861 BFGS: 1210 17:27:44 135.983365 2.7886 BFGS: 1211 17:27:44 135.632893 2.7910 BFGS: 1212 17:27:44 135.283017 2.7933 BFGS: 1213 17:27:44 134.933725 2.7954 BFGS: 1214 17:27:44 134.585005 2.7973 BFGS: 1215 17:27:44 134.236843 2.7990 BFGS: 1216 17:27:44 133.889229 2.8006 BFGS: 1217 17:27:44 133.542151 2.8020 BFGS: 1218 17:27:44 133.195596 2.8033 BFGS: 1219 17:27:45 132.849555 2.8045 BFGS: 1220 17:27:45 132.504016 2.8054 BFGS: 1221 17:27:45 132.158968 2.8062 BFGS: 1222 17:27:45 131.814364 2.8069 BFGS: 1223 17:27:45 131.473003 2.8073 BFGS: 1224 17:27:45 131.137806 2.8073 BFGS: 1225 17:27:45 130.808977 2.8074 BFGS: 1226 17:27:45 130.484377 2.8075 BFGS: 1227 17:27:45 130.162443 2.8074 BFGS: 1228 17:27:45 129.842185 2.8073 BFGS: 1229 17:27:46 129.523026 2.8071 BFGS: 1230 17:27:46 129.204640 2.8068 BFGS: 1231 17:27:46 128.886844 2.8064 BFGS: 1232 17:27:46 128.569526 2.8058 BFGS: 1233 17:27:46 128.252619 2.8051 BFGS: 1234 17:27:46 127.936076 2.8043 BFGS: 1235 17:27:46 127.619862 2.8033 BFGS: 1236 17:27:46 127.303953 2.8022 BFGS: 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17:27:49 118.582556 2.7251 BFGS: 1264 17:27:49 118.231877 2.7204 BFGS: 1265 17:27:49 117.881878 2.7156 BFGS: 1266 17:27:49 117.532643 2.7106 BFGS: 1267 17:27:50 117.184216 2.7054 BFGS: 1268 17:27:50 116.836617 2.7001 BFGS: 1269 17:27:50 116.489845 2.6945 BFGS: 1270 17:27:50 116.143892 2.6888 BFGS: 1271 17:27:50 115.798740 2.6828 BFGS: 1272 17:27:50 115.454365 2.6767 BFGS: 1273 17:27:50 115.110743 2.6704 BFGS: 1274 17:27:50 114.767845 2.6639 BFGS: 1275 17:27:50 114.425642 2.6572 BFGS: 1276 17:27:50 114.084104 2.6504 BFGS: 1277 17:27:51 113.743202 2.6433 BFGS: 1278 17:27:51 113.402905 2.6361 BFGS: 1279 17:27:51 113.063183 2.6287 BFGS: 1280 17:27:51 112.724005 2.6211 BFGS: 1281 17:27:51 112.385342 2.6134 BFGS: 1282 17:27:51 112.047163 2.6054 BFGS: 1283 17:27:51 111.709438 2.5973 BFGS: 1284 17:27:51 111.372137 2.5891 BFGS: 1285 17:27:51 111.035230 2.5806 BFGS: 1286 17:27:52 110.698687 2.5720 BFGS: 1287 17:27:52 110.362477 2.5632 BFGS: 1288 17:27:52 110.026571 2.5543 BFGS: 1289 17:27:52 109.690936 2.5452 BFGS: 1290 17:27:52 109.355544 2.5359 BFGS: 1291 17:27:52 109.020362 2.5265 BFGS: 1292 17:27:52 108.686723 2.5170 BFGS: 1293 17:27:52 108.355133 2.5073 BFGS: 1294 17:27:52 108.025585 2.4976 BFGS: 1295 17:27:52 107.698072 2.4878 BFGS: 1296 17:27:53 107.372586 2.4778 BFGS: 1297 17:27:53 107.049120 2.4678 BFGS: 1298 17:27:53 106.727666 2.4578 BFGS: 1299 17:27:53 106.408215 2.4476 BFGS: 1300 17:27:53 106.090758 2.4374 BFGS: 1301 17:27:53 105.775287 2.4271 BFGS: 1302 17:27:53 105.461792 2.4167 BFGS: 1303 17:27:53 105.150265 2.4063 BFGS: 1304 17:27:53 104.840696 2.3958 BFGS: 1305 17:27:54 104.533075 2.3853 BFGS: 1306 17:27:54 104.227394 2.3747 BFGS: 1307 17:27:54 103.923641 2.3641 BFGS: 1308 17:27:54 103.621807 2.3534 BFGS: 1309 17:27:54 103.321883 2.3427 BFGS: 1310 17:27:54 103.023858 2.3320 BFGS: 1311 17:27:54 102.727722 2.3212 BFGS: 1312 17:27:54 102.433465 2.3104 BFGS: 1313 17:27:54 102.141076 2.2996 BFGS: 1314 17:27:54 101.850545 2.2887 BFGS: 1315 17:27:55 101.561862 2.2778 BFGS: 1316 17:27:55 101.275015 2.2669 BFGS: 1317 17:27:55 100.989994 2.2560 BFGS: 1318 17:27:55 100.706787 2.2451 BFGS: 1319 17:27:55 100.425385 2.2347 BFGS: 1320 17:27:55 100.145774 2.2303 BFGS: 