element(s): ['Si'] AFLOW prototype label: A_cF136_227_aeg Parameter names: ['a', 'x2', 'x3', 'z3'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['14.7362', '0.76473335', '0.31636148', '0.12789779'] model name: Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 ==== Building ASE atoms object with: ==== representative atom symbols = ['Si', 'Si', 'Si'] representative atom coordinates = [[0. 0. 0. ] [0.88973335 0.88973335 0.88973335] [0.44136148 0.44136148 0.25289779]] spacegroup = 227 cell = [[14.7362, 0, 0], [0, 14.7362, 0], [0, 0, 14.7362]] ========================================= Step Time Energy fmax BFGS: 0 14:14:28 482.484180 4.5380 BFGS: 1 14:14:28 479.921451 4.5140 BFGS: 2 14:14:28 477.528605 4.4909 BFGS: 3 14:14:28 475.286946 4.4719 BFGS: 4 14:14:29 473.179822 4.4544 BFGS: 5 14:14:29 471.196741 4.4407 BFGS: 6 14:14:29 469.332973 4.4278 BFGS: 7 14:14:30 467.576583 4.4153 BFGS: 8 14:14:31 465.916517 4.4032 BFGS: 9 14:14:32 464.343042 4.3913 BFGS: 10 14:14:32 462.847573 4.3798 BFGS: 11 14:14:33 461.422517 4.3686 BFGS: 12 14:14:34 460.061144 4.3577 BFGS: 13 14:14:35 458.757478 4.3470 BFGS: 14 14:14:35 457.506198 4.3365 BFGS: 15 14:14:36 456.302562 4.3262 BFGS: 16 14:14:37 455.142328 4.3161 BFGS: 17 14:14:38 454.021701 4.3062 BFGS: 18 14:14:38 452.937274 4.2965 BFGS: 19 14:14:39 451.885983 4.2869 BFGS: 20 14:14:39 450.865072 4.2775 BFGS: 21 14:14:40 449.872048 4.2682 BFGS: 22 14:14:41 448.904662 4.2591 BFGS: 23 14:14:41 447.960873 4.2501 BFGS: 24 14:14:42 447.038828 4.2412 BFGS: 25 14:14:43 446.136845 4.2324 BFGS: 26 14:14:43 445.253388 4.2237 BFGS: 27 14:14:44 444.387057 4.2151 BFGS: 28 14:14:44 443.536570 4.2066 BFGS: 29 14:14:45 442.700753 4.1982 BFGS: 30 14:14:47 441.878529 4.1899 BFGS: 31 14:14:47 441.068908 4.1817 BFGS: 32 14:14:48 440.270975 4.1736 BFGS: 33 14:14:49 439.483890 4.1655 BFGS: 34 14:14:49 438.706874 4.1575 BFGS: 35 14:14:50 437.939205 4.1495 BFGS: 36 14:14:51 437.180216 4.1417 BFGS: 37 14:14:51 436.429284 4.1339 BFGS: 38 14:14:52 435.685833 4.1261 BFGS: 39 14:14:53 434.949324 4.1184 BFGS: 40 14:14:54 434.219255 4.1108 BFGS: 41 14:14:54 433.495155 4.1032 BFGS: 42 14:14:55 432.776586 4.0957 BFGS: 43 14:14:56 432.063136 4.0882 BFGS: 44 14:14:56 431.354418 4.0808 BFGS: 45 14:14:57 430.650070 4.0734 BFGS: 46 14:14:58 429.949749 4.0660 BFGS: 47 14:14:59 429.253137 4.0587 BFGS: 48 14:14:59 428.559928 4.0514 BFGS: 49 14:15:00 427.869840 4.0442 BFGS: 50 14:15:01 427.182602 4.0370 BFGS: 51 14:15:01 426.497961 4.0298 BFGS: 52 14:15:02 425.815677 4.0227 BFGS: 53 14:15:02 425.135525 4.0156 BFGS: 54 14:15:03 424.457290 4.0085 BFGS: 55 14:15:04 423.780771 4.0015 BFGS: 56 14:15:05 423.105778 3.9945 BFGS: 57 14:15:06 422.432131 3.9875 BFGS: 58 14:15:06 421.759662 3.9805 BFGS: 59 14:15:07 421.088100 3.9740 BFGS: 60 14:15:07 420.416954 3.9676 BFGS: 61 14:15:08 419.746059 3.9612 BFGS: 62 14:15:09 419.075300 3.9548 BFGS: 63 14:15:10 418.404571 3.9485 BFGS: 64 14:15:11 417.733773 3.9422 BFGS: 65 14:15:12 417.062815 3.9359 BFGS: 66 14:15:12 416.391618 3.9296 BFGS: 67 14:15:13 415.720106 3.9233 BFGS: 68 14:15:14 415.048215 3.9170 BFGS: 69 14:15:14 414.375886 3.9107 BFGS: 70 14:15:15 413.703070 3.9045 BFGS: 71 14:15:17 413.029722 3.8982 BFGS: 72 14:15:18 412.355808 3.8920 BFGS: 73 14:15:19 411.681296 3.8857 BFGS: 74 14:15:19 411.006163 3.8795 BFGS: 75 14:15:20 410.330393 3.8732 BFGS: 76 14:15:21 409.653973 3.8670 BFGS: 77 14:15:22 408.976896 3.8608 BFGS: 78 14:15:22 408.299159 3.8545 BFGS: 79 14:15:23 407.620766 3.8483 BFGS: 80 14:15:24 406.941722 3.8421 BFGS: 81 14:15:25 406.262036 3.8359 BFGS: 82 14:15:26 405.581721 3.8296 BFGS: 83 14:15:27 404.900791 3.8234 BFGS: 84 14:15:28 404.219265 3.8172 BFGS: 85 14:15:30 403.537161 3.8109 BFGS: 86 14:15:31 402.854502 3.8047 BFGS: 87 14:15:31 402.171309 3.7985 BFGS: 88 14:15:32 401.487608 3.7922 BFGS: 89 14:15:33 400.803423 3.7860 BFGS: 90 14:15:34 400.118782 3.7797 BFGS: 91 14:15:35 399.433712 3.7735 BFGS: 92 14:15:35 398.748242 3.7672 BFGS: 93 14:15:36 398.062402 3.7609 BFGS: 94 14:15:37 397.376223 3.7547 BFGS: 95 14:15:38 396.689738 3.7484 BFGS: 96 14:15:38 396.002979 3.7421 BFGS: 97 14:15:39 395.315980 3.7358 BFGS: 98 14:15:39 394.628777 3.7295 BFGS: 99 14:15:40 393.941407 3.7232 BFGS: 100 14:15:41 393.253906 3.7169 BFGS: 101 14:15:42 392.566314 3.7106 BFGS: 102 14:15:43 391.878670 3.7043 BFGS: 103 14:15:44 391.191016 3.6980 BFGS: 104 14:15:45 390.503393 3.6916 BFGS: 105 14:15:45 389.815845 3.6853 BFGS: 106 14:15:46 389.128417 3.6790 BFGS: 107 14:15:47 388.441153 3.6726 BFGS: 108 14:15:48 387.754101 3.6662 BFGS: 109 14:15:49 387.067308 3.6599 BFGS: 110 14:15:49 386.380823 3.6535 BFGS: 111 14:15:50 385.694694 3.6471 BFGS: 112 14:15:51 385.008974 3.6408 BFGS: 113 14:15:52 384.323712 3.6344 BFGS: 114 14:15:53 383.638962 3.6280 BFGS: 115 14:15:54 382.954775 3.6216 BFGS: 116 14:15:54 382.271206 3.6152 BFGS: 117 14:15:55 381.588307 3.6088 BFGS: 118 14:15:56 380.906135 3.6024 BFGS: 119 14:15:57 380.224744 3.5960 BFGS: 120 14:15:58 379.544189 3.5895 BFGS: 121 14:15:59 378.864525 3.5831 BFGS: 122 14:16:00 378.185809 3.5767 BFGS: 123 14:16:01 377.508096 3.5703 BFGS: 124 14:16:01 376.831442 3.5638 BFGS: 125 14:16:02 376.155903 3.5574 BFGS: 126 14:16:03 375.481534 3.5509 BFGS: 127 14:16:04 374.808391 3.5445 BFGS: 128 14:16:05 374.136528 3.5380 BFGS: 129 14:16:06 373.466000 3.5316 BFGS: 130 14:16:07 372.796847 3.5253 BFGS: 131 14:16:07 372.129077 3.5192 BFGS: 132 14:16:08 371.462738 3.5130 BFGS: 133 14:16:09 370.797882 3.5069 BFGS: 134 14:16:10 370.134560 3.5007 BFGS: 135 14:16:11 369.472821 3.4945 BFGS: 136 14:16:12 368.812714 3.4884 BFGS: 137 14:16:13 368.154287 3.4822 BFGS: 138 14:16:14 367.497585 3.4761 BFGS: 139 14:16:14 366.842653 3.4699 BFGS: 140 14:16:15 366.189537 3.4638 BFGS: 141 14:16:16 365.538277 3.4576 BFGS: 142 14:16:17 364.888915 3.4514 BFGS: 143 14:16:18 364.241490 3.4453 BFGS: 144 14:16:19 363.596041 3.4391 BFGS: 145 14:16:20 362.952603 3.4330 BFGS: 146 14:16:21 362.311212 3.4269 BFGS: 147 14:16:22 361.671901 3.4207 BFGS: 148 14:16:22 361.034700 3.4146 BFGS: 149 14:16:23 360.399641 3.4084 BFGS: 150 14:16:24 359.766751 3.4023 BFGS: 151 14:16:24 359.136056 3.3962 BFGS: 152 14:16:25 358.507580 3.3901 BFGS: 153 14:16:26 357.881269 3.3844 BFGS: 154 14:16:26 357.256801 3.3792 BFGS: 155 14:16:27 356.634227 3.3742 BFGS: 156 14:16:28 356.013622 3.3692 BFGS: 157 14:16:29 355.395014 3.3642 BFGS: 158 14:16:29 354.778428 3.3592 BFGS: 159 14:16:30 354.163887 3.3542 BFGS: 160 14:16:31 353.551411 3.3491 BFGS: 161 14:16:32 352.941022 3.3441 BFGS: 162 14:16:33 352.332735 3.3391 BFGS: 163 14:16:33 351.726569 3.3340 BFGS: 164 14:16:34 351.122536 3.3290 BFGS: 165 14:16:35 350.520650 3.3240 BFGS: 166 14:16:36 349.920922 3.3189 BFGS: 167 14:16:37 349.323362 3.3138 BFGS: 168 14:16:38 348.727976 3.3088 BFGS: 169 14:16:38 348.134772 3.3037 BFGS: 170 14:16:39 347.543755 3.2987 BFGS: 171 14:16:40 346.954927 3.2936 BFGS: 172 14:16:41 346.368291 3.2885 BFGS: 173 14:16:42 345.783847 3.2834 BFGS: 174 14:16:43 345.201594 3.2783 BFGS: 175 14:16:45 344.621531 3.2733 BFGS: 176 14:16:46 344.043654 3.2682 BFGS: 177 14:16:47 343.467959 3.2631 BFGS: 178 14:16:47 342.894439 3.2580 BFGS: 179 14:16:48 342.323089 3.2529 BFGS: 180 14:16:50 341.753900 3.2478 BFGS: 181 14:16:51 341.186863 3.2427 BFGS: 182 14:16:52 340.621970 3.2376 BFGS: 183 14:16:53 340.059209 3.2325 BFGS: 184 14:16:53 339.498570 3.2274 BFGS: 185 14:16:53 338.940039 3.2223 BFGS: 186 14:16:54 338.383604 3.2172 BFGS: 187 14:16:54 337.829252 3.2121 BFGS: 188 14:16:54 337.276968 3.2070 BFGS: 189 14:16:55 336.726737 3.2019 BFGS: 190 14:16:56 336.178544 3.1968 BFGS: 191 14:16:57 