element(s): ['Li', 'Si'] AFLOW prototype label: A21B5_cF416_216_6efg4h_2efg Parameter names: ['a', 'x1', 'x2', 'x3', 'x4', 'x5', 'x6', 'x7', 'x8', 'x9', 'x10', 'x11', 'x12', 'x13', 'z13', 'x14', 'z14', 'x15', 'z15', 'x16', 'z16'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['18.5511', '0.80272711', '0.91864489', '0.057126038', '0.18621155', '0.32992969', '0.55554615', '0.66046999', '0.41491518', '0.67266118', '0.17810376', '0.5745335', '0.42995597', '0.09107039', '0.76309251', '0.90941472', '0.26168864', '0.84515547', '0.020322938', '0.83929165', '0.50701053'] model name: LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 ==== Building ASE atoms object with: ==== representative atom symbols = ['Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Si', 'Si', 'Si', 'Si'] representative atom coordinates = [[0.80272711 0.80272711 0.80272711] [0.91864489 0.91864489 0.91864489] [0.05712604 0.05712604 0.05712604] [0.18621155 0.18621155 0.18621155] [0.32992969 0.32992969 0.32992969] [0.55554615 0.55554615 0.55554615] [0.67266118 0. 0. ] [0.5745335 0.25 0.25 ] [0.59107039 0.59107039 0.76309251] [0.40941472 0.40941472 0.26168864] [0.34515547 0.34515547 0.02032294] [0.33929165 0.33929165 0.50701053] [0.66046999 0.66046999 0.66046999] [0.41491518 0.41491518 0.41491518] [0.17810376 0. 0. ] [0.42995597 0.25 0.25 ]] spacegroup = 216 cell = [[18.5511, 0, 0], [0, 18.5511, 0], [0, 0, 18.5511]] ========================================= Step Time Energy fmax BFGS: 0 15:58:07 -3023.077390 9.909909 BFGS: 1 15:58:11 -3027.933800 9.950094 BFGS: 2 15:58:15 -3031.678021 9.973121 BFGS: 3 15:58:18 -3035.020274 9.988169 BFGS: 4 15:58:21 -3038.162922 9.999421 BFGS: 5 15:58:25 -3041.191289 10.008018 BFGS: 6 15:58:28 -3044.148139 10.014188 BFGS: 7 15:58:31 -3047.057395 10.019251 BFGS: 8 15:58:36 -3049.933461 10.023210 BFGS: 9 15:58:40 -3052.783370 10.025233 BFGS: 10 15:58:45 -3055.607486 10.026123 BFGS: 11 15:58:48 -3058.405788 10.025946 BFGS: 12 15:58:53 -3061.176780 10.024761 BFGS: 13 15:58:57 -3063.918193 10.022623 BFGS: 14 15:59:00 -3066.627486 10.019590 BFGS: 15 15:59:03 -3069.302262 10.015959 BFGS: 16 15:59:07 -3071.940352 10.011326 BFGS: 17 15:59:10 -3074.539454 10.005983 BFGS: 18 15:59:13 -3077.097797 9.999996 BFGS: 19 15:59:17 -3079.613930 9.993431 BFGS: 20 15:59:20 -3082.086768 9.986351 BFGS: 21 15:59:24 -3084.515667 9.978822 BFGS: 22 15:59:28 -3086.900696 9.971378 BFGS: 23 15:59:31 -3089.242458 9.963124 BFGS: 24 15:59:34 -3091.541464 9.954588 BFGS: 25 15:59:37 -3093.799130 9.945818 BFGS: 26 15:59:41 -3096.017279 9.936853 BFGS: 27 15:59:46 -3098.198022 9.927729 BFGS: 28 15:59:49 -3100.343644 9.918474 BFGS: 29 15:59:52 -3102.456503 9.909110 BFGS: 30 15:59:55 -3104.538942 9.899654 BFGS: 31 15:59:59 -3106.593227 9.890121 BFGS: 32 16:00:04 -3108.621547 9.880756 BFGS: 33 16:00:09 -3110.625992 9.871086 BFGS: 34 16:00:13 -3112.608280 9.861359 BFGS: 35 16:00:17 -3114.570132 9.851576 BFGS: 36 16:00:22 -3116.513276 9.842214 BFGS: 37 16:00:26 -3118.439629 9.832320 BFGS: 38 16:00:31 -3120.349919 9.822365 BFGS: 39 16:00:34 -3122.245360 9.812347 BFGS: 40 16:00:38 -3124.127068 9.802264 BFGS: 41 16:00:42 -3125.996064 9.792112 BFGS: 42 16:00:45 -3127.853312 9.782363 BFGS: 43 16:00:48 -3129.699587 9.772066 BFGS: 44 16:00:53 -3131.535722 9.761689 BFGS: 45 16:00:55 -3133.362420 9.751230 BFGS: 46 16:00:58 -3135.180314 9.740685 BFGS: 47 16:01:03 -3136.990204 9.731657 BFGS: 48 16:01:06 -3138.793261 9.720938 BFGS: 49 16:01:10 -3140.589109 9.710600 BFGS: 50 16:01:15 -3142.378211 9.699694 BFGS: 51 16:01:21 -3144.160785 9.688695 BFGS: 52 16:01:26 -3145.937136 9.677606 BFGS: 53 16:01:31 -3147.707537 9.666432 BFGS: 54 16:01:37 -3149.472338 9.654701 BFGS: 55 16:01:42 -3151.232430 9.643338 BFGS: 56 16:01:47 -3152.987182 9.631904 BFGS: 57 16:01:51 -3154.736759 9.620404 BFGS: 58 16:01:55 -3156.481420 9.608845 BFGS: 59 16:01:58 -3158.221785 9.597208 BFGS: 60 16:02:02 -3159.957397 9.586240 BFGS: 61 16:02:07 -3161.688438 9.574513 BFGS: 62 16:02:11 -3163.414864 9.562512 BFGS: 63 16:02:15 -3165.137019 9.550692 BFGS: 64 16:02:22 -3166.854705 9.538854 BFGS: 65 16:02:25 -3168.567976 9.527001 BFGS: 66 16:02:30 -3170.276885 9.515139 BFGS: 67 16:02:34 -3171.981583 9.504164 BFGS: 68 16:02:38 -3173.682232 9.492353 BFGS: 69 16:02:43 -3175.378615 9.480524 BFGS: 70 16:02:49 -3177.070761 9.468692 BFGS: 71 16:02:55 -3178.758688 9.456869 BFGS: 72 16:02:59 -3180.442483 9.445956 BFGS: 73 16:03:04 -3182.122590 9.434639 BFGS: 74 16:03:10 -3183.798715 9.422851 BFGS: 75 16:03:15 -3185.470601 9.411112 BFGS: 76 16:03:21 -3187.138232 9.399421 BFGS: 77 16:03:27 -3188.801590 9.387784 BFGS: 78 16:03:30 -3190.460650 9.376204 BFGS: 79 16:03:35 -3192.115387 9.364687 BFGS: 80 16:03:38 -3193.765771 9.353239 BFGS: 81 16:03:42 -3195.411775 9.341745 BFGS: 82 16:03:48 -3197.053410 9.330444 BFGS: 83 16:03:54 -3198.690591 9.319230 BFGS: 84 16:03:59 -3200.323469 9.308347 BFGS: 85 16:04:02 -3201.952217 9.297317 BFGS: 86 16:04:06 -3203.576386 9.286389 BFGS: 87 16:04:10 -3205.195936 9.275571 BFGS: 88 16:04:13 -3206.810830 9.264867 BFGS: 89 16:04:18 -3208.421034 9.254284 BFGS: 90 16:04:23 -3210.026515 9.243826 BFGS: 91 16:04:28 -3211.627245 9.233501 BFGS: 92 16:04:33 -3213.223201 9.223312 BFGS: 93 16:04:37 -3214.814361 9.213266 BFGS: 94 16:04:42 -3216.400892 9.203846 BFGS: 95 16:04:45 -3217.982978 9.194323 BFGS: 96 16:04:49 -3219.560512 9.184698 BFGS: 97 16:04:52 -3221.133208 9.175233 BFGS: 98 16:04:55 -3222.701074 9.165933 BFGS: 99 16:04:58 -3224.264122 9.156801 BFGS: 100 16:05:04 -3225.822373 9.147841 BFGS: 101 16:05:09 -3227.375865 9.138817 BFGS: 102 16:05:12 -3228.924975 9.131165 BFGS: 103 16:05:18 -3230.469627 