1321 17:27:55 99.867944 2.2259 BFGS: 1322 17:27:55 99.591883 2.2215 BFGS: 1323 17:27:55 99.317579 2.2171 BFGS: 1324 17:27:55 99.045020 2.2127 BFGS: 1325 17:27:56 98.774192 2.2083 BFGS: 1326 17:27:56 98.505083 2.2039 BFGS: 1327 17:27:56 98.237681 2.1995 BFGS: 1328 17:27:56 97.971970 2.1952 BFGS: 1329 17:27:56 97.707937 2.1909 BFGS: 1330 17:27:56 97.445568 2.1865 BFGS: 1331 17:27:56 97.184848 2.1822 BFGS: 1332 17:27:56 96.925760 2.1779 BFGS: 1333 17:27:56 96.668289 2.1736 BFGS: 1334 17:27:57 96.412418 2.1693 BFGS: 1335 17:27:57 96.158130 2.1650 BFGS: 1336 17:27:57 95.905406 2.1607 BFGS: 1337 17:27:57 95.654227 2.1565 BFGS: 1338 17:27:57 95.404575 2.1522 BFGS: 1339 17:27:57 95.156427 2.1480 BFGS: 1340 17:27:57 94.909764 2.1437 BFGS: 1341 17:27:57 94.664562 2.1395 BFGS: 1342 17:27:57 94.420799 2.1353 BFGS: 1343 17:27:57 94.178451 2.1310 BFGS: 1344 17:27:58 93.937491 2.1268 BFGS: 1345 17:27:58 93.697895 2.1226 BFGS: 1346 17:27:58 93.459635 2.1184 BFGS: 1347 17:27:58 93.222682 2.1143 BFGS: 1348 17:27:58 92.987008 2.1101 BFGS: 1349 17:27:58 92.752583 2.1059 BFGS: 1350 17:27:58 92.519374 2.1017 BFGS: 1351 17:27:58 92.287350 2.0976 BFGS: 1352 17:27:58 92.056476 2.0934 BFGS: 1353 17:27:58 91.826720 2.0893 BFGS: 1354 17:27:59 91.598045 2.0851 BFGS: 1355 17:27:59 91.370415 2.0810 BFGS: 1356 17:27:59 91.143793 2.0768 BFGS: 1357 17:27:59 90.918141 2.0727 BFGS: 1358 17:27:59 90.693419 2.0686 BFGS: 1359 17:27:59 90.469588 2.0644 BFGS: 1360 17:27:59 90.246606 2.0603 BFGS: 1361 17:27:59 90.024434 2.0562 BFGS: 1362 17:27:59 89.803028 2.0520 BFGS: 1363 17:28:00 89.582346 2.0479 BFGS: 1364 17:28:00 89.362345 2.0437 BFGS: 1365 17:28:00 89.142982 2.0396 BFGS: 1366 17:28:00 88.924214 2.0354 BFGS: 1367 17:28:00 88.705998 2.0313 BFGS: 1368 17:28:00 88.488290 2.0271 BFGS: 1369 17:28:00 88.271051 2.0230 BFGS: 1370 17:28:00 88.054240 2.0188 BFGS: 1371 17:28:00 87.837820 2.0146 BFGS: 1372 17:28:00 87.621758 2.0105 BFGS: 1373 17:28:01 87.406022 2.0063 BFGS: 1374 17:28:01 87.190590 2.0021 BFGS: 1375 17:28:01 86.975442 1.9979 BFGS: 1376 17:28:01 86.760570 1.9936 BFGS: 1377 17:28:01 86.545972 1.9894 BFGS: 1378 17:28:01 86.331660 1.9852 BFGS: 1379 17:28:01 86.117656 1.9809 BFGS: 1380 17:28:01 85.903996 1.9767 BFGS: 1381 17:28:01 85.690728 1.9724 BFGS: 1382 17:28:01 85.477913 1.9681 BFGS: 1383 17:28:02 85.265625 1.9639 BFGS: 1384 17:28:02 85.053948 1.9596 BFGS: 1385 17:28:02 84.842975 1.9553 BFGS: 1386 17:28:02 84.632806 1.9510 BFGS: 1387 17:28:02 84.423546 1.9467 BFGS: 1388 17:28:02 84.215302 1.9424 BFGS: 1389 17:28:02 84.008185 1.9381 BFGS: 1390 17:28:02 83.802304 1.9339 BFGS: 1391 17:28:02 83.597770 1.9296 BFGS: 1392 17:28:02 83.394694 1.9254 BFGS: 1393 17:28:03 83.193190 1.9211 BFGS: 1394 17:28:03 82.993373 1.9169 BFGS: 1395 17:28:03 82.795365 1.9127 BFGS: 1396 17:28:03 82.599291 1.9085 BFGS: 1397 17:28:03 82.405289 1.9044 BFGS: 1398 17:28:03 82.213503 1.9003 BFGS: 1399 17:28:03 82.024088 1.8963 BFGS: 1400 17:28:03 81.837122 1.8925 BFGS: 1401 17:28:03 81.652750 1.8887 BFGS: 1402 17:28:03 81.471225 1.8850 BFGS: 1403 17:28:04 81.292803 1.8813 BFGS: 1404 17:28:04 81.117717 1.8777 BFGS: 1405 17:28:04 80.946115 1.8742 BFGS: 1406 17:28:04 80.777952 1.8708 BFGS: 1407 17:28:04 80.613010 1.8676 BFGS: 1408 17:28:04 80.451123 1.8644 BFGS: 1409 17:28:04 80.291316 1.8613 