335.632373 3.1916 BFGS: 192 14:16:57 335.088208 3.1865 BFGS: 193 14:16:58 334.546032 3.1814 BFGS: 194 14:16:59 334.005828 3.1763 BFGS: 195 14:17:00 333.467578 3.1712 BFGS: 196 14:17:00 332.931265 3.1661 BFGS: 197 14:17:01 332.396871 3.1610 BFGS: 198 14:17:02 331.864377 3.1559 BFGS: 199 14:17:03 331.333765 3.1508 BFGS: 200 14:17:03 330.805017 3.1457 BFGS: 201 14:17:04 330.278111 3.1406 BFGS: 202 14:17:05 329.753031 3.1357 BFGS: 203 14:17:05 329.229766 3.1308 BFGS: 204 14:17:06 328.708297 3.1259 BFGS: 205 14:17:07 328.188603 3.1209 BFGS: 206 14:17:08 327.670665 3.1160 BFGS: 207 14:17:09 327.154465 3.1111 BFGS: 208 14:17:10 326.639982 3.1062 BFGS: 209 14:17:10 326.127198 3.1013 BFGS: 210 14:17:11 325.616093 3.0964 BFGS: 211 14:17:12 325.106649 3.0914 BFGS: 212 14:17:13 324.598846 3.0865 BFGS: 213 14:17:13 324.092666 3.0816 BFGS: 214 14:17:15 323.588090 3.0767 BFGS: 215 14:17:16 323.085101 3.0718 BFGS: 216 14:17:16 322.583679 3.0669 BFGS: 217 14:17:17 322.083806 3.0620 BFGS: 218 14:17:18 321.585465 3.0571 BFGS: 219 14:17:19 321.088639 3.0522 BFGS: 220 14:17:20 320.593309 3.0473 BFGS: 221 14:17:21 320.099452 3.0426 BFGS: 222 14:17:21 319.607003 3.0379 BFGS: 223 14:17:22 319.115933 3.0333 BFGS: 224 14:17:23 318.626226 3.0287 BFGS: 225 14:17:24 318.137868 3.0240 BFGS: 226 14:17:25 317.650843 3.0194 BFGS: 227 14:17:26 317.165137 3.0148 BFGS: 228 14:17:26 316.680736 3.0102 BFGS: 229 14:17:27 316.197626 3.0056 BFGS: 230 14:17:28 315.715792 3.0009 BFGS: 231 14:17:29 315.235220 2.9963 BFGS: 232 14:17:29 314.755898 2.9917 BFGS: 233 14:17:30 314.277812 2.9871 BFGS: 234 14:17:30 313.800949 2.9825 BFGS: 235 14:17:32 313.325296 2.9779 BFGS: 236 14:17:32 312.850841 2.9733 BFGS: 237 14:17:33 312.377571 2.9687 BFGS: 238 14:17:34 311.905474 2.9641 BFGS: 239 14:17:34 311.434539 2.9595 BFGS: 240 14:17:35 310.964753 2.9550 BFGS: 241 14:17:36 310.496105 2.9504 BFGS: 242 14:17:36 310.028584 2.9458 BFGS: 243 14:17:37 309.562180 2.9412 BFGS: 244 14:17:38 309.096881 2.9367 BFGS: 245 14:17:38 308.632676 2.9321 BFGS: 246 14:17:39 308.169557 2.9275 BFGS: 247 14:17:40 307.707512 2.9230 BFGS: 248 14:17:40 307.246532 2.9184 BFGS: 249 14:17:41 306.786607 2.9139 BFGS: 250 14:17:42 306.327729 2.9093 BFGS: 251 14:17:42 305.869887 2.9048 BFGS: 252 14:17:43 305.413072 2.9002 BFGS: 253 14:17:44 304.957277 2.8957 BFGS: 254 14:17:44 304.502493 2.8912 BFGS: 255 14:17:45 304.048710 2.8866 BFGS: 256 14:17:46 303.595922 2.8821 BFGS: 257 14:17:47 303.144120 2.8776 BFGS: 258 14:17:48 302.693296 2.8731 BFGS: 259 14:17:49 302.243443 2.8686 BFGS: 260 14:17:50 301.794554 2.8641 BFGS: 261 14:17:50 301.346621 2.8596 BFGS: 262 14:17:51 300.899638 2.8551 BFGS: 263 14:17:52 300.453596 2.8506 BFGS: 264 14:17:53 300.008491 2.8461 BFGS: 265 14:17:53 299.564315 2.8416 BFGS: 266 14:17:54 299.121062 2.8371 BFGS: 267 14:17:55 298.678725 2.8326 BFGS: 268 14:17:55 298.237300 2.8282 BFGS: 269 14:17:56 297.796779 2.8237 BFGS: 270 14:17:57 297.357157 2.8192 BFGS: 271 14:17:57 296.918429 2.8148 BFGS: 272 14:17:58 296.480589 2.8103 BFGS: 273 14:17:59 296.043632 2.8058 BFGS: 274 14:18:00 295.607553 2.8014 BFGS: 275 14:18:01 295.172346 2.7970 BFGS: 276 14:18:02 294.738007 2.7925 BFGS: 277 14:18:02 294.304531 2.7881 BFGS: 278 14:18:03 293.871913 2.7837 BFGS: 279 14:18:04 293.440149 2.7792 BFGS: 280 14:18:05 293.009235 2.7748 BFGS: 281 14:18:06 292.579165 2.7704 BFGS: 282 14:18:07 292.149936 2.7660 BFGS: 283 14:18:07 291.721543 2.7616 BFGS: 284 14:18:08 291.293984 2.7572 BFGS: 285 14:18:09 290.867253 2.7528 BFGS: 286 14:18:10 290.441347 2.7484 BFGS: 287 14:18:11 290.016262 2.7440 BFGS: 288 14:18:12 289.591995 2.7396 BFGS: 289 14:18:13 289.168543 2.7352 BFGS: 290 14:18:14 288.745900 2.7308 BFGS: 291 14:18:14 288.324066 2.7265 BFGS: 292 14:18:15 287.903035 2.7221 BFGS: 293 14:18:16 287.482805 2.7177 BFGS: 294 14:18:17 287.063373 2.7134 BFGS: 295 14:18:18 286.644735 2.7090 BFGS: 296 14:18:19 286.226890 2.7047 BFGS: 297 14:18:20 285.809833 2.7003 BFGS: 298 14:18:20 285.393562 2.6960 BFGS: 299 14:18:21 284.978074 2.6917 BFGS: 300 14:18:22 284.563367 2.6873 BFGS: 301 14:18:23 284.149438 2.6830 BFGS: 302 14:18:24 283.736284 2.6787 BFGS: 303 14:18:24 283.323903 2.6744 BFGS: 304 14:18:25 282.912292 2.6700 BFGS: 305 14:18:26 282.501450 2.6657 BFGS: 306 14:18:27 282.091372 2.6614 BFGS: 307 14:18:28 281.682057 2.6572 BFGS: 308 14:18:28 281.273461 2.6531 BFGS: 309 14:18:29 280.865543 2.6490 BFGS: 310 14:18:31 280.458298 2.6450 BFGS: 311 14:18:32 280.051726 2.6409 BFGS: 312 14:18:33 279.645824 2.6368 BFGS: 313 14:18:34 279.240589 2.6328 BFGS: 314 14:18:35 278.836020 2.6287 BFGS: 315 14:18:36 278.432115 2.6247 BFGS: 316 14:18:37 278.028872 2.6206 BFGS: 317 14:18:37 277.626288 2.6166 BFGS: 318 14:18:38 277.224363 2.6125 BFGS: 319 14:18:39 276.823094 2.6085 BFGS: 320 14:18:40 276.422479 2.6045 BFGS: 321 14:18:40 276.022517 2.6005 BFGS: 322 14:18:41 275.623206 2.5965 BFGS: 323 14:18:42 275.224544 2.5925 BFGS: 324 14:18:42 274.826530 2.5885 BFGS: 325 14:18:43 274.429162 2.5845 BFGS: 326 14:18:44 274.032439 2.5805 BFGS: 327 14:18:44 273.636359 2.5765 BFGS: 328 14:18:45 273.240920 2.5725 BFGS: 329 14:18:46 272.846122 2.5685 BFGS: 330 14:18:47 272.451963 2.5646 BFGS: 331 14:18:47 272.058442 2.5606 BFGS: 332 14:18:48 271.665557 2.5566 BFGS: 333 14:18:49 271.273306 2.5527 BFGS: 334 14:18:49 270.881690 2.5487 BFGS: 335 14:18:50 270.490705 2.5448 BFGS: 336 14:18:51 270.100353 2.5409 BFGS: 337 14:18:51 269.710630 2.5369 BFGS: 338 14:18:53 269.321536 2.5330 BFGS: 339 14:18:53 268.933070 2.5291 BFGS: 340 14:18:54 268.545231 2.5252 BFGS: 341 14:18:55 268.158017 2.5212 BFGS: 342 14:18:55 267.771428 2.5173 BFGS: 343 14:18:56 267.385463 2.5134 BFGS: 344 14:18:57 267.000120 2.5095 BFGS: 345 14:18:58 266.615399 2.5056 BFGS: 346 14:18:59 266.231299 2.5018 BFGS: 347 14:18:59 265.847818 2.4979 BFGS: 348 14:19:00 265.464956 2.4940 BFGS: 349 14:19:00 265.082712 2.4901 BFGS: 350 14:19:01 264.701084 2.4863 BFGS: 351 14:19:02 264.320073 2.4824 BFGS: 352 14:19:03 263.939677 2.4785 BFGS: 353 14:19:04 263.559895 2.4747 BFGS: 354 14:19:05 263.180727 2.4708 BFGS: 355 14:19:06 262.802172 2.4670 BFGS: 356 14:19:07 262.424228 2.4631 BFGS: 357 14:19:08 262.046895 2.4593 BFGS: 358 14:19:09 261.670173 2.4555 BFGS: 359 14:19:09 261.294060 2.4517 BFGS: 360 14:19:10 260.918555 2.4478 BFGS: 361 14:19:11 260.543659 2.4440 BFGS: 362 14:19:12 260.169370 2.4402 BFGS: 363 14:19:12 259.795687 2.4364 BFGS: 364 14:19:13 259.422610 2.4326 BFGS: 365 14:19:14 259.050138 2.4288 BFGS: 366 14:19:14 258.678270 2.4250 BFGS: 367 14:19:15 258.307006 2.4213 BFGS: 368 14:19:16 257.936344 2.4175 BFGS: 369 14:19:17 257.566285 2.4137 BFGS: 370 14:19:17 257.196827 2.4099 BFGS: 371 14:19:18 256.827970 2.4062 BFGS: 372 14:19:19 256.459713 2.4024 BFGS: 373 14:19:19 256.092055 2.3986 BFGS: 374 14:19:20 255.724996 2.3949 BFGS: 375 14:19:21 255.358535 2.3911 BFGS: 376 14:19:22 254.992671 2.3874 BFGS: 377 14:19:22 254.627404 2.3837 BFGS: 378 14:19:23 254.262732 2.3799 BFGS: 379 14:19:24 253.898657 2.3762 BFGS: 380 14:19:25 253.535175 2.3725 BFGS: 381 14:19:26 253.172288 2.3687 BFGS: 382 14:19:26 252.809995 2.3650 BFGS: 383 14:19:27 252.448293 2.3613 BFGS: 384 14:19:28 252.087184 2.3576 BFGS: 385 14:19:28 251.726667 2.3539 BFGS: 386 14:19:29 251.366740 2.3502 BFGS: 387 14:19:30 251.007403 2.3465 BFGS: 388 14:19:31 250.648656 2.3428 BFGS: 389 14:19:32 250.290497 2.3392 BFGS: 390 14:19:33 249.932927 2.3355 BFGS: 391 14:19:34 249.575944 2.3318 BFGS: 392 14:19:35 249.219548 2.3281 BFGS: 393 14:19:35 248.863738 2.3245 BFGS: 394 14:19:36 248.508514 2.3208 BFGS: 395 14:19:37 248.153875 2.3171 BFGS: 396 14:19:38 