9.122701 BFGS: 104 16:05:22 -3232.009625 9.114422 BFGS: 105 16:05:27 -3233.545048 9.106808 BFGS: 106 16:05:34 -3235.075931 9.098893 BFGS: 107 16:05:39 -3236.602402 9.091647 BFGS: 108 16:05:45 -3238.124542 9.084093 BFGS: 109 16:05:49 -3239.642367 9.077213 BFGS: 110 16:05:53 -3241.156034 9.070037 BFGS: 111 16:06:00 -3242.665512 9.063053 BFGS: 112 16:06:06 -3244.170925 9.056741 BFGS: 113 16:06:10 -3245.672334 9.050133 BFGS: 114 16:06:15 -3247.169804 9.043715 BFGS: 115 16:06:24 -3248.663426 9.037485 BFGS: 116 16:06:34 -3250.153405 9.031921 BFGS: 117 16:06:40 -3251.639878 9.026537 BFGS: 118 16:06:47 -3253.122746 9.020848 BFGS: 119 16:06:51 -3254.602146 9.016064 BFGS: 120 16:06:55 -3256.078284 9.010720 BFGS: 121 16:07:02 -3257.551140 9.005555 BFGS: 122 16:07:09 -3259.020832 9.001288 BFGS: 123 16:07:17 -3260.487477 8.996595 BFGS: 124 16:07:23 -3261.951460 8.992429 BFGS: 125 16:07:29 -3263.412575 8.987940 BFGS: 126 16:07:33 -3264.870862 8.983604 BFGS: 127 16:07:36 -3266.326406 8.979420 BFGS: 128 16:07:41 -3267.779304 8.975624 BFGS: 129 16:07:49 -3269.229633 8.971730 BFGS: 130 16:07:54 -3270.677565 8.968816 BFGS: 131 16:07:58 -3272.123228 8.965261 BFGS: 132 16:08:02 -3273.566575 8.961819 BFGS: 133 16:08:06 -3275.007740 8.959223 BFGS: 134 16:08:13 -3276.446805 8.956034 BFGS: 135 16:08:17 -3277.883802 8.952960 BFGS: 136 16:08:23 -3279.318839 8.950246 BFGS: 137 16:08:32 -3280.752038 8.947395 BFGS: 138 16:08:38 -3282.183383 8.944663 BFGS: 139 16:08:43 -3283.613074 8.942883 BFGS: 140 16:08:45 -3285.041091 8.940393 BFGS: 141 16:08:53 -3286.467501 8.938001 BFGS: 142 16:08:58 -3287.892362 8.935704 BFGS: 143 16:09:03 -3289.315740 8.933503 BFGS: 144 16:09:07 -3290.737827 8.932115 BFGS: 145 16:09:11 -3292.158685 8.930579 BFGS: 146 16:09:14 -3293.578320 8.928654 BFGS: 147 16:09:18 -3294.996758 8.927045 BFGS: 148 16:09:22 -3296.414063 8.925263 BFGS: 149 16:09:24 -3297.830246 8.923554 BFGS: 150 16:09:28 -3299.245355 8.921917 BFGS: 151 16:09:33 -3300.659439 8.920349 BFGS: 152 16:09:36 -3302.072543 8.918848 BFGS: 153 16:09:41 -3303.484712 8.917410 BFGS: 154 16:09:46 -3304.895988 8.916033 BFGS: 155 16:09:51 -3306.306414 8.914714 BFGS: 156 16:09:55 -3307.716029 8.913451 BFGS: 157 16:09:58 -3309.124872 8.912241 BFGS: 158 16:10:01 -3310.532982 8.911081 BFGS: 159 16:10:06 -3311.940452 8.910452 BFGS: 160 16:10:10 -3313.347345 8.909370 BFGS: 161 16:10:13 -3314.753616 8.908332 BFGS: 162 16:10:16 -3316.159294 8.907335 BFGS: 163 16:10:18 -3317.564407 8.906376 BFGS: 164 16:10:22 -3318.969010 8.905936 BFGS: 165 16:10:26 -3320.373103 8.905529 BFGS: 166 16:10:30 -3321.776799 8.904689 BFGS: 167 16:10:34 -3323.180090 8.904355 BFGS: 168 16:10:37 -3324.583010 8.903561 BFGS: 169 16:10:42 -3325.985520 8.903025 BFGS: 170 16:10:47 -3327.387640 8.902261 BFGS: 171 16:10:50 -3328.789379 8.901513 BFGS: 172 16:10:54 -3330.190754 8.900779 BFGS: 173 16:10:58 -3331.591779 8.900060 BFGS: 174 16:11:03 -3332.992470 8.899353 BFGS: 175 16:11:07 -3334.392841 8.898657 BFGS: 176 16:11:11 -3335.792964 8.898813 BFGS: 177 16:11:16 -3337.192898 8.898128 BFGS: 178 16:11:22 -3338.592553 8.897691 BFGS: 179 16:11:24 -3339.992006 8.897038 BFGS: 180 16:11:30 -3341.391183 8.896381 BFGS: 181 16:11:36 -3342.790115 8.896206 BFGS: 182 16:11:40 -3344.188863 8.896021 BFGS: 183 16:11:42 -3345.587440 8.895358 BFGS: 184 16:11:44 -3346.985794 8.894690 BFGS: 185 16:11:48 -3348.383927 8.894017 BFGS: 186 16:11:51 -3349.781842 8.893341 BFGS: 187 16:11:55 -3351.179545 8.892661 BFGS: 188 16:11:59 -3352.577038 8.891977 BFGS: 189 16:12:01 -3353.974353 8.891772 BFGS: 190 16:12:06 -3355.371609 8.891917 BFGS: 191 16:12:09 -3356.768797 8.891210 BFGS: 192 16:12:11 -3358.165771 8.890490 BFGS: 193 16:12:13 -3359.562543 8.889759 BFGS: 194 16:12:14 -3360.959118 8.889015 BFGS: 195 16:12:15 -3362.355501 8.888258 BFGS: 196 16:12:17 -3363.751739 8.887972 BFGS: 197 16:12:21 -3365.147854 8.887181 BFGS: 198 16:12:23 -3366.543799 8.886861 BFGS: 199 16:12:25 -3367.939732 8.886893 BFGS: 200 16:12:28 -3369.335740 8.886055 BFGS: 201 16:12:30 -3370.731553 8.885201 BFGS: 202 16:12:33 -3372.127187 8.884815 BFGS: 203 16:12:34 -3373.522774 8.883930 BFGS: 204 16:12:36 -3374.918152 8.883030 BFGS: 205 16:12:38 -3376.313325 8.882113 BFGS: 206 16:12:40 -3377.708339 8.881664 BFGS: 207 16:12:41 -3379.103078 8.880724 BFGS: 208 16:12:43 -3380.497615 8.879765 BFGS: 209 16:12:44 -3381.892053 8.880255 BFGS: 210 16:12:46 -3383.286573 8.879241 BFGS: 211 16:12:47 -3384.680848 8.878216 BFGS: 212 16:12:49 -3386.074903 8.877177 BFGS: 213 16:12:50 -3387.469006 8.878077 BFGS: 214 16:12:52 -3388.862953 8.877037 BFGS: 215 16:12:53 -3390.256725 8.875955 BFGS: 216 16:12:54 -3391.650339 8.875331 BFGS: 217 16:12:56 -3393.043661 8.874203 BFGS: 218 16:12:57 -3394.436786 8.873058 BFGS: 219 16:12:59 -3395.829720 8.871896 BFGS: 220 16:13:00 -3397.222535 8.871202 BFGS: 221 16:13:01 -3398.615317 8.870010 BFGS: 222 16:13:03 -3400.007900 8.868792 BFGS: 223 16:13:06 -3401.400287 8.867553 BFGS: 224 16:13:07 -3402.792478 8.866294 BFGS: 225 16:13:08 -3404.184475 8.865014 BFGS: 226 16:13:09 -3405.576277 8.863715 BFGS: 227 16:13:10 -3406.967943 8.862882 BFGS: 228 16:13:12 -3408.359479 8.861546 BFGS: 229 16:13:14 -3409.750821 8.860676 BFGS: 230 16:13:16 -3411.142031 8.859268 BFGS: 231 16:13:19 -3412.533050 8.857851 BFGS: 232 16:13:21 -3413.923879 8.856420 BFGS: 233 16:13:23 -3415.314678 8.855396 BFGS: 234 16:13:25 -3416.705606 8.853901 BFGS: 235 16:13:27 -3418.096428 8.852386 BFGS: 236 16:13:29 -3419.487158 8.851335 BFGS: 237 16:13:31 -3420.877927 8.849812 BFGS: 238 16:13:33 -3422.268590 8.848258 BFGS: 239 16:13:34 -3423.659156 8.846672 BFGS: 240 16:13:36 -3425.049636 8.845057 BFGS: 241 