BFGS: 1410 17:28:04 80.132827 1.8581 BFGS: 1411 17:28:04 79.975260 1.8550 BFGS: 1412 17:28:05 79.818443 1.8518 BFGS: 1413 17:28:05 79.662292 1.8487 BFGS: 1414 17:28:05 79.506758 1.8455 BFGS: 1415 17:28:05 79.351803 1.8424 BFGS: 1416 17:28:05 79.197397 1.8393 BFGS: 1417 17:28:05 79.043513 1.8361 BFGS: 1418 17:28:06 78.890127 1.8330 BFGS: 1419 17:28:06 78.737216 1.8298 BFGS: 1420 17:28:06 78.584758 1.8267 BFGS: 1421 17:28:06 78.432731 1.8235 BFGS: 1422 17:28:06 78.281116 1.8204 BFGS: 1423 17:28:06 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23.587833 1.0518 BFGS: 1883 17:28:41 23.486567 1.0486 BFGS: 1884 17:28:41 23.385613 1.0453 BFGS: 1885 17:28:41 23.284973 1.0421 BFGS: 1886 17:28:41 23.184648 1.0388 BFGS: 1887 17:28:41 23.084638 1.0356 BFGS: 1888 17:28:41 22.984945 1.0323 BFGS: 1889 17:28:41 22.885569 1.0290 BFGS: 1890 17:28:41 22.786511 1.0258 BFGS: 1891 17:28:41 22.687774 1.0225 BFGS: 1892 17:28:41 22.589357 1.0192 BFGS: 1893 17:28:41 22.491261 1.0159 BFGS: 1894 17:28:41 22.393488 1.0126 BFGS: 1895 17:28:41 22.296039 1.0093 BFGS: 1896 17:28:42 22.198914 1.0060 BFGS: 1897 17:28:42 22.102116 1.0026 BFGS: 1898 17:28:42 22.005644 0.9993 BFGS: 1899 17:28:42 21.909500 0.9960 BFGS: 1900 17:28:42 21.813685 0.9926 BFGS: 1901 17:28:42 21.718200 0.9892 BFGS: 1902 17:28:42 21.623045 0.9859 BFGS: 1903 17:28:42 21.528223 0.9825 BFGS: 1904 17:28:42 21.433735 0.9791 BFGS: 1905 17:28:42 21.339580 0.9757 BFGS: 1906 17:28:42 21.245760 0.9723 BFGS: 1907 17:28:42 21.152277 0.9689 BFGS: 1908 17:28:42 21.059132 0.9655 BFGS: 1909 17:28:42 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7.686574 0.4376 BFGS: 2100 17:28:54 7.631444 0.4357 BFGS: 2101 17:28:54 7.576483 0.4337 BFGS: 2102 17:28:54 7.521693 0.4317 BFGS: 2103 17:28:54 7.467076 0.4298 BFGS: 2104 17:28:54 7.412634 0.4278 BFGS: 2105 17:28:54 7.358370 0.4258 BFGS: 2106 17:28:54 7.304286 0.4238 BFGS: 2107 17:28:54 7.250383 0.4219 BFGS: 2108 17:28:54 7.196666 0.4199 BFGS: 2109 17:28:54 7.143134 0.4179 BFGS: 2110 17:28:54 7.089791 0.4159 BFGS: 2111 17:28:55 7.036639 0.4139 BFGS: 2112 17:28:55 6.983679 0.4119 BFGS: 2113 17:28:55 6.930913 0.4099 BFGS: 2114 17:28:55 6.878344 0.4079 BFGS: 2115 17:28:55 6.825974 0.4059 BFGS: 2116 17:28:55 6.773805 0.4038 BFGS: 2117 17:28:55 6.721838 0.4018 BFGS: 2118 17:28:55 6.670077 0.3998 BFGS: 2119 17:28:55 6.618522 0.3978 BFGS: 2120 17:28:55 6.567175 0.3957 BFGS: 2121 17:28:55 6.516040 0.3937 BFGS: 2122 17:28:55 6.465118 0.3917 BFGS: 2123 17:28:55 6.414401 0.3897 BFGS: 2124 17:28:55 6.363868 0.3876 BFGS: 2125 17:28:55 6.313536 0.3856 BFGS: 2126 17:28:55 6.263418 0.3836 BFGS: 2127 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3.047008 0.2403 BFGS: 2211 17:29:04 3.018543 0.2385 BFGS: 2212 17:29:04 2.990316 0.2366 BFGS: 2213 17:29:04 2.962329 0.2347 BFGS: 2214 17:29:05 2.934584 0.2329 BFGS: 2215 17:29:05 2.907081 0.2310 BFGS: 2216 17:29:05 2.879821 0.2291 BFGS: 2217 17:29:05 2.852806 0.2273 BFGS: 2218 17:29:05 2.826036 0.2262 BFGS: 2219 17:29:05 2.799513 0.2257 BFGS: 2220 17:29:05 2.773237 0.2252 BFGS: 2221 17:29:06 2.747210 0.2247 BFGS: 2222 17:29:06 2.721432 0.2241 BFGS: 2223 17:29:06 2.695903 0.2235 BFGS: 2224 17:29:06 2.670619 0.2229 BFGS: 2225 17:29:06 2.645598 0.2222 BFGS: 2226 17:29:06 2.620808 0.2214 BFGS: 2227 17:29:06 2.596279 0.2205 BFGS: 