247.799820 2.3135 BFGS: 397 14:19:38 247.446349 2.3098 BFGS: 398 14:19:39 247.093460 2.3062 BFGS: 399 14:19:40 246.741154 2.3026 BFGS: 400 14:19:41 246.389430 2.2989 BFGS: 401 14:19:41 246.038286 2.2953 BFGS: 402 14:19:42 245.687723 2.2917 BFGS: 403 14:19:43 245.337740 2.2880 BFGS: 404 14:19:43 244.988336 2.2844 BFGS: 405 14:19:44 244.639510 2.2808 BFGS: 406 14:19:45 244.291262 2.2772 BFGS: 407 14:19:45 243.943591 2.2736 BFGS: 408 14:19:46 243.596497 2.2700 BFGS: 409 14:19:46 243.249978 2.2664 BFGS: 410 14:19:47 242.904035 2.2628 BFGS: 411 14:19:48 242.558666 2.2592 BFGS: 412 14:19:48 242.213870 2.2556 BFGS: 413 14:19:49 241.869648 2.2521 BFGS: 414 14:19:49 241.525999 2.2485 BFGS: 415 14:19:50 241.182921 2.2449 BFGS: 416 14:19:50 240.840414 2.2413 BFGS: 417 14:19:51 240.498478 2.2378 BFGS: 418 14:19:51 240.157111 2.2342 BFGS: 419 14:19:52 239.816314 2.2307 BFGS: 420 14:19:53 239.476085 2.2271 BFGS: 421 14:19:53 239.136423 2.2236 BFGS: 422 14:19:54 238.797329 2.2200 BFGS: 423 14:19:54 238.458801 2.2165 BFGS: 424 14:19:55 238.120839 2.2130 BFGS: 425 14:19:56 237.783442 2.2094 BFGS: 426 14:19:57 237.446609 2.2059 BFGS: 427 14:19:57 237.110340 2.2024 BFGS: 428 14:19:58 236.774634 2.1989 BFGS: 429 14:19:59 236.439490 2.1954 BFGS: 430 14:20:00 236.104908 2.1918 BFGS: 431 14:20:01 235.770886 2.1883 BFGS: 432 14:20:01 235.437425 2.1848 BFGS: 433 14:20:02 235.104523 2.1813 BFGS: 434 14:20:03 234.772180 2.1779 BFGS: 435 14:20:04 234.440395 2.1744 BFGS: 436 14:20:04 234.109167 2.1709 BFGS: 437 14:20:05 233.778496 2.1674 BFGS: 438 14:20:06 233.448381 2.1639 BFGS: 439 14:20:07 233.118822 2.1604 BFGS: 440 14:20:08 232.789816 2.1570 BFGS: 441 14:20:09 232.461365 2.1535 BFGS: 442 14:20:11 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0.3098 BFGS: 1899 14:35:49 31.087102 0.3093 BFGS: 1900 14:35:50 31.041161 0.3089 BFGS: 1901 14:35:50 30.995284 0.3085 BFGS: 1902 14:35:51 30.949470 0.3080 BFGS: 1903 14:35:51 30.903719 0.3076 BFGS: 1904 14:35:52 30.858032 0.3072 BFGS: 1905 14:35:52 30.812409 0.3068 BFGS: 1906 14:35:53 30.766849 0.3063 BFGS: 1907 14:35:53 30.721352 0.3059 BFGS: 1908 14:35:54 30.675919 0.3055 BFGS: 1909 14:35:54 30.630548 0.3051 BFGS: 1910 14:35:55 30.585241 0.3046 BFGS: 1911 14:35:56 30.539998 0.3042 BFGS: 1912 14:35:56 30.494817 0.3038 BFGS: 1913 14:35:56 30.449699 0.3034 BFGS: 1914 14:35:57 30.404642 0.3030 BFGS: 1915 14:35:57 30.359643 0.3026 BFGS: 1916 14:35:57 30.314703 0.3022 BFGS: 1917 14:35:58 30.269820 0.3018 BFGS: 1918 14:35:58 30.224996 0.3014 BFGS: 1919 14:35:59 30.180230 0.3010 BFGS: 1920 14:35:59 30.135522 0.3006 BFGS: 1921 14:35:59 30.090872 0.3002 BFGS: 1922 14:35:59 30.046280 0.2998 BFGS: 1923 14:36:00 30.001746 0.2994 BFGS: 1924 14:36:00 29.957270 0.2990 BFGS: 1925 14:36:00 29.912852 0.2986 BFGS: 1926 14:36:00 29.868491 0.2983 BFGS: 1927 14:36:00 29.824189 0.2979 BFGS: 1928 14:36:01 29.779944 0.2975 BFGS: 1929 14:36:01 29.735757 0.2971 BFGS: 1930 14:36:01 29.691628 0.2967 BFGS: 1931 14:36:02 29.647557 0.2963 BFGS: 1932 14:36:02 29.603543 0.2959 BFGS: 1933 14:36:03 29.559587 0.2955 BFGS: 1934 14:36:03 29.515688 0.2951 BFGS: 1935 14:36:04 29.471847 0.2948 BFGS: 1936 14:36:04 29.428064 0.2944 BFGS: 1937 14:36:05 29.384338 0.2940 BFGS: 1938 14:36:05 29.340670 0.2936 BFGS: 1939 14:36:06 29.297058 0.2932 BFGS: 1940 14:36:07 29.253505 0.2928 BFGS: 1941 14:36:08 29.210008 0.2924 BFGS: 1942 14:36:08 29.166569 0.2921 BFGS: 1943 14:36:09 29.123188 0.2917 BFGS: 1944 14:36:10 29.079863 0.2913 BFGS: 1945 14:36:10 29.036596 0.2909 BFGS: 1946 14:36:11 28.993385 0.2905 BFGS: 1947 14:36:11 28.950232 0.2901 BFGS: 1948 14:36:12 28.907136 0.2898 BFGS: 1949 14:36:12 28.864097 0.2894 BFGS: 1950 14:36:13 28.821115 0.2890 BFGS: 1951 14:36:13 28.778190 0.2886 BFGS: 1952 14:36:14 28.735322 0.2882 BFGS: 1953 14:36:15 28.692511 0.2878 BFGS: 1954 14:36:15 28.649757 0.2875 BFGS: 1955 14:36:16 28.607059 0.2871 BFGS: 1956 14:36:16 28.564419 0.2867 BFGS: 1957 14:36:17 28.521835 0.2863 BFGS: 1958 14:36:17 28.479307 0.2859 BFGS: 1959 14:36:18 28.436837 0.2856 BFGS: 1960 14:36:18 28.394423 0.2852 BFGS: 1961 14:36:19 28.352065 0.2848 BFGS: 1962 14:36:19 28.309764 0.2844 BFGS: 1963 14:36:20 28.267520 0.2840 BFGS: 1964 14:36:20 28.225332 0.2837 BFGS: 1965 14:36:21 28.183200 0.2833 BFGS: 1966 14:36:22 28.141125 0.2829 BFGS: 1967 14:36:22 28.099106 0.2825 BFGS: 1968 14:36:22 28.057143 0.2822 BFGS: 1969 14:36:23 28.015237 0.2818 BFGS: 1970 14:36:23 27.973386 0.2814 BFGS: 1971 14:36:24 27.931592 0.2810 BFGS: 1972 14:36:25 27.889854 0.2807 BFGS: 1973 14:36:25 27.848173 0.2803 BFGS: 1974 14:36:26 27.806547 0.2799 BFGS: 1975 14:36:26 27.764977 0.2795 BFGS: 1976 14:36:27 27.723463 0.2791 BFGS: 1977 14:36:28 27.682005 0.2788 BFGS: 1978 14:36:28 27.640603 0.2784 BFGS: 1979 14:36:29 27.599257 0.2780 BFGS: 1980 14:36:29 27.557966 0.2777 BFGS: 1981 14:36:30 27.516731 0.2773 BFGS: 1982 14:36:30 27.475552 0.2769 BFGS: 1983 14:36:31 27.434429 0.2765 BFGS: 1984 14:36:31 27.393361 0.2762 BFGS: 1985 14:36:32 27.352349 0.2758 BFGS: 1986 14:36:32 27.311392 0.2754 BFGS: 1987 14:36:33 27.270491 0.2750 BFGS: 1988 14:36:33 27.229645 0.2747 BFGS: 1989 14:36:34 27.188855 0.2743 BFGS: 1990 14:36:34 27.148120 0.2739 BFGS: 1991 14:36:35 27.107440 0.2736 BFGS: 1992 14:36:35 27.066816 0.2732 BFGS: 1993 14:36:36 27.026247 0.2728 BFGS: 1994 14:36:36 26.985733 0.2724 BFGS: 1995 14:36:36 26.945274 0.2721 BFGS: 1996 14:36:37 26.904870 0.2717 BFGS: 1997 14:36:37 26.864522 0.2713 BFGS: 1998 14:36:38 26.824228 0.2710 BFGS: 1999 14:36:38 26.783990 0.2706 BFGS: 2000 14:36:39 26.743806 0.2702 BFGS: 2001 14:36:39 26.703677 0.2699 BFGS: 2002 14:36:40 26.663603 0.2695 BFGS: 2003 14:36:40 26.623584 0.2691 BFGS: 2004 14:36:40 26.583620 0.2688 BFGS: 2005 14:36:41 26.543710 0.2684 BFGS: 2006 14:36:41 26.503856 0.2680 BFGS: 2007 14:36:42 26.464055 0.2676 BFGS: 2008 14:36:42 26.424310 0.2673 BFGS: 2009 14:36:43 26.384619 0.2669 BFGS: 2010 14:36:43 26.344982 0.2665 BFGS: 2011 14:36:44 26.305400 0.2662 BFGS: 2012 14:36:44 26.265873 0.2658 BFGS: 2013 14:36:45 26.226399 0.2655 BFGS: 2014 14:36:46 26.186981 0.2651 BFGS: 2015 14:36:46 26.147616 0.2647 BFGS: 2016 14:36:47 26.108306 0.2644 BFGS: 2017 14:36:48 26.069050 0.2640 BFGS: 2018 14:36:48 26.029848 0.2636 BFGS: 2019 14:36:49 25.990700 0.2633 BFGS: 2020 14:36:49 25.951607 0.2629 BFGS: 2021 14:36:50 25.912567 0.2625 BFGS: 2022 14:36:51 25.873582 0.2622 BFGS: 2023 14:36:51 25.834650 0.2618 BFGS: 2024 14:36:52 25.795773 0.2614 BFGS: 2025 14:36:52 25.756949 0.2611 BFGS: 2026 14:36:53 25.718180 0.2607 BFGS: 2027 14:36:53 25.679464 0.2604 BFGS: 2028 14:36:54 25.640801 0.2600 BFGS: 2029 14:36:54 25.602193 0.2596 BFGS: 2030 14:36:55 25.563638 0.2593 BFGS: 2031 14:36:56 25.525137 0.2589 BFGS: 2032 14:36:56 25.486690 0.2585 BFGS: 2033 14:36:57 25.448296 0.2582 BFGS: 2034 14:36:57 25.409956 0.2578 BFGS: 2035 14:36:58 25.371669 0.2575 BFGS: 2036 14:36:59 25.333435 0.2571 BFGS: 2037 14:36:59 25.295256 0.2567 BFGS: 2038 14:37:00 25.257129 0.2564 BFGS: 2039 14:37:00 25.219056 0.2560 BFGS: 2040 14:37:00 25.181036 0.2557 BFGS: 2041 14:37:01 25.143069 0.2553 BFGS: 2042 14:37:02 25.105156 0.2550 BFGS: 2043 14:37:02 25.067295 0.2546 BFGS: 2044 14:37:03 25.029488 0.2542 BFGS: 2045 14:37:03 24.991734 0.2539 BFGS: 2046 14:37:04 24.954033 0.2535 BFGS: 2047 14:37:05 24.916385 0.2532 BFGS: 2048 14:37:05 24.878790 0.2528 BFGS: 2049 14:37:06 24.841248 0.2524 BFGS: 2050 14:37:07 24.803758 0.2521 BFGS: 2051 14:37:07 24.766322 0.2517 BFGS: 2052 14:37:08 24.728939 0.2514 BFGS: 2053 14:37:08 24.691608 0.2510 BFGS: 2054 14:37:09 24.654330 0.2507 BFGS: 2055 14:37:09 24.617104 0.2503 BFGS: 2056 14:37:10 