2228 17:29:06 2.572103 0.2195 BFGS: 2229 17:29:07 2.548346 0.2183 BFGS: 2230 17:29:07 2.524176 0.2176 BFGS: 2231 17:29:07 2.500373 0.2168 BFGS: 2232 17:29:07 2.477020 0.2159 BFGS: 2233 17:29:07 2.454070 0.2148 BFGS: 2234 17:29:07 2.431524 0.2136 BFGS: 2235 17:29:07 2.409368 0.2122 BFGS: 2236 17:29:07 2.387593 0.2108 BFGS: 2237 17:29:08 2.366188 0.2092 BFGS: 2238 17:29:08 2.345131 0.2075 BFGS: 2239 17:29:08 2.324367 0.2057 BFGS: 2240 17:29:08 2.303947 0.2038 BFGS: 2241 17:29:08 2.283840 0.2017 BFGS: 2242 17:29:08 2.264043 0.1996 BFGS: 2243 17:29:08 2.244544 0.1973 BFGS: 2244 17:29:08 2.225333 0.1967 BFGS: 2245 17:29:08 2.206399 0.2005 BFGS: 2246 17:29:08 2.187732 0.2043 BFGS: 2247 17:29:08 2.169322 0.2081 BFGS: 2248 17:29:08 2.151159 0.2119 BFGS: 2249 17:29:09 2.133231 0.2156 BFGS: 2250 17:29:09 2.115529 0.2193 BFGS: 2251 17:29:09 2.098041 0.2229 BFGS: 2252 17:29:09 2.080758 0.2266 BFGS: 2253 17:29:09 2.063670 0.2326 BFGS: 2254 17:29:09 2.046765 0.2411 BFGS: 2255 17:29:09 2.030033 0.2496 BFGS: 2256 17:29:09 2.013464 0.2579 BFGS: 2257 17:29:09 1.997071 0.2661 BFGS: 2258 17:29:09 1.980842 0.2741 BFGS: 2259 17:29:10 1.964740 0.2820 BFGS: 2260 17:29:10 1.948755 0.2898 BFGS: 2261 17:29:10 1.932876 0.2974 BFGS: 2262 17:29:10 1.917093 0.3049 BFGS: 2263 17:29:10 1.901396 0.3122 BFGS: 2264 17:29:10 1.885776 0.3194 BFGS: 2265 17:29:10 1.870224 0.3264 BFGS: 2266 17:29:10 1.854721 0.3332 BFGS: 2267 17:29:11 1.839355 0.3399 BFGS: 2268 17:29:11 1.824088 0.3464 BFGS: 2269 17:29:11 1.808904 0.3527 BFGS: 2270 17:29:11 1.794453 0.3585 BFGS: 2271 17:29:11 1.779648 0.3643 BFGS: 2272 17:29:11 1.765066 0.3700 BFGS: 2273 17:29:11 1.750427 0.3755 BFGS: 2274 17:29:11 1.735863 0.3809 BFGS: 2275 17:29:11 1.721368 0.3861 BFGS: 2276 17:29:11 1.706926 0.3912 BFGS: 2277 17:29:12 1.692527 0.3961 BFGS: 2278 17:29:12 1.678158 0.4009 BFGS: 2279 17:29:12 1.663807 0.4055 BFGS: 2280 17:29:12 1.649464 0.4099 BFGS: 2281 17:29:12 1.635119 0.4142 BFGS: 2282 17:29:12 1.620761 0.4184 BFGS: 2283 17:29:12 1.606382 0.4223 BFGS: 2284 17:29:12 1.591972 0.4261 BFGS: 2285 17:29:12 1.577525 0.4298 BFGS: 2286 17:29:13 1.563031 0.4332 BFGS: 2287 17:29:13 1.548485 0.4365 BFGS: 2288 17:29:13 1.533879 0.4397 BFGS: 2289 17:29:13 1.519209 0.4426 BFGS: 2290 17:29:13 1.504467 0.4454 BFGS: 2291 17:29:13 1.489651 0.4481 BFGS: 2292 17:29:13 1.474756 0.4505 BFGS: 2293 17:29:13 1.459777 0.4528 BFGS: 2294 17:29:13 1.444713 0.4549 BFGS: 2295 17:29:13 1.429560 0.4568 BFGS: 2296 17:29:14 1.414317 0.4585 BFGS: 2297 17:29:14 1.398982 0.4601 BFGS: 2298 17:29:14 1.383559 0.4615 BFGS: 2299 17:29:14 1.368069 0.4626 BFGS: 2300 17:29:14 1.352509 0.4636 BFGS: 2301 17:29:14 1.336876 0.4644 BFGS: 2302 17:29:14 1.321167 0.4650 BFGS: 2303 17:29:14 1.305381 0.4655 BFGS: 2304 17:29:14 1.289514 0.4657 BFGS: 2305 17:29:14 1.273566 0.4657 BFGS: 2306 17:29:14 1.257534 0.4656 BFGS: 2307 17:29:15 1.241419 0.4653 BFGS: 2308 17:29:15 1.225228 0.4647 BFGS: 2309 17:29:15 1.208971 0.4640 BFGS: 2310 17:29:15 1.192652 0.4632 BFGS: 2311 17:29:15 1.176279 0.4621 BFGS: 2312 17:29:15 1.159877 0.4609 BFGS: 2313 17:29:15 1.143453 0.4595 BFGS: 2314 17:29:15 1.127025 0.4579 BFGS: 2315 17:29:15 1.110589 0.4561 BFGS: 2316 17:29:15 1.094145 0.4541 BFGS: 2317 17:29:16 1.078412 0.4520 BFGS: 2318 17:29:16 1.068692 0.4502 BFGS: 2319 17:29:16 1.050910 0.4448 BFGS: 2320 17:29:16 1.036954 0.4399 BFGS: 2321 17:29:16 1.013864 0.4293 BFGS: 2322 17:29:16 0.993966 0.4192 BFGS: 2323 17:29:16 0.963116 0.4000 BFGS: 2324 17:29:16 0.938310 0.3830 BFGS: 2325 17:29:16 0.894294 0.3462 BFGS: 2326 17:29:16 0.867081 0.3214 BFGS: 2327 17:29:16 0.786417 0.3711 BFGS: 2328 17:29:16 0.768137 0.3696 BFGS: 2329 17:29:16 0.741348 0.3555 BFGS: 2330 17:29:16 0.718974 0.3351 BFGS: 2331 17:29:17 0.698374 0.3118 BFGS: 2332 17:29:17 0.678753 0.2862 BFGS: 2333 17:29:17 0.659753 0.2583 BFGS: 2334 17:29:17 0.641095 0.2271 BFGS: 2335 17:29:17 0.622343 0.1906 BFGS: 2336 17:29:17 0.602281 0.1423 BFGS: 2337 17:29:17 0.584016 0.1386 BFGS: 2338 17:29:17 0.565990 0.1468 BFGS: 2339 17:29:17 0.553367 0.1544 BFGS: 2340 17:29:17 0.542098 0.1589 BFGS: 2341 17:29:17 0.531468 0.1620 BFGS: 2342 17:29:17 0.521330 0.1647 BFGS: 2343 17:29:17 0.511577 0.1672 BFGS: 2344 17:29:18 0.502146 0.1695 BFGS: 2345 17:29:18 0.493005 0.1716 BFGS: 2346 17:29:18 0.484101 0.1736 BFGS: 2347 17:29:18 0.475442 0.1755 BFGS: 2348 17:29:18 0.467023 0.1774 BFGS: 2349 17:29:18 0.458836 0.1792 BFGS: 2350 17:29:18 0.450870 0.1810 BFGS: 2351 17:29:18 0.443115 0.1827 BFGS: 2352 17:29:18 0.435473 0.1845 BFGS: 2353 17:29:18 0.427941 0.1864 BFGS: 2354 17:29:18 0.420506 0.1886 BFGS: 2355 17:29:19 0.413160 0.1908 BFGS: 2356 17:29:19 0.405901 0.1930 BFGS: 2357 17:29:19 0.398725 0.1952 BFGS: 2358 17:29:19 0.391630 0.1973 BFGS: 2359 17:29:19 0.384615 0.1994 BFGS: 2360 17:29:19 0.377679 0.2015 BFGS: 2361 17:29:19 0.370821 0.2034 BFGS: 2362 17:29:19 0.364039 0.2053 BFGS: 2363 17:29:19 0.357334 0.2071 BFGS: 2364 17:29:19 0.350703 0.2088 BFGS: 2365 17:29:19 0.344147 0.2104 BFGS: 2366 17:29:19 0.337663 0.2119 BFGS: 2367 17:29:19 0.331253 0.2133 BFGS: 2368 17:29:20 0.324914 0.2146 BFGS: 2369 17:29:20 0.318647 0.2158 BFGS: 2370 17:29:20 0.312450 0.2169 BFGS: 2371 17:29:20 0.306323 0.2179 BFGS: 2372 17:29:20 0.300265 0.2187 BFGS: 2373 17:29:20 0.294276 0.2195 BFGS: 2374 17:29:20 0.288356 0.2201 BFGS: 2375 17:29:20 0.282523 0.2207 BFGS: 2376 17:29:20 0.276783 0.2211 BFGS: 2377 17:29:20 0.271125 0.2213 BFGS: 2378 17:29:20 0.265547 0.2214 BFGS: 2379 17:29:20 0.260048 0.2214 BFGS: 2380 17:29:20 0.254628 0.2212 BFGS: 2381 17:29:21 0.249286 0.2209 BFGS: 2382 17:29:21 0.244023 0.2204 BFGS: 2383 17:29:21 0.238839 0.2197 BFGS: 2384 17:29:21 0.233733 0.2189 BFGS: 2385 17:29:21 0.228705 0.2180 BFGS: 2386 17:29:21 0.223756 0.2168 BFGS: 2387 17:29:21 0.218884 0.2155 BFGS: 2388 17:29:21 0.214089 0.2140 BFGS: 2389 17:29:21 0.209371 0.2124 BFGS: 2390 17:29:21 0.204729 0.2106 BFGS: 2391 17:29:21 0.200150 0.2086 BFGS: 2392 17:29:21 0.195627 0.2063 BFGS: 2393 17:29:21 0.191164 0.2039 BFGS: 2394 17:29:21 0.186761 0.2012 BFGS: 2395 17:29:22 0.182421 0.1984 BFGS: 2396 17:29:22 0.178143 0.1954 BFGS: 2397 17:29:22 0.173930 0.1922 BFGS: 2398 17:29:22 0.169782 0.1889 BFGS: 2399 17:29:22 0.165699 0.1853 BFGS: 2400 17:29:22 0.161689 0.1816 BFGS: 2401 17:29:22 0.157752 0.1778 BFGS: 2402 17:29:22 0.153889 0.1737 BFGS: 2403 17:29:22 0.150099 0.1695 BFGS: 2404 17:29:22 0.146361 0.1650 BFGS: 2405 17:29:22 0.142694 0.1606 BFGS: 2406 17:29:22 0.139112 0.1560 BFGS: 2407 17:29:22 0.135613 0.1515 BFGS: 2408 17:29:23 0.132194 0.1469 BFGS: 2409 17:29:23 0.128855 0.1422 BFGS: 2410 17:29:23 0.125596 