24.579932 0.2500 BFGS: 2057 14:37:10 24.542812 0.2496 BFGS: 2058 14:37:11 24.505744 0.2492 BFGS: 2059 14:37:11 24.468729 0.2489 BFGS: 2060 14:37:12 24.431767 0.2485 BFGS: 2061 14:37:12 24.394857 0.2482 BFGS: 2062 14:37:13 24.357999 0.2478 BFGS: 2063 14:37:13 24.321194 0.2475 BFGS: 2064 14:37:14 24.284441 0.2471 BFGS: 2065 14:37:15 24.247740 0.2468 BFGS: 2066 14:37:15 24.211092 0.2464 BFGS: 2067 14:37:16 24.174496 0.2461 BFGS: 2068 14:37:17 24.137952 0.2457 BFGS: 2069 14:37:17 24.101460 0.2454 BFGS: 2070 14:37:18 24.065021 0.2450 BFGS: 2071 14:37:18 24.028633 0.2447 BFGS: 2072 14:37:19 23.992297 0.2443 BFGS: 2073 14:37:19 23.956014 0.2439 BFGS: 2074 14:37:20 23.919782 0.2436 BFGS: 2075 14:37:21 23.883603 0.2432 BFGS: 2076 14:37:21 23.847475 0.2429 BFGS: 2077 14:37:22 23.811399 0.2425 BFGS: 2078 14:37:22 23.775375 0.2422 BFGS: 2079 14:37:23 23.739402 0.2418 BFGS: 2080 14:37:23 23.703481 0.2415 BFGS: 2081 14:37:24 23.667612 0.2411 BFGS: 2082 14:37:24 23.631795 0.2408 BFGS: 2083 14:37:25 23.596029 0.2404 BFGS: 2084 14:37:25 23.560315 0.2401 BFGS: 2085 14:37:26 23.524653 0.2397 BFGS: 2086 14:37:26 23.489041 0.2394 BFGS: 2087 14:37:27 23.453482 0.2391 BFGS: 2088 14:37:27 23.417974 0.2387 BFGS: 2089 14:37:28 23.382517 0.2384 BFGS: 2090 14:37:28 23.347111 0.2380 BFGS: 2091 14:37:29 23.311757 0.2377 BFGS: 2092 14:37:29 23.276454 0.2373 BFGS: 2093 14:37:30 23.241202 0.2370 BFGS: 2094 14:37:31 23.206002 0.2366 BFGS: 2095 14:37:31 23.170852 0.2363 BFGS: 2096 14:37:32 23.135754 0.2359 BFGS: 2097 14:37:33 23.100707 0.2356 BFGS: 2098 14:37:34 23.065711 0.2352 BFGS: 2099 14:37:35 23.030766 0.2349 BFGS: 2100 14:37:35 22.995872 0.2345 BFGS: 2101 14:37:37 22.961028 0.2342 BFGS: 2102 14:37:37 22.926236 0.2339 BFGS: 2103 14:37:38 22.891495 0.2335 BFGS: 2104 14:37:38 22.856804 0.2332 BFGS: 2105 14:37:39 22.822164 0.2328 BFGS: 2106 14:37:40 22.787575 0.2325 BFGS: 2107 14:37:40 22.753037 0.2321 BFGS: 2108 14:37:41 22.718547 0.2318 BFGS: 2109 14:37:41 22.684105 0.2315 BFGS: 2110 14:37:42 22.649709 0.2312 BFGS: 2111 14:37:42 22.615359 0.2310 BFGS: 2112 14:37:43 22.581056 0.2307 BFGS: 2113 14:37:43 22.546799 0.2304 BFGS: 2114 14:37:44 22.512587 0.2301 BFGS: 2115 14:37:44 22.478421 0.2298 BFGS: 2116 14:37:45 22.444300 0.2295 BFGS: 2117 14:37:45 22.410225 0.2292 BFGS: 2118 14:37:46 22.376194 0.2289 BFGS: 2119 14:37:46 22.342209 0.2286 BFGS: 2120 14:37:47 22.308267 0.2283 BFGS: 2121 14:37:48 22.274371 0.2280 BFGS: 2122 14:37:48 22.240518 0.2277 BFGS: 2123 14:37:49 22.206710 0.2275 BFGS: 2124 14:37:50 22.172945 0.2272 BFGS: 2125 14:37:50 22.139224 0.2269 BFGS: 2126 14:37:51 22.105547 0.2266 BFGS: 2127 14:37:51 22.071913 0.2263 BFGS: 2128 14:37:52 22.038322 0.2260 BFGS: 2129 14:37:52 22.004775 0.2257 BFGS: 2130 14:37:53 21.971270 0.2254 BFGS: 2131 14:37:53 21.937808 0.2252 BFGS: 2132 14:37:54 21.904389 0.2249 BFGS: 2133 14:37:54 21.871012 0.2246 BFGS: 2134 14:37:54 21.837678 0.2243 BFGS: 2135 14:37:54 21.804386 0.2240 BFGS: 2136 14:37:55 21.771136 0.2237 BFGS: 2137 14:37:55 21.737928 0.2234 BFGS: 2138 14:37:56 21.704761 0.2232 BFGS: 2139 14:37:56 21.671637 0.2229 BFGS: 2140 14:37:57 21.638554 0.2226 BFGS: 2141 14:37:57 21.605512 0.2223 BFGS: 2142 14:37:58 21.572512 0.2220 BFGS: 2143 14:37:58 21.539553 0.2217 BFGS: 2144 14:37:58 21.506635 0.2215 BFGS: 2145 14:37:59 21.473758 0.2212 BFGS: 2146 14:37:59 21.440922 0.2209 BFGS: 2147 14:38:00 21.408126 0.2206 BFGS: 2148 14:38:00 21.375371 0.2203 BFGS: 2149 14:38:01 21.342656 0.2200 BFGS: 2150 14:38:01 21.309982 0.2198 BFGS: 2151 14:38:02 21.277348 0.2195 BFGS: 2152 14:38:02 21.244754 0.2192 BFGS: 2153 14:38:03 21.212201 0.2189 BFGS: 2154 14:38:03 21.179687 0.2186 BFGS: 2155 14:38:04 21.147213 0.2184 BFGS: 2156 14:38:04 21.114778 0.2181 BFGS: 2157 14:38:05 21.082383 0.2178 BFGS: 2158 14:38:05 21.050028 0.2175 BFGS: 2159 14:38:06 21.017712 0.2173 BFGS: 2160 14:38:06 20.985435 0.2170 BFGS: 2161 14:38:07 20.953197 0.2167 BFGS: 2162 14:38:07 20.920998 0.2164 BFGS: 2163 14:38:08 20.888839 0.2161 BFGS: 2164 14:38:08 20.856718 0.2159 BFGS: 2165 14:38:09 20.824636 0.2156 BFGS: 2166 14:38:09 20.792592 0.2153 BFGS: 2167 14:38:09 20.760587 0.2150 BFGS: 2168 14:38:10 20.728620 0.2148 BFGS: 2169 14:38:11 20.696692 0.2145 BFGS: 2170 14:38:11 20.664802 0.2142 BFGS: 2171 14:38:12 20.632950 0.2139 BFGS: 2172 14:38:12 20.601136 0.2137 BFGS: 2173 14:38:13 20.569360 0.2134 BFGS: 2174 14:38:13 20.537622 0.2131 BFGS: 2175 14:38:13 20.505922 0.2129 BFGS: 2176 14:38:14 20.474259 0.2126 BFGS: 2177 14:38:14 20.442634 0.2123 BFGS: 2178 14:38:15 20.411046 0.2120 BFGS: 2179 14:38:16 20.379496 0.2118 BFGS: 2180 14:38:16 20.347983 0.2115 BFGS: 2181 14:38:17 20.316507 0.2112 BFGS: 2182 14:38:18 20.285068 0.2110 BFGS: 2183 14:38:19 20.253666 0.2107 BFGS: 2184 14:38:20 20.222301 0.2104 BFGS: 2185 14:38:20 20.190973 0.2101 BFGS: 2186 14:38:21 20.159681 0.2099 BFGS: 2187 14:38:22 20.128426 0.2096 BFGS: 2188 14:38:22 20.097208 0.2093 BFGS: 2189 14:38:23 20.066026 0.2091 BFGS: 2190 14:38:23 20.034881 0.2088 BFGS: 2191 14:38:24 20.003772 0.2085 BFGS: 2192 14:38:24 19.972699 0.2083 BFGS: 2193 14:38:25 19.941662 0.2080 BFGS: 2194 14:38:25 19.910661 0.2077 BFGS: 2195 14:38:26 19.879696 0.2075 BFGS: 2196 14:38:26 19.848767 0.2072 BFGS: 2197 14:38:26 19.817873 0.2069 BFGS: 2198 14:38:27 19.787016 0.2067 BFGS: 2199 14:38:28 19.756194 0.2064 BFGS: 2200 14:38:28 19.725407 0.2061 BFGS: 2201 14:38:28 19.694656 0.2059 BFGS: 2202 14:38:29 19.663940 0.2056 BFGS: 2203 14:38:30 19.633259 0.2053 BFGS: 2204 14:38:30 19.602614 0.2051 BFGS: 2205 14:38:31 19.572003 0.2048 BFGS: 2206 14:38:31 19.541428 0.2046 BFGS: 2207 14:38:32 19.510887 0.2043 BFGS: 2208 14:38:32 19.480382 0.2040 BFGS: 2209 14:38:33 19.449911 0.2038 BFGS: 2210 14:38:33 19.419475 0.2035 BFGS: 2211 14:38:34 19.389073 0.2032 BFGS: 2212 14:38:34 19.358706 0.2030 BFGS: 2213 14:38:34 19.328373 0.2027 BFGS: 2214 14:38:35 19.298075 0.2025 BFGS: 2215 14:38:36 19.267811 0.2022 BFGS: 2216 14:38:36 19.237581 0.2019 BFGS: 2217 14:38:37 19.207385 0.2017 BFGS: 2218 14:38:37 19.177224 0.2014 BFGS: 2219 14:38:37 19.147096 0.2012 BFGS: 2220 14:38:38 19.117002 0.2009 BFGS: 2221 14:38:38 19.086942 0.2006 BFGS: 2222 14:38:38 19.056916 0.2004 BFGS: 2223 14:38:38 19.026923 0.2001 BFGS: 2224 14:38:39 18.996964 0.1999 BFGS: 2225 14:38:39 18.967039 0.1996 BFGS: 2226 14:38:39 18.937147 0.1994 BFGS: 2227 14:38:40 18.907288 0.1991 BFGS: 2228 14:38:40 18.877462 0.1988 BFGS: 2229 14:38:40 18.847670 0.1986 BFGS: 2230 14:38:41 18.817911 0.1983 BFGS: 2231 14:38:41 18.788185 0.1981 BFGS: 2232 14:38:42 18.758492 0.1978 BFGS: 2233 14:38:42 18.728832 0.1976 BFGS: 2234 14:38:43 18.699205 0.1973 BFGS: 2235 14:38:43 18.669610 0.1971 BFGS: 2236 14:38:44 18.640048 0.1968 BFGS: 2237 14:38:45 18.610519 0.1966 BFGS: 2238 14:38:45 18.581022 0.1963 BFGS: 2239 14:38:46 18.551558 0.1961 BFGS: 2240 14:38:46 18.522126 0.1958 BFGS: 2241 14:38:47 18.492727 0.1955 BFGS: 2242 14:38:47 18.463360 0.1953 BFGS: 2243 14:38:48 18.434025 0.1950 BFGS: 2244 14:38:48 18.404722 0.1948 BFGS: 2245 14:38:49 18.375451 0.1945 BFGS: 2246 14:38:50 18.346213 0.1943 BFGS: 2247 14:38:50 18.317006 0.1940 BFGS: 2248 14:38:52 18.287831 0.1938 BFGS: 2249 14:38:52 18.258688 0.1935 BFGS: 2250 14:38:52 18.229576 0.1933 BFGS: 2251 14:38:53 18.200496 0.1930 BFGS: 2252 14:38:54 18.171448 0.1928 BFGS: 2253 14:38:54 18.142432 0.1925 BFGS: 2254 14:38:55 18.113446 0.1923 BFGS: 2255 14:38:55 18.084493 0.1920 BFGS: 2256 14:38:56 18.055570 0.1918 BFGS: 2257 14:38:56 18.026679 0.1915 BFGS: 2258 14:38:57 17.997819 0.1913 BFGS: 2259 14:38:57 17.968990 0.1911 BFGS: 2260 14:38:58 17.940192 0.1908 BFGS: 2261 14:38:58 17.911425 