0.1376 BFGS: 2411 17:29:23 0.122413 0.1330 BFGS: 2412 17:29:23 0.119308 0.1283 BFGS: 2413 17:29:23 0.116279 0.1236 BFGS: 2414 17:29:23 0.113324 0.1189 BFGS: 2415 17:29:23 0.110444 0.1142 BFGS: 2416 17:29:23 0.107637 0.1095 BFGS: 2417 17:29:23 0.104901 0.1048 BFGS: 2418 17:29:23 0.102237 0.1001 BFGS: 2419 17:29:23 0.099643 0.0953 BFGS: 2420 17:29:23 0.097118 0.0906 BFGS: 2421 17:29:23 0.094662 0.0859 BFGS: 2422 17:29:24 0.092272 0.0811 BFGS: 2423 17:29:24 0.089943 0.0764 BFGS: 2424 17:29:24 0.087698 0.0718 BFGS: 2425 17:29:24 0.085527 0.0701 BFGS: 2426 17:29:24 0.083430 0.0689 BFGS: 2427 17:29:24 0.081403 0.0677 BFGS: 2428 17:29:24 0.079441 0.0664 BFGS: 2429 17:29:24 0.077543 0.0650 BFGS: 2430 17:29:24 0.075704 0.0636 BFGS: 2431 17:29:24 0.073921 0.0621 BFGS: 2432 17:29:24 0.072192 0.0607 BFGS: 2433 17:29:24 0.070514 0.0592 BFGS: 2434 17:29:24 0.068884 0.0577 BFGS: 2435 17:29:25 0.067300 0.0562 BFGS: 2436 17:29:25 0.065766 0.0547 BFGS: 2437 17:29:25 0.064278 0.0533 BFGS: 2438 17:29:25 0.062826 0.0518 BFGS: 2439 17:29:25 0.061410 0.0505 BFGS: 2440 17:29:25 0.060027 0.0491 BFGS: 2441 17:29:25 0.058673 0.0477 BFGS: 2442 17:29:25 0.057345 0.0464 BFGS: 2443 17:29:25 0.056040 0.0450 BFGS: 2444 17:29:25 0.054754 0.0437 BFGS: 2445 17:29:25 0.053486 0.0423 BFGS: 2446 17:29:25 0.052235 0.0410 BFGS: 2447 17:29:25 0.051000 0.0397 BFGS: 2448 17:29:25 0.049780 0.0385 BFGS: 2449 17:29:25 0.048574 0.0375 BFGS: 2450 17:29:26 0.047383 0.0373 BFGS: 2451 17:29:26 0.046205 0.0370 BFGS: 2452 17:29:26 0.045042 0.0370 BFGS: 2453 17:29:26 0.043891 0.0373 BFGS: 2454 17:29:26 0.042756 0.0376 BFGS: 2455 17:29:26 0.041637 0.0379 BFGS: 2456 17:29:26 0.040532 0.0382 BFGS: 2457 17:29:26 0.039442 0.0385 BFGS: 2458 17:29:26 0.038366 0.0387 BFGS: 2459 17:29:26 0.037304 0.0390 BFGS: 2460 17:29:26 0.036256 0.0392 BFGS: 2461 17:29:26 0.035222 0.0394 BFGS: 2462 17:29:26 0.034202 0.0396 BFGS: 2463 17:29:27 0.033195 0.0397 BFGS: 2464 17:29:27 0.032201 0.0399 BFGS: 2465 17:29:27 0.031222 0.0400 BFGS: 2466 17:29:27 0.030256 0.0401 BFGS: 2467 17:29:27 0.029303 0.0402 BFGS: 2468 17:29:27 0.028364 0.0405 BFGS: 2469 17:29:27 0.027439 0.0413 BFGS: 2470 17:29:27 0.026527 0.0422 BFGS: 2471 17:29:27 0.025629 0.0430 BFGS: 2472 17:29:27 0.024745 0.0438 BFGS: 2473 17:29:27 0.023875 0.0445 BFGS: 2474 17:29:27 0.023019 0.0453 BFGS: 2475 17:29:27 0.022177 0.0460 BFGS: 2476 17:29:28 0.021351 0.0466 BFGS: 2477 17:29:28 0.020590 0.0473 BFGS: 2478 17:29:28 0.019886 0.0478 BFGS: 2479 17:29:28 0.019230 0.0483 BFGS: 2480 17:29:28 0.018616 0.0487 BFGS: 2481 17:29:28 0.018034 0.0489 BFGS: 2482 17:29:28 0.017473 0.0489 BFGS: 2483 17:29:28 0.016922 0.0488 BFGS: 2484 17:29:28 0.016364 0.0483 BFGS: 2485 17:29:28 0.015781 0.0475 BFGS: 2486 17:29:28 0.015148 0.0463 BFGS: 2487 17:29:28 0.014441 0.0456 BFGS: 2488 17:29:28 0.013634 0.0479 BFGS: 2489 17:29:29 0.012724 0.0495 BFGS: 2490 17:29:29 0.011649 0.0501 BFGS: 2491 17:29:29 0.010321 0.0492 BFGS: 2492 17:29:29 0.008574 0.0450 BFGS: 2493 17:29:29 0.006905 0.0372 BFGS: 2494 17:29:29 0.005646 0.0286 BFGS: 2495 17:29:29 0.004579 0.0301 BFGS: 2496 17:29:29 0.003811 0.0328 BFGS: 2497 17:29:29 0.003371 0.0310 BFGS: 2498 17:29:29 0.002963 0.0288 BFGS: 2499 17:29:29 0.002626 0.0269 BFGS: 2500 17:29:29 0.002315 0.0249 BFGS: 2501 17:29:29 0.002025 0.0232 BFGS: 