0.1906 BFGS: 2262 14:38:58 17.882689 0.1903 BFGS: 2263 14:38:59 17.853984 0.1901 BFGS: 2264 14:39:00 17.825310 0.1898 BFGS: 2265 14:39:00 17.796666 0.1896 BFGS: 2266 14:39:01 17.768054 0.1893 BFGS: 2267 14:39:01 17.739471 0.1891 BFGS: 2268 14:39:02 17.710920 0.1888 BFGS: 2269 14:39:02 17.682399 0.1886 BFGS: 2270 14:39:03 17.653908 0.1884 BFGS: 2271 14:39:03 17.625448 0.1881 BFGS: 2272 14:39:03 17.597018 0.1879 BFGS: 2273 14:39:03 17.568618 0.1876 BFGS: 2274 14:39:03 17.540248 0.1874 BFGS: 2275 14:39:04 17.511909 0.1871 BFGS: 2276 14:39:04 17.483599 0.1869 BFGS: 2277 14:39:04 17.455320 0.1867 BFGS: 2278 14:39:05 17.427070 0.1864 BFGS: 2279 14:39:05 17.398851 0.1862 BFGS: 2280 14:39:05 17.370661 0.1859 BFGS: 2281 14:39:05 17.342501 0.1857 BFGS: 2282 14:39:06 17.314371 0.1854 BFGS: 2283 14:39:06 17.286270 0.1852 BFGS: 2284 14:39:06 17.258199 0.1850 BFGS: 2285 14:39:06 17.230158 0.1847 BFGS: 2286 14:39:07 17.202146 0.1845 BFGS: 2287 14:39:07 17.174163 0.1843 BFGS: 2288 14:39:07 17.146210 0.1840 BFGS: 2289 14:39:07 17.118286 0.1838 BFGS: 2290 14:39:07 17.090392 0.1835 BFGS: 2291 14:39:08 17.062526 0.1833 BFGS: 2292 14:39:08 17.034690 0.1831 BFGS: 2293 14:39:08 17.006883 0.1828 BFGS: 2294 14:39:08 16.979105 0.1826 BFGS: 2295 14:39:09 16.951356 0.1823 BFGS: 2296 14:39:09 16.923635 0.1821 BFGS: 2297 14:39:10 16.895944 0.1819 BFGS: 2298 14:39:10 16.868281 0.1816 BFGS: 2299 14:39:11 16.840647 0.1814 BFGS: 2300 14:39:11 16.813042 0.1812 BFGS: 2301 14:39:12 16.785466 0.1809 BFGS: 2302 14:39:12 16.757918 0.1807 BFGS: 2303 14:39:13 16.730399 0.1805 BFGS: 2304 14:39:13 16.702908 0.1802 BFGS: 2305 14:39:14 16.675445 0.1800 BFGS: 2306 14:39:14 16.648011 0.1798 BFGS: 2307 14:39:15 16.620606 0.1795 BFGS: 2308 14:39:15 16.593228 0.1793 BFGS: 2309 14:39:16 16.565879 0.1791 BFGS: 2310 14:39:16 16.538558 0.1788 BFGS: 2311 14:39:17 16.511265 0.1786 BFGS: 2312 14:39:17 16.484000 0.1784 BFGS: 2313 14:39:18 16.456764 0.1781 BFGS: 2314 14:39:18 16.429555 0.1779 BFGS: 2315 14:39:19 16.402374 0.1777 BFGS: 2316 14:39:19 16.375221 0.1774 BFGS: 2317 14:39:20 16.348096 0.1772 BFGS: 2318 14:39:20 16.320998 0.1770 BFGS: 2319 14:39:21 16.293929 0.1767 BFGS: 2320 14:39:21 16.266887 0.1765 BFGS: 2321 14:39:22 16.239872 0.1763 BFGS: 2322 14:39:22 16.212886 0.1760 BFGS: 2323 14:39:23 16.185926 0.1758 BFGS: 2324 14:39:24 16.158995 0.1756 BFGS: 2325 14:39:24 16.132090 0.1754 BFGS: 2326 14:39:25 16.105213 0.1751 BFGS: 2327 14:39:26 16.078364 0.1749 BFGS: 2328 14:39:27 16.051542 0.1747 BFGS: 2329 14:39:27 16.024747 0.1744 BFGS: 2330 14:39:28 15.997979 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0.1124 BFGS: 3101 14:45:53 2.054662 0.1123 BFGS: 3102 14:45:53 2.045024 0.1122 BFGS: 3103 14:45:54 2.035410 0.1121 BFGS: 3104 14:45:55 2.025818 0.1119 BFGS: 3105 14:45:55 2.016250 0.1118 BFGS: 3106 14:45:56 2.006704 0.1117 BFGS: 3107 14:45:56 1.997182 0.1116 BFGS: 3108 14:45:57 1.987683 0.1115 BFGS: 3109 14:45:58 1.978208 0.1113 BFGS: 3110 14:45:59 1.968755 0.1112 BFGS: 3111 14:45:59 1.959325 0.1111 BFGS: 3112 14:46:00 1.949919 0.1109 BFGS: 3113 14:46:01 1.940536 0.1108 BFGS: 3114 14:46:02 1.931176 0.1107 BFGS: 3115 14:46:02 1.921839 0.1106 BFGS: 3116 14:46:03 1.912525 0.1104 BFGS: 3117 14:46:04 1.903235 0.1103 BFGS: 3118 14:46:04 1.893968 0.1102 BFGS: 3119 14:46:05 1.884724 0.1101 BFGS: 3120 14:46:06 1.875503 0.1099 BFGS: 3121 14:46:07 1.866305 0.1098 BFGS: 3122 14:46:07 1.857131 0.1097 BFGS: 3123 14:46:08 1.847980 0.1096 BFGS: 3124 14:46:09 1.838852 0.1094 BFGS: 3125 14:46:10 1.829747 0.1093 BFGS: 3126 14:46:12 1.820666 0.1092 BFGS: 3127 14:46:12 1.811607 0.1090 BFGS: 3128 14:46:13 1.802572 0.1089 BFGS: 3129 14:46:13 1.793561 0.1088 BFGS: 3130 14:46:14 1.784572 0.1087 BFGS: 3131 14:46:14 1.775607 0.1085 BFGS: 3132 14:46:15 1.766665 0.1084 BFGS: 3133 14:46:15 1.757747 0.1083 BFGS: 3134 14:46:16 1.748851 0.1081 BFGS: 3135 14:46:16 1.739979 0.1080 BFGS: 3136 14:46:17 1.731131 0.1079 BFGS: 3137 14:46:18 1.722305 0.1078 BFGS: 3138 14:46:18 1.713503 0.1076 BFGS: 3139 14:46:19 1.704724 0.1075 BFGS: 3140 14:46:20 1.695969 0.1074 BFGS: 3141 14:46:20 1.687237 0.1072 BFGS: 3142 14:46:21 1.678528 0.1071 BFGS: 3143 14:46:22 1.669842 0.1070 BFGS: 3144 14:46:22 1.661180 0.1069 BFGS: 3145 14:46:23 1.652541 0.1067 BFGS: 3146 14:46:23 1.643926 0.1066 BFGS: 3147 14:46:24 1.635333 0.1065 BFGS: 3148 14:46:24 1.626765 0.1063 BFGS: 3149 14:46:25 1.618219 0.1062 BFGS: 3150 14:46:25 1.609697 0.1061 BFGS: 3151 14:46:26 1.601198 0.1059 BFGS: 3152 14:46:27 1.592723 0.1058 BFGS: 3153 14:46:28 1.584271 0.1057 BFGS: 3154 14:46:28 1.575842 0.1055 BFGS: 3155 14:46:29 1.567437 0.1054 BFGS: 3156 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0.0977 BFGS: 3212 14:47:03 1.127144 0.0976 BFGS: 3213 14:47:03 1.120103 0.0974 BFGS: 3214 14:47:04 1.113085 0.0973 BFGS: 3215 14:47:04 1.106091 0.0971 BFGS: 3216 14:47:05 1.099120 0.0970 BFGS: 3217 14:47:06 1.092173 0.0969 BFGS: 3218 14:47:06 1.085250 0.0967 BFGS: 3219 14:47:06 1.078351 0.0966 BFGS: 3220 14:47:07 1.071474 0.0964 BFGS: 3221 14:47:08 1.064622 0.0963 BFGS: 3222 14:47:08 1.057793 0.0961 BFGS: 3223 14:47:09 1.050988 0.0960 BFGS: 3224 14:47:09 1.044207 0.0958 BFGS: 3225 14:47:09 1.037449 0.0957 BFGS: 3226 14:47:10 1.030715 0.0956 BFGS: 3227 14:47:10 1.024005 0.0954 BFGS: 3228 14:47:11 1.017318 0.0953 BFGS: 3229 14:47:12 1.010655 0.0951 BFGS: 3230 14:47:13 1.004015 0.0950 BFGS: 3231 14:47:14 0.997399 0.0948 BFGS: 3232 14:47:14 0.990807 0.0947 BFGS: 3233 14:47:14 0.984239 0.0945 BFGS: 3234 14:47:15 0.977694 0.0944 BFGS: 3235 14:47:16 0.971173 0.0942 BFGS: 3236 14:47:16 0.964676 0.0941 BFGS: 3237 14:47:17 0.958202 0.0939 BFGS: 3238 14:47:17 0.951752 0.0938 BFGS: 3239 14:47:18 0.945326 0.0936 BFGS: 3240 14:47:18 0.938923 0.0935 BFGS: 3241 14:47:19 0.932544 0.0934 BFGS: 3242 14:47:19 0.926189 0.0932 BFGS: 3243 14:47:20 0.919857 0.0931 BFGS: 3244 14:47:21 0.913549 0.0929 BFGS: 3245 14:47:21 0.907265 0.0928 BFGS: 3246 14:47:21 0.901005 0.0926 BFGS: 3247 14:47:22 0.894768 0.0925 BFGS: 3248 14:47:22 0.888555 0.0923 BFGS: 3249 14:47:23 0.882365 0.0922 BFGS: 3250 14:47:24 0.876200 0.0920 BFGS: 3251 14:47:24 0.870058 0.0919 BFGS: 3252 14:47:24 0.863940 0.0917 BFGS: 3253 14:47:25 0.857845 0.0916 BFGS: 3254 14:47:25 0.851774 0.0914 BFGS: 3255 14:47:26 0.845727 0.0913 BFGS: 3256 14:47:27 0.839704 0.0911 BFGS: 3257 14:47:27 0.833704 0.0910 BFGS: 3258 14:47:28 0.827729 0.0908 BFGS: 3259 14:47:28 0.821776 0.0906 BFGS: 3260 14:47:29 0.815848 0.0905 BFGS: 3261 14:47:29 0.809943 0.0903 BFGS: 3262 14:47:30 0.804062 0.0902 BFGS: 3263 14:47:31 0.798205 0.0900 BFGS: 3264 14:47:32 0.792372 0.0899 BFGS: 3265 14:47:33 0.786562 0.0897 BFGS: 3266 14:47:33 0.780776 0.0896 BFGS: 3267 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14:48:30 0.282866 0.0708 BFGS: 3379 14:48:31 0.279756 0.0706 BFGS: 3380 14:48:31 0.276670 0.0704 BFGS: 3381 14:48:32 0.273607 0.0703 BFGS: 3382 14:48:32 0.270567 0.0701 BFGS: 3383 14:48:33 0.267551 0.0699 BFGS: 3384 14:48:34 0.264559 0.0697 BFGS: 3385 14:48:35 0.261589 0.0695 BFGS: 3386 14:48:35 0.258644 0.0693 BFGS: 3387 14:48:36 0.255719 0.0691 BFGS: 3388 14:48:37 0.252816 0.0690 BFGS: 3389 14:48:37 0.249933 0.0688 BFGS: 3390 14:48:38 0.247071 0.0686 BFGS: 3391 14:48:38 0.244230 0.0684 BFGS: 3392 14:48:39 0.241410 0.0682 BFGS: 3393 14:48:40 0.238610 0.0680 BFGS: 3394 14:48:40 0.235830 0.0678 BFGS: 3395 14:48:41 0.233071 0.0676 BFGS: 3396 14:48:41 0.230332 0.0674 BFGS: 3397 14:48:42 0.227613 0.0671 BFGS: 3398 14:48:42 0.224915 0.0669 BFGS: 3399 14:48:42 0.222236 0.0667 BFGS: 3400 14:48:42 0.219578 0.0665 BFGS: 3401 14:48:43 0.216940 0.0663 BFGS: 3402 14:48:43 0.214321 0.0661 BFGS: 3403 14:48:44 0.211723 0.0658 BFGS: 3404 14:48:44 0.209144 0.0656 BFGS: 3405 14:48:45 0.206585 0.0654 BFGS: 3406 14:48:45 0.204046 0.0651 BFGS: 3407 14:48:46 0.201526 0.0649 BFGS: 3408 14:48:46 0.199026 0.0647 BFGS: 3409 14:48:47 0.196545 0.0644 BFGS: 3410 14:48:48 0.194084 0.0642 BFGS: 3411 14:48:48 0.191642 0.0640 BFGS: 3412 14:48:49 0.189220 0.0637 BFGS: 3413 14:48:49 0.186817 0.0635 BFGS: 3414 14:48:50 0.184433 0.0632 BFGS: 3415 14:48:50 0.182068 0.0630 BFGS: 3416 14:48:51 0.179723 0.0627 BFGS: 3417 14:48:52 0.177396 0.0625 BFGS: 3418 14:48:53 0.175088 0.0622 BFGS: 3419 14:48:53 0.172800 0.0620 BFGS: 3420 14:48:54 0.170530 0.0617 BFGS: 3421 14:48:55 0.168279 0.0614 BFGS: 3422 14:48:56 0.166047 0.0612 BFGS: 3423 14:48:56 0.163834 0.0609 BFGS: 3424 14:48:57 0.161640 0.0607 BFGS: 3425 14:48:57 0.159464 0.0604 BFGS: 3426 14:48:58 0.157307 0.0601 BFGS: 3427 14:48:58 0.155168 0.0598 BFGS: 3428 14:48:59 0.153048 0.0596 BFGS: 3429 14:48:59 0.150946 0.0593 BFGS: 3430 14:49:00 0.148863 0.0590 BFGS: 3431 14:49:01 0.146798 0.0587 BFGS: 3432 14:49:03 0.144751 0.0584 BFGS: 3433 14:49:04 0.142723 0.0582 BFGS: 3434 14:49:05 0.140713 0.0579 BFGS: 3435 14:49:05 0.138721 0.0576 BFGS: 3436 14:49:06 0.136747 0.0573 BFGS: 3437 14:49:06 0.134791 0.0570 BFGS: 3438 14:49:07 0.132854 0.0567 BFGS: 3439 14:49:07 0.130934 0.0564 BFGS: 3440 14:49:08 0.129033 0.0561 BFGS: 3441 14:49:08 0.127149 0.0558 BFGS: 3442 14:49:09 0.125283 0.0555 BFGS: 3443 14:49:09 0.123435 0.0552 BFGS: 3444 14:49:10 0.121605 0.0549 BFGS: 3445 14:49:10 0.119792 0.0546 BFGS: 3446 14:49:11 0.117997 0.0543 BFGS: 3447 14:49:11 0.116220 0.0540 BFGS: 3448 14:49:12 0.114460 0.0537 BFGS: 3449 14:49:12 0.112718 0.0534 BFGS: 3450 14:49:13 0.110994 0.0531 BFGS: 3451 14:49:14 0.109287 0.0527 BFGS: 3452 14:49:14 0.107597 0.0524 BFGS: 3453 14:49:15 0.105925 0.0521 BFGS: 3454 14:49:15 0.104270 0.0518 BFGS: 3455 14:49:16 0.102632 0.0515 BFGS: 3456 14:49:16 0.101012 0.0511 BFGS: 3457 14:49:17 0.099409 0.0508 BFGS: 3458 14:49:17 0.097823 0.0505 BFGS: 3459 14:49:17 0.096254 0.0501 BFGS: 3460 14:49:18 0.094702 0.0498 BFGS: 3461 14:49:18 0.093168 0.0495 BFGS: 3462 14:49:19 0.091650 0.0491 BFGS: 3463 14:49:19 0.090149 0.0488 BFGS: 3464 14:49:20 0.088665 0.0485 BFGS: 3465 14:49:20 0.087198 0.0481 BFGS: 3466 14:49:20 0.085746 0.0476 BFGS: 3467 14:49:21 0.084310 0.0471 BFGS: 3468 14:49:21 0.082889 0.0466 BFGS: 3469 14:49:22 0.081483 0.0461 BFGS: 3470 14:49:22 0.080093 0.0456 BFGS: 3471 14:49:23 0.078718 0.0451 BFGS: 3472 14:49:23 0.077359 0.0446 BFGS: 3473 14:49:23 0.076014 0.0441 BFGS: 3474 14:49:24 0.074685 0.0436 BFGS: 3475 14:49:24 0.073371 0.0431 BFGS: 3476 14:49:25 0.072072 0.0426 BFGS: 3477 14:49:25 0.070788 0.0421 BFGS: 3478 14:49:26 0.069519 0.0416 BFGS: 3479 14:49:26 0.068265 0.0411 BFGS: 3480 14:49:27 0.067026 0.0406 BFGS: 3481 14:49:27 0.065802 0.0401 BFGS: 3482 14:49:28 0.064593 0.0396 BFGS: 3483 14:49:28 0.063398 0.0391 BFGS: 3484 14:49:29 0.062219 0.0386 BFGS: 3485 14:49:29 0.061054 0.0381 BFGS: 3486 14:49:30 0.059903 0.0376 BFGS: 3487 14:49:30 0.058768 0.0371 BFGS: 3488 14:49:31 0.057647 0.0366 BFGS: 3489 14:49:31 0.056540 0.0362 BFGS: 3490 14:49:31 0.055448 0.0357 BFGS: 3491 14:49:32 0.054370 0.0352 BFGS: 3492 14:49:33 0.053307 0.0347 BFGS: 3493 14:49:33 0.052258 0.0342 BFGS: 3494 14:49:34 0.051223 0.0337 BFGS: 3495 14:49:34 0.050203 0.0332 BFGS: 3496 14:49:35 0.049197 0.0327 BFGS: 3497 14:49:35 0.048205 0.0323 BFGS: 3498 14:49:36 0.047227 0.0318 BFGS: 3499 14:49:36 0.046263 0.0313 BFGS: 3500 14:49:37 0.045313 0.0308 BFGS: 3501 14:49:37 0.044377 0.0303 BFGS: 3502 14:49:38 0.043455 0.0299 BFGS: 3503 14:49:38 0.042547 0.0294 BFGS: 3504 14:49:39 0.041653 0.0289 BFGS: 3505 14:49:39 0.040772 0.0284 BFGS: 3506 14:49:40 0.039905 0.0279 BFGS: 3507 14:49:40 0.039052 0.0275 BFGS: 3508 14:49:41 0.038212 0.0270 BFGS: 3509 14:49:41 0.037386 0.0265 BFGS: 3510 14:49:42 0.036574 0.0261 BFGS: 3511 14:49:42 0.035775 0.0256 BFGS: 3512 14:49:43 0.034989 0.0251 BFGS: 3513 14:49:43 0.034217 0.0246 BFGS: 3514 14:49:44 0.033458 0.0242 BFGS: 3515 14:49:44 0.032712 0.0237 BFGS: 3516 14:49:45 0.031979 0.0232 BFGS: 3517 14:49:45 0.031260 0.0228 BFGS: 3518 14:49:46 0.030553 0.0223 BFGS: 3519 14:49:46 0.029860 0.0218 BFGS: 3520 14:49:46 0.029180 0.0214 BFGS: 3521 14:49:47 0.028512 0.0209 BFGS: 3522 14:49:47 0.027857 0.0205 BFGS: 3523 14:49:48 0.027215 0.0200 BFGS: 3524 14:49:48 0.026586 0.0195 BFGS: 3525 14:49:49 0.025969 0.0191 BFGS: 3526 14:49:50 0.025365 0.0186 BFGS: 3527 14:49:50 0.024774 0.0182 BFGS: 3528 14:49:51 0.024195 0.0177 BFGS: 3529 14:49:51 0.023628 0.0172 BFGS: 3530 14:49:52 0.023074 0.0168 BFGS: 3531 14:49:52 0.022531 0.0163 BFGS: 3532 14:49:53 0.022002 0.0159 BFGS: 3533 14:49:53 0.021484 0.0154 BFGS: 3534 14:49:53 0.020978 0.0150 BFGS: 3535 14:49:54 0.020484 0.0145 BFGS: 3536 14:49:54 0.020002 0.0141 BFGS: 3537 14:49:55 0.019532 0.0136 BFGS: 3538 14:49:55 0.019073 0.0132 BFGS: 3539 14:49:56 0.018627 0.0127 BFGS: 3540 14:49:56 0.018191 0.0123 BFGS: 3541 14:49:57 0.017768 0.0119 BFGS: 3542 14:49:57 0.017355 0.0118 BFGS: 3543 14:49:58 0.016954 0.0118 BFGS: 3544 14:49:58 0.016564 0.0117 BFGS: 3545 14:49:59 0.016185 0.0117 BFGS: 3546 14:49:59 0.015818 0.0116 BFGS: 3547 14:50:00 0.015461 0.0116 BFGS: 3548 14:50:00 0.015115 0.0116 BFGS: 3549 14:50:01 0.014779 0.0115 BFGS: 3550 14:50:01 0.014454 0.0115 BFGS: 3551 14:50:02 0.014140 0.0114 BFGS: 3552 14:50:02 0.013836 0.0114 BFGS: 3553 14:50:03 0.013542 0.0113 BFGS: 3554 14:50:04 0.013258 0.0113 BFGS: 3555 14:50:04 0.012984 0.0112 BFGS: 3556 14:50:04 0.012720 0.0112 BFGS: 3557 14:50:05 0.012465 0.0111 BFGS: 3558 14:50:05 0.012220 0.0111 BFGS: 3559 14:50:06 0.011984 0.0110 BFGS: 3560 14:50:06 0.011757 0.0109 BFGS: 3561 14:50:07 0.011539 0.0109 BFGS: 3562 14:50:08 0.011330 0.0108 BFGS: 3563 14:50:08 0.011129 0.0108 BFGS: 3564 14:50:08 0.010936 0.0107 BFGS: 3565 14:50:08 0.010752 0.0106 BFGS: 3566 14:50:09 0.010575 0.0106 BFGS: 3567 14:50:09 0.010405 0.0105 BFGS: 3568 14:50:10 0.010242 0.0104 BFGS: 3569 14:50:10 0.010086 0.0103 BFGS: 3570 14:50:11 0.009933 0.0103 BFGS: 3571 14:50:11 0.009780 0.0102 BFGS: 3572 14:50:12 0.009628 0.0101 BFGS: 3573 14:50:13 0.009478 0.0100 BFGS: 3574 14:50:13 0.009328 0.0099 BFGS: 3575 14:50:14 0.009180 0.0099 BFGS: 3576 14:50:14 0.009033 0.0098 BFGS: 3577 14:50:15 0.008888 0.0097 BFGS: 3578 14:50:16 0.008743 0.0096 BFGS: 3579 14:50:17 0.008600 0.0096 BFGS: 3580 14:50:17 0.008458 0.0095 BFGS: 3581 14:50:18 0.008317 0.0094 BFGS: 3582 14:50:18 0.008177 0.0093 BFGS: 3583 14:50:19 0.008039 0.0092 BFGS: 3584 14:50:19 0.007901 0.0092 BFGS: 3585 14:50:20 0.007765 0.0091 BFGS: 3586 14:50:20 0.007630 0.0090 BFGS: 3587 14:50:21 0.007497 0.0089 BFGS: 3588 14:50:22 0.007364 0.0089 BFGS: 3589 14:50:22 0.007233 0.0088 BFGS: 3590 14:50:23 0.007102 0.0087 BFGS: 3591 14:50:24 0.006973 0.0086 BFGS: 3592 14:50:24 0.006846 0.0085 BFGS: 3593 14:50:25 0.006719 0.0085 BFGS: 3594 14:50:25 0.006594 0.0084 BFGS: 3595 14:50:26 0.006469 0.0083 BFGS: 3596 14:50:26 0.006346 0.0082 BFGS: 3597 14:50:27 0.006224 0.0081 BFGS: 3598 14:50:28 0.006104 0.0081 BFGS: 3599 14:50:29 0.005984 0.0080 BFGS: 3600 14:50:30 0.005866 0.0079 BFGS: 3601 14:50:31 0.005749 0.0078 BFGS: 3602 14:50:31 0.005633 0.0078 BFGS: 3603 14:50:32 0.005518 0.0077 BFGS: 3604 14:50:32 0.005405 0.0076 BFGS: 3605 14:50:33 0.005293 0.0075 BFGS: 3606 14:50:34 0.005181 0.0074 BFGS: 3607 14:50:34 0.005071 0.0074 BFGS: 3608 14:50:35 0.004963 0.0073 BFGS: 3609 14:50:35 0.004855 0.0072 BFGS: 3610 14:50:36 0.004749 0.0071 BFGS: 3611 14:50:36 0.004644 0.0070 BFGS: 3612 14:50:37 0.004540 0.0070 BFGS: 3613 14:50:37 0.004437 