2502 17:29:29 0.001759 0.0215 BFGS: 2503 17:29:30 0.001516 0.0198 BFGS: 2504 17:29:30 0.001298 0.0181 BFGS: 2505 17:29:30 0.001102 0.0163 BFGS: 2506 17:29:30 0.000924 0.0145 BFGS: 2507 17:29:30 0.000767 0.0130 BFGS: 2508 17:29:30 0.000633 0.0115 BFGS: 2509 17:29:30 0.000520 0.0100 BFGS: 2510 17:29:30 0.000428 0.0092 BFGS: 2511 17:29:30 0.000353 0.0103 BFGS: 2512 17:29:30 0.000289 0.0110 BFGS: 2513 17:29:30 0.000236 0.0114 BFGS: 2514 17:29:30 0.000189 0.0105 BFGS: 2515 17:29:30 0.000147 0.0094 BFGS: 2516 17:29:30 0.000111 0.0083 BFGS: 2517 17:29:31 0.000079 0.0070 BFGS: 2518 17:29:31 0.000051 0.0057 BFGS: 2519 17:29:31 0.000029 0.0043 BFGS: 2520 17:29:31 0.000013 0.0029 BFGS: 2521 17:29:31 0.000004 0.0015 BFGS: 2522 17:29:31 0.000000 0.0001 BFGS: 2523 17:29:31 0.000000 0.0000 Minimization converged after 2523 steps. Maximum force component: 0.0 eV/Angstrom Maximum stress component: 0.0 eV/Angstrom^3 ==== Minimized structure obtained from ASE ==== symbols = ['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', '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 = [[2.06450427e-32 0.00000000e+00 5.21257618e-32] [5.00000000e-01 5.00000000e-01 5.00000000e-01] [7.70029004e-32 1.35006361e-01 7.90697163e-01] [0.00000000e+00 8.64993639e-01 7.90697163e-01] [3.64993639e-01 5.00000000e-01 2.90697163e-01] [6.35006361e-01 5.00000000e-01 2.90697163e-01] [5.00000000e-01 6.35006361e-01 7.09302837e-01] [5.00000000e-01 3.64993639e-01 7.09302837e-01] [1.35006361e-01 1.51573869e-31 2.09302837e-01] [8.64993639e-01 2.39985825e-32 2.09302837e-01] [0.00000000e+00 3.68551543e-01 6.37665724e-01] [5.67002582e-32 6.31448457e-01 6.37665724e-01] [1.31448457e-01 5.00000000e-01 1.37665724e-01] [8.68551543e-01 5.00000000e-01 1.37665724e-01] [5.00000000e-01 8.68551543e-01 8.62334276e-01] [5.00000000e-01 1.31448457e-01 8.62334276e-01] [3.68551543e-01 1.76676681e-32 3.62334276e-01] [6.31448457e-01 0.00000000e+00 3.62334276e-01] [7.55063608e-32 1.31936354e-01 2.90921990e-01] [1.29575220e-31 8.68063646e-01 2.90921990e-01] [3.68063646e-01 5.00000000e-01 7.90921990e-01] [6.31936354e-01 5.00000000e-01 7.90921990e-01] [5.00000000e-01 6.31936354e-01 2.09078010e-01] [5.00000000e-01 3.68063646e-01 2.09078010e-01] [1.31936354e-01 1.26618288e-32 7.09078010e-01] [8.68063646e-01 0.00000000e+00 7.09078010e-01] [1.79641859e-31 1.84308475e-01 5.25226911e-01] [6.11170027e-32 8.15691525e-01 5.25226911e-01] [3.15691525e-01 5.00000000e-01 2.52269106e-02] [6.84308475e-01 5.00000000e-01 2.52269106e-02] [5.00000000e-01 6.84308475e-01 9.74773089e-01] [5.00000000e-01 3.15691525e-01 9.74773089e-01] [1.84308475e-01 0.00000000e+00 4.74773089e-01] [8.15691525e-01 0.00000000e+00 4.74773089e-01] [5.30174351e-32 3.41010286e-01 8.99765694e-01] [4.88927426e-32 6.58989714e-01 8.99765694e-01] [1.58989714e-01 5.00000000e-01 3.99765694e-01] [8.41010286e-01 5.00000000e-01 3.99765694e-01] [5.00000000e-01 8.41010286e-01 6.00234306e-01] [5.00000000e-01 1.58989714e-01 6.00234306e-01] [3.41010286e-01 2.28207380e-33 1.00234306e-01] [6.58989714e-01 0.00000000e+00 1.00234306e-01] [3.64893814e-01 3.32875596e-01 3.81067351e-01] [6.35106186e-01 6.67124404e-01 3.81067351e-01] [1.67124404e-01 8.64893814e-01 8.81067351e-01] [8.32875596e-01 1.35106186e-01 8.81067351e-01] [1.35106186e-01 8.32875596e-01 