0.0069 BFGS: 3614 14:50:38 0.004335 0.0068 BFGS: 3615 14:50:38 0.004235 0.0067 BFGS: 3616 14:50:39 0.004135 0.0066 BFGS: 3617 14:50:39 0.004037 0.0066 BFGS: 3618 14:50:40 0.003940 0.0065 BFGS: 3619 14:50:40 0.003845 0.0064 BFGS: 3620 14:50:41 0.003750 0.0063 BFGS: 3621 14:50:41 0.003657 0.0063 BFGS: 3622 14:50:42 0.003565 0.0062 BFGS: 3623 14:50:42 0.003474 0.0061 BFGS: 3624 14:50:43 0.003384 0.0060 BFGS: 3625 14:50:43 0.003295 0.0059 BFGS: 3626 14:50:44 0.003208 0.0059 BFGS: 3627 14:50:44 0.003122 0.0058 BFGS: 3628 14:50:45 0.003037 0.0057 BFGS: 3629 14:50:45 0.002953 0.0056 BFGS: 3630 14:50:45 0.002870 0.0055 BFGS: 3631 14:50:46 0.002789 0.0055 BFGS: 3632 14:50:46 0.002708 0.0054 BFGS: 3633 14:50:47 0.002629 0.0053 BFGS: 3634 14:50:47 0.002551 0.0052 BFGS: 3635 14:50:47 0.002474 0.0052 BFGS: 3636 14:50:48 0.002399 0.0051 BFGS: 3637 14:50:48 0.002324 0.0050 BFGS: 3638 14:50:49 0.002251 0.0049 BFGS: 3639 14:50:49 0.002179 0.0048 BFGS: 3640 14:50:49 0.002108 0.0048 BFGS: 3641 14:50:50 0.002038 0.0047 BFGS: 3642 14:50:50 0.001970 0.0046 BFGS: 3643 14:50:51 0.001903 0.0045 BFGS: 3644 14:50:52 0.001836 0.0044 BFGS: 3645 14:50:52 0.001771 0.0044 BFGS: 3646 14:50:53 0.001708 0.0043 BFGS: 3647 14:50:53 0.001645 0.0042 BFGS: 3648 14:50:54 0.001583 0.0041 BFGS: 3649 14:50:54 0.001523 0.0040 BFGS: 3650 14:50:55 0.001464 0.0040 BFGS: 3651 14:50:55 0.001406 0.0039 BFGS: 3652 14:50:56 0.001349 0.0038 BFGS: 3653 14:50:56 0.001294 0.0037 BFGS: 3654 14:50:57 0.001239 0.0037 BFGS: 3655 14:50:57 0.001186 0.0036 BFGS: 3656 14:50:57 0.001134 0.0035 BFGS: 3657 14:50:58 0.001083 0.0034 BFGS: 3658 14:50:58 0.001033 0.0033 BFGS: 3659 14:50:59 0.000985 0.0033 BFGS: 3660 14:50:59 0.000938 0.0032 BFGS: 3661 14:51:00 0.000891 0.0031 BFGS: 3662 14:51:00 0.000846 0.0030 BFGS: 3663 14:51:01 0.000803 0.0029 BFGS: 3664 14:51:01 0.000760 0.0029 BFGS: 3665 14:51:02 0.000718 0.0028 BFGS: 3666 14:51:02 0.000678 0.0027 BFGS: 3667 14:51:03 0.000639 0.0026 BFGS: 3668 14:51:04 0.000601 0.0025 BFGS: 3669 14:51:04 0.000564 0.0025 BFGS: 3670 14:51:05 0.000528 0.0024 BFGS: 3671 14:51:05 0.000494 0.0023 BFGS: 3672 14:51:06 0.000461 0.0022 BFGS: 3673 14:51:06 0.000428 0.0022 BFGS: 3674 14:51:07 0.000397 0.0021 BFGS: 3675 14:51:07 0.000368 0.0020 BFGS: 3676 14:51:08 0.000339 0.0019 BFGS: 3677 14:51:09 0.000311 0.0018 BFGS: 3678 14:51:10 0.000285 0.0018 BFGS: 3679 14:51:10 0.000260 0.0017 BFGS: 3680 14:51:11 0.000236 0.0016 BFGS: 3681 14:51:11 0.000213 0.0015 BFGS: 3682 14:51:12 0.000191 0.0014 BFGS: 3683 14:51:13 0.000171 0.0014 BFGS: 3684 14:51:13 0.000152 0.0013 BFGS: 3685 14:51:14 0.000133 0.0012 BFGS: 3686 14:51:15 0.000116 0.0011 BFGS: 3687 14:51:15 0.000101 0.0010 BFGS: 3688 14:51:15 0.000086 0.0010 BFGS: 3689 14:51:16 0.000072 0.0009 BFGS: 3690 14:51:16 0.000060 0.0008 BFGS: 3691 14:51:17 0.000049 0.0007 BFGS: 3692 14:51:17 0.000039 0.0006 BFGS: 3693 14:51:18 0.000030 0.0006 BFGS: 3694 14:51:18 0.000022 0.0005 BFGS: 3695 14:51:19 0.000016 0.0004 BFGS: 3696 14:51:19 0.000010 0.0003 BFGS: 3697 14:51:20 0.000006 0.0003 BFGS: 3698 14:51:20 0.000003 0.0002 BFGS: 3699 14:51:21 0.000001 0.0001 BFGS: 3700 14:51:21 0.000000 0.0000 BFGS: 3701 14:51:22 0.000000 0.0000 Minimization converged after 3701 steps. Maximum force component: 1.1133169440713824e-09 eV/Angstrom Maximum stress component: 5.957410875333656e-12 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', '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 = [[8.80977642e-32 0.00000000e+00 0.00000000e+00] [0.00000000e+00 5.00000000e-01 5.00000000e-01] [5.00000000e-01 5.00000000e-01 0.00000000e+00] [5.00000000e-01 0.00000000e+00 5.00000000e-01] [7.50000000e-01 2.50000000e-01 7.50000000e-01] [2.50000000e-01 2.50000000e-01 2.50000000e-01] [2.50000000e-01 7.50000000e-01 7.50000000e-01] [7.50000000e-01 7.50000000e-01 2.50000000e-01] [9.04699569e-01 9.04699569e-01 9.04699569e-01] [9.53004311e-02 5.95300431e-01 4.04699569e-01] [5.95300431e-01 4.04699569e-01 9.53004311e-02] [4.04699569e-01 9.53004311e-02 5.95300431e-01] [6.54699569e-01 1.54699569e-01 8.45300431e-01] [3.45300431e-01 3.45300431e-01 3.45300431e-01] [1.54699569e-01 8.45300431e-01 6.54699569e-01] [8.45300431e-01 6.54699569e-01 1.54699569e-01] [1.54699569e-01 6.54699569e-01 8.45300431e-01] [6.54699569e-01 8.45300431e-01 1.54699569e-01] [8.45300431e-01 1.54699569e-01 6.54699569e-01] [5.95300431e-01 9.53004311e-02 4.04699569e-01] [9.53004311e-02 4.04699569e-01 5.95300431e-01] [4.04699569e-01 5.95300431e-01 9.53004311e-02] [9.04699569e-01 4.04699569e-01 4.04699569e-01] [9.53004311e-02 9.53004311e-02 9.04699569e-01] [5.95300431e-01 9.04699569e-01 5.95300431e-01] [6.54699569e-01 6.54699569e-01 3.45300431e-01] [3.45300431e-01 8.45300431e-01 8.45300431e-01] [1.54699569e-01 3.45300431e-01 1.54699569e-01] [1.54699569e-01 1.54699569e-01 3.45300431e-01] [6.54699569e-01 3.45300431e-01 6.54699569e-01] [5.95300431e-01 5.95300431e-01 9.04699569e-01] [9.53004311e-02 9.04699569e-01 9.53004311e-02] [4.04699569e-01 9.04699569e-01 4.04699569e-01] [9.04699569e-01 9.53004311e-02 9.53004311e-02] [8.45300431e-01 3.45300431e-01 8.45300431e-01] [3.45300431e-01 6.54699569e-01 6.54699569e-01] [3.45300431e-01 1.54699569e-01 1.54699569e-01] [9.04699569e-01 5.95300431e-01 5.95300431e-01] [4.04699569e-01 4.04699569e-01 9.04699569e-01] [8.45300431e-01 8.45300431e-01 3.45300431e-01] [4.40890343e-01 4.40890343e-01 2.52685084e-01] [5.59109657e-01 5.91096571e-02 7.52685084e-01] [5.91096571e-02 9.40890343e-01 7.47314916e-01] [9.40890343e-01 5.59109657e-01 2.47314916e-01] [2.52685084e-01 4.40890343e-01 4.40890343e-01] [7.52685084e-01 5.59109657e-01 5.91096571e-02] [7.47314916e-01 5.91096571e-02 9.40890343e-01] [2.47314916e-01 9.40890343e-01 5.59109657e-01] [4.40890343e-01 2.52685084e-01 4.40890343e-01] [5.91096571e-02 7.52685084e-01 5.59109657e-01] [9.40890343e-01 7.47314916e-01 5.91096571e-02] [5.59109657e-01 2.47314916e-01 9.40890343e-01] [1.90890343e-01 6.90890343e-01 4.97314916e-01] [8.09109657e-01 8.09109657e-01 9.97314916e-01] [6.90890343e-01 3.09109657e-01 2.68508429e-03] [3.09109657e-01 1.90890343e-01 5.02685084e-01] [1.90890343e-01 5.02685084e-01 3.09109657e-01] [3.09109657e-01 2.68508429e-03 6.90890343e-01] [8.09109657e-01 9.97314916e-01 8.09109657e-01] [6.90890343e-01 4.97314916e-01 1.90890343e-01] [2.68508429e-03 6.90890343e-01 3.09109657e-01] [5.02685084e-01 3.09109657e-01 1.90890343e-01] [4.97314916e-01 1.90890343e-01 6.90890343e-01] [9.97314916e-01 8.09109657e-01 8.09109657e-01] [6.90890343e-01 1.90890343e-01 4.97314916e-01] [1.90890343e-01 3.09109657e-01 5.02685084e-01] [3.09109657e-01 6.90890343e-01 2.68508429e-03] [4.97314916e-01 6.90890343e-01 1.90890343e-01] [5.02685084e-01 1.90890343e-01 3.09109657e-01] [2.68508429e-03 3.09109657e-01 6.90890343e-01] [1.90890343e-01 4.97314916e-01 6.90890343e-01] [3.09109657e-01 5.02685084e-01 1.90890343e-01] [6.90890343e-01 2.68508429e-03 3.09109657e-01] [5.91096571e-02 5.59109657e-01 7.52685084e-01] [5.59109657e-01 9.40890343e-01 2.47314916e-01] [9.40890343e-01 5.91096571e-02 7.47314916e-01] [5.91096571e-02 7.47314916e-01 9.40890343e-01] [9.40890343e-01 2.47314916e-01 5.59109657e-01] [5.59109657e-01 7.52685084e-01 5.91096571e-02] [2.47314916e-01 5.59109657e-01 9.40890343e-01] [7.47314916e-01 9.40890343e-01 5.91096571e-02] [7.52685084e-01 5.91096571e-02 5.59109657e-01] [4.40890343e-01 9.40890343e-01 7.52685084e-01] [5.59109657e-01 5.59109657e-01 2.52685084e-01] [5.91096571e-02 4.40890343e-01 2.47314916e-01] [2.52685084e-01 9.40890343e-01 9.40890343e-01] [7.47314916e-01 5.59109657e-01 4.40890343e-01] [2.47314916e-01 4.40890343e-01 5.91096571e-02] [4.40890343e-01 7.52685084e-01 9.40890343e-01] [5.91096571e-02 2.52685084e-01 5.91096571e-02] [5.59109657e-01 7.47314916e-01 4.40890343e-01] [1.90890343e-01 1.90890343e-01 9.97314916e-01] [8.09109657e-01 3.09109657e-01 4.97314916e-01] [6.90890343e-01 8.09109657e-01 5.02685084e-01] [1.90890343e-01 2.68508429e-03 8.09109657e-01] [8.09109657e-01 4.97314916e-01 3.09109657e-01] [6.90890343e-01 9.97314916e-01 6.90890343e-01] [2.68508429e-03 1.90890343e-01 8.09109657e-01] [5.02685084e-01 8.09109657e-01 6.90890343e-01] [9.97314916e-01 3.09109657e-01 3.09109657e-01] [6.90890343e-01 6.90890343e-01 9.97314916e-01] [1.90890343e-01 8.09109657e-01 2.68508429e-03] [5.02685084e-01 6.90890343e-01 8.09109657e-01] [2.68508429e-03 8.09109657e-01 1.90890343e-01] [1.90890343e-01 9.97314916e-01 1.90890343e-01] [6.90890343e-01 5.02685084e-01 8.09109657e-01] [5.91096571e-02 5.91096571e-02 2.52685084e-01] [5.59109657e-01 4.40890343e-01 7.47314916e-01] [5.91096571e-02 2.47314916e-01 4.40890343e-01] [5.59109657e-01 2.52685084e-01 5.59109657e-01] [2.47314916e-01 5.91096571e-02 4.40890343e-01] [7.47314916e-01 4.40890343e-01 5.59109657e-01] [9.40890343e-01 4.40890343e-01 7.52685084e-01] [4.40890343e-01 5.59109657e-01 7.47314916e-01] [7.52685084e-01 4.40890343e-01 9.40890343e-01] [2.52685084e-01 5.59109657e-01 5.59109657e-01] [9.40890343e-01 2.52685084e-01 9.40890343e-01] [4.40890343e-01 7.47314916e-01 5.59109657e-01] [3.09109657e-01 8.09109657e-01 4.97314916e-01] [8.09109657e-01 1.90890343e-01 2.68508429e-03] [8.09109657e-01 2.68508429e-03 1.90890343e-01] [3.09109657e-01 9.97314916e-01 3.09109657e-01] [9.97314916e-01 1.90890343e-01 1.90890343e-01] [4.97314916e-01 8.09109657e-01 3.09109657e-01] [8.09109657e-01 6.90890343e-01 5.02685084e-01] [9.97314916e-01 6.90890343e-01 6.90890343e-01] [8.09109657e-01 5.02685084e-01 6.90890343e-01] [4.40890343e-01 5.91096571e-02 2.47314916e-01] [4.40890343e-01 2.47314916e-01 5.91096571e-02] [2.52685084e-01 5.91096571e-02 5.91096571e-02] [9.40890343e-01 9.40890343e-01 2.52685084e-01] [7.52685084e-01 9.40890343e-01 4.40890343e-01] [9.40890343e-01 7.52685084e-01 4.40890343e-01] [3.09109657e-01 3.09109657e-01 9.97314916e-01] [3.09109657e-01 4.97314916e-01 8.09109657e-01] [4.97314916e-01 3.09109657e-01 8.09109657e-01]] cellpar = Cell([[34.78273821241719, 7.78941778191841e-32, 3.8896315413858104e-32], [1.5621979717150562e-31, 34.78273821241719, -6.057668659759361e-17], [-3.8967901162815466e-32, -6.057668659759358e-17, 34.78273821241719]]) forces = [[ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 0.00000000e+00 0.00000000e+00 0.00000000e+00] [ 6.30446346e-10 6.30446346e-10 1.11331694e-09] [-6.30446346e-10 -6.30446346e-10 1.11331694e-09] [-6.30446346e-10 6.30446346e-10 -1.11331694e-09] [ 6.30446346e-10 -6.30446346e-10 -1.11331694e-09] [ 1.11331694e-09 6.30446346e-10 6.30446346e-10] [ 1.11331694e-09 -6.30446346e-10 -6.30446346e-10] [-1.11331694e-09 -6.30446346e-10 6.30446346e-10] [-1.11331694e-09 6.30446346e-10 -6.30446346e-10] [ 6.30446346e-10 1.11331694e-09 6.30446346e-10] [-6.30446346e-10 1.11331694e-09 -6.30446346e-10] [ 6.30446346e-10 -1.11331694e-09 -6.30446346e-10] [-6.30446346e-10 -1.11331694e-09 6.30446346e-10] [ 6.30446346e-10 6.30446346e-10 -1.11331694e-09] [-6.30446346e-10 -6.30446346e-10 -1.11331694e-09] [ 6.30446346e-10 -6.30446346e-10 1.11331694e-09] [-6.30446346e-10 6.30446346e-10 1.11331694e-09] [ 6.30446346e-10 1.11331694e-09 -6.30446346e-10] [-6.30446346e-10 1.11331694e-09 6.30446346e-10] [-6.30446346e-10 -1.11331694e-09 -6.30446346e-10] [ 6.30446346e-10 -1.11331694e-09 6.30446346e-10] [ 1.11331694e-09 6.30446346e-10 -6.30446346e-10] [ 1.11331694e-09 -6.30446346e-10 6.30446346e-10] [-1.11331694e-09 6.30446346e-10 6.30446346e-10] [-1.11331694e-09 -6.30446346e-10 -6.30446346e-10] [ 6.30446346e-10 6.30446346e-10 -1.11331694e-09] [ 6.30446346e-10 -6.30446346e-10 1.11331694e-09] [-6.30446346e-10 6.30446346e-10 1.11331694e-09] [-1.11331694e-09 6.30446346e-10 6.30446346e-10] [ 1.11331694e-09 6.30446346e-10 -6.30446346e-10] [ 1.11331694e-09 -6.30446346e-10 6.30446346e-10] [ 6.30446346e-10 -1.11331694e-09 6.30446346e-10] [-6.30446346e-10 1.11331694e-09 6.30446346e-10] [ 6.30446346e-10 1.11331694e-09 -6.30446346e-10] [-6.30446346e-10 -6.30446346e-10 1.11331694e-09] [-6.30446346e-10 6.30446346e-10 -1.11331694e-09] [ 6.30446346e-10 -6.30446346e-10 -1.11331694e-09] [-6.30446346e-10 -1.11331694e-09 6.30446346e-10] [ 6.30446346e-10 -1.11331694e-09 -6.30446346e-10] [-6.30446346e-10 1.11331694e-09 -6.30446346e-10] [-1.11331694e-09 -6.30446346e-10 6.30446346e-10] [-1.11331694e-09 6.30446346e-10 -6.30446346e-10] [ 1.11331694e-09 -6.30446346e-10 -6.30446346e-10] [ 6.30446346e-10 6.30446346e-10 1.11331694e-09] [-6.30446346e-10 -6.30446346e-10 1.11331694e-09] [-6.30446346e-10 6.30446346e-10 -1.11331694e-09] [ 1.11331694e-09 6.30446346e-10 6.30446346e-10] [-1.11331694e-09 -6.30446346e-10 6.30446346e-10] [-1.11331694e-09 6.30446346e-10 -6.30446346e-10] [ 6.30446346e-10 1.11331694e-09 6.30446346e-10] [-6.30446346e-10 1.11331694e-09 -6.30446346e-10] [-6.30446346e-10 -1.11331694e-09 6.30446346e-10] [ 6.30446346e-10 6.30446346e-10 -1.11331694e-09] [-6.30446346e-10 -6.30446346e-10 -1.11331694e-09] [ 6.30446346e-10 -6.30446346e-10 1.11331694e-09] [ 6.30446346e-10 1.11331694e-09 -6.30446346e-10] [-6.30446346e-10 -1.11331694e-09 -6.30446346e-10] [ 6.30446346e-10 -1.11331694e-09 6.30446346e-10] [ 1.11331694e-09 6.30446346e-10 -6.30446346e-10] [ 1.11331694e-09 -6.30446346e-10 6.30446346e-10] [-1.11331694e-09 -6.30446346e-10 -6.30446346e-10] [ 6.30446346e-10 6.30446346e-10 -1.11331694e-09] [ 6.30446346e-10 -6.30446346e-10 1.11331694e-09] [ 1.11331694e-09 6.30446346e-10 -6.30446346e-10] [ 1.11331694e-09 -6.30446346e-10 6.30446346e-10] [ 6.30446346e-10 -1.11331694e-09 6.30446346e-10] [ 6.30446346e-10 1.11331694e-09 -6.30446346e-10] [-6.30446346e-10 -6.30446346e-10 1.11331694e-09] [-6.30446346e-10 6.30446346e-10 -1.11331694e-09] [-6.30446346e-10 -1.11331694e-09 6.30446346e-10] [-6.30446346e-10 1.11331694e-09 -6.30446346e-10] [-1.11331694e-09 -6.30446346e-10 6.30446346e-10] [-1.11331694e-09 6.30446346e-10 -6.30446346e-10] [ 6.30446346e-10 6.30446346e-10 1.11331694e-09] [ 6.30446346e-10 -6.30446346e-10 -1.11331694e-09] [ 1.11331694e-09 6.30446346e-10 6.30446346e-10] [ 1.11331694e-09 -6.30446346e-10 -6.30446346e-10] [ 6.30446346e-10 1.11331694e-09 6.30446346e-10] [ 6.30446346e-10 -1.11331694e-09 -6.30446346e-10] [-6.30446346e-10 -6.30446346e-10 -1.11331694e-09] [-6.30446346e-10 6.30446346e-10 1.11331694e-09] [-6.30446346e-10 1.11331694e-09 6.30446346e-10] [-6.30446346e-10 -1.11331694e-09 -6.30446346e-10] [-1.11331694e-09 6.30446346e-10 6.30446346e-10] [-1.11331694e-09 -6.30446346e-10 -6.30446346e-10] [-6.30446346e-10 6.30446346e-10 1.11331694e-09] [-1.11331694e-09 6.30446346e-10 6.30446346e-10] [-6.30446346e-10 1.11331694e-09 6.30446346e-10] [ 6.30446346e-10 -6.30446346e-10 -1.11331694e-09] [ 6.30446346e-10 -1.11331694e-09 -6.30446346e-10] [ 1.11331694e-09 -6.30446346e-10 -6.30446346e-10] [ 6.30446346e-10 6.30446346e-10 1.11331694e-09] [ 1.11331694e-09 6.30446346e-10 6.30446346e-10] [ 6.30446346e-10 1.11331694e-09 6.30446346e-10] [-6.30446346e-10 -6.30446346e-10 -1.11331694e-09] [-6.30446346e-10 -1.11331694e-09 -6.30446346e-10] [-1.11331694e-09 -6.30446346e-10 -6.30446346e-10]] stress = [-5.95741088e-12 -5.95741088e-12 -5.95741088e-12 -2.10880347e-30 -3.81381893e-60 5.97596454e-60] energy per atom = 3.102093745276173e-17 =============================================== Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them. Successfully added property instance for parameter set 0