1.18932649e-01] [8.64893814e-01 1.67124404e-01 1.18932649e-01] [3.32875596e-01 3.64893814e-01 6.18932649e-01] [6.67124404e-01 6.35106186e-01 6.18932649e-01] [1.35106186e-01 1.67124404e-01 1.18932649e-01] [8.64893814e-01 8.32875596e-01 1.18932649e-01] [3.32875596e-01 6.35106186e-01 6.18932649e-01] [6.67124404e-01 3.64893814e-01 6.18932649e-01] [3.64893814e-01 6.67124404e-01 3.81067351e-01] [6.35106186e-01 3.32875596e-01 3.81067351e-01] [1.67124404e-01 1.35106186e-01 8.81067351e-01] [8.32875596e-01 8.64893814e-01 8.81067351e-01] [3.51950561e-01 1.45127754e-01 7.13087913e-01] [6.48049439e-01 8.54872246e-01 7.13087913e-01] [3.54872246e-01 8.51950561e-01 2.13087913e-01] [6.45127754e-01 1.48049439e-01 2.13087913e-01] [1.48049439e-01 6.45127754e-01 7.86912087e-01] [8.51950561e-01 3.54872246e-01 7.86912087e-01] [1.45127754e-01 3.51950561e-01 2.86912087e-01] [8.54872246e-01 6.48049439e-01 2.86912087e-01] [1.48049439e-01 3.54872246e-01 7.86912087e-01] [8.51950561e-01 6.45127754e-01 7.86912087e-01] [1.45127754e-01 6.48049439e-01 2.86912087e-01] [8.54872246e-01 3.51950561e-01 2.86912087e-01] [3.51950561e-01 8.54872246e-01 7.13087913e-01] [6.48049439e-01 1.45127754e-01 7.13087913e-01] [3.54872246e-01 1.48049439e-01 2.13087913e-01] [6.45127754e-01 8.51950561e-01 2.13087913e-01] [3.18181840e-01 1.32371340e-01 9.99424691e-01] [6.81818160e-01 8.67628660e-01 9.99424691e-01] [3.67628660e-01 8.18181840e-01 4.99424691e-01] [6.32371340e-01 1.81818160e-01 4.99424691e-01] [1.81818160e-01 6.32371340e-01 5.00575309e-01] [8.18181840e-01 3.67628660e-01 5.00575309e-01] [1.32371340e-01 3.18181840e-01 5.75308730e-04] [8.67628660e-01 6.81818160e-01 5.75308730e-04] [1.81818160e-01 3.67628660e-01 5.00575309e-01] [8.18181840e-01 6.32371340e-01 5.00575309e-01] [1.32371340e-01 6.81818160e-01 5.75308730e-04] [8.67628660e-01 3.18181840e-01 5.75308730e-04] [3.18181840e-01 8.67628660e-01 9.99424691e-01] [6.81818160e-01 1.32371340e-01 9.99424691e-01] [3.67628660e-01 1.81818160e-01 4.99424691e-01] [6.32371340e-01 8.18181840e-01 4.99424691e-01] [1.36315850e-01 1.96569346e-01 3.86679854e-01] [8.63684150e-01 8.03430654e-01 3.86679854e-01] [3.03430654e-01 6.36315850e-01 8.86679854e-01] [6.96569346e-01 3.63684150e-01 8.86679854e-01] [3.63684150e-01 6.96569346e-01 1.13320146e-01] [6.36315850e-01 3.03430654e-01 1.13320146e-01] [1.96569346e-01 1.36315850e-01 6.13320146e-01] [8.03430654e-01 8.63684150e-01 6.13320146e-01] [3.63684150e-01 3.03430654e-01 1.13320146e-01] [6.36315850e-01 6.96569346e-01 1.13320146e-01] [1.96569346e-01 8.63684150e-01 6.13320146e-01] [8.03430654e-01 1.36315850e-01 6.13320146e-01] [1.36315850e-01 8.03430654e-01 3.86679854e-01] [8.63684150e-01 1.96569346e-01 3.86679854e-01] [3.03430654e-01 3.63684150e-01 8.86679854e-01] [6.96569346e-01 6.36315850e-01 8.86679854e-01]] cellpar = Cell([[20.929674889214738, -1.0930660874867531e-36, -6.767719954927817e-39], [1.1506600553960684e-37, 20.929674889214738, -1.24824703966423e-17], [-1.7424167745406248e-38, -3.032645591588101e-17, 47.028559652591966]]) forces = [[0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.]] stress = [0. 0. 0. 0. 0. 0.] energy per atom = 0.0 =============================================== Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them. Successfully added property instance for parameter set 0