16:13:38 -3426.440038 8.843412 BFGS: 242 16:13:39 -3427.830370 8.841738 BFGS: 243 16:13:41 -3429.220641 8.840037 BFGS: 244 16:13:43 -3430.610860 8.838308 BFGS: 245 16:13:44 -3432.001034 8.836552 BFGS: 246 16:13:46 -3433.391173 8.834770 BFGS: 247 16:13:48 -3434.781358 8.833448 BFGS: 248 16:13:50 -3436.171581 8.831626 BFGS: 249 16:13:51 -3437.561773 8.829773 BFGS: 250 16:13:53 -3438.951946 8.827891 BFGS: 251 16:13:55 -3440.342112 8.825980 BFGS: 252 16:13:56 -3441.732281 8.824040 BFGS: 253 16:13:59 -3443.122464 8.822071 BFGS: 254 16:14:00 -3444.512668 8.820075 BFGS: 255 16:14:01 -3445.902905 8.818050 BFGS: 256 16:14:03 -3447.293182 8.815996 BFGS: 257 16:14:04 -3448.683509 8.813914 BFGS: 258 16:14:07 -3450.073893 8.811803 BFGS: 259 16:14:08 -3451.464344 8.809663 BFGS: 260 16:14:10 -3452.854868 8.807495 BFGS: 261 16:14:12 -3454.245472 8.805297 BFGS: 262 16:14:13 -3455.636162 8.803070 BFGS: 263 16:14:14 -3457.026945 8.800813 BFGS: 264 16:14:16 -3458.417824 8.798526 BFGS: 265 16:14:17 -3459.808804 8.796209 BFGS: 266 16:14:19 -3461.199887 8.793863 BFGS: 267 16:14:21 -3462.591075 8.791486 BFGS: 268 16:14:25 -3463.982367 8.789079 BFGS: 269 16:14:28 -3465.373803 8.787130 BFGS: 270 16:14:31 -3466.765520 8.784656 BFGS: 271 16:14:32 -3468.157363 8.782641 BFGS: 272 16:14:34 -3469.549369 8.780120 BFGS: 273 16:14:36 -3470.941477 8.777564 BFGS: 274 16:14:38 -3472.333673 8.774977 BFGS: 275 16:14:40 -3473.725936 8.772362 BFGS: 276 16:14:44 -3475.118250 8.769718 BFGS: 277 16:14:49 -3476.510601 8.767047 BFGS: 278 16:14:52 -3477.902982 8.764347 BFGS: 279 16:14:54 -3479.295385 8.761620 BFGS: 280 16:14:57 -3480.687803 8.758864 BFGS: 281 16:15:01 -3482.080232 8.756079 BFGS: 282 16:15:02 -3483.472698 8.753754 BFGS: 283 16:15:02 -3484.865240 8.750910 BFGS: 284 16:15:04 -3486.257830 8.748525 BFGS: 285 16:15:05 -3487.650500 8.745857 BFGS: 286 16:15:07 -3489.043278 8.742909 BFGS: 287 16:15:10 -3490.436026 8.739931 BFGS: 288 16:15:12 -3491.828771 8.737166 BFGS: 289 16:15:13 -3493.221555 8.734126 BFGS: 290 16:15:15 -3494.614349 8.731543 BFGS: 291 16:15:16 -3496.007274 8.728442 BFGS: 292 16:15:18 -3497.400117 8.725301 BFGS: 293 16:15:20 -3498.792866 8.722123 BFGS: 294 16:15:22 -3500.185504 8.718908 BFGS: 295 16:15:23 -3501.578017 8.715657 BFGS: 296 16:15:25 -3502.970388 8.712370 BFGS: 297 16:15:27 -3504.362598 8.709048 BFGS: 298 16:15:29 -3505.754627 8.705691 BFGS: 299 16:15:30 -3507.146544 8.702725 BFGS: 300 16:15:31 -3508.538407 8.699282 BFGS: 301 16:15:33 -3509.929995 8.695810 BFGS: 302 16:15:35 -3511.321291 8.692307 BFGS: 303 16:15:36 -3512.712270 8.688771 BFGS: 304 16:15:38 -3514.102928 8.685694 BFGS: 305 16:15:40 -3515.493200 8.682091 BFGS: 306 16:15:42 -3516.883070 8.678457 BFGS: 307 16:15:44 -3518.272497 8.674791 BFGS: 308 16:15:46 -3519.661443 8.671094 BFGS: 309 16:15:48 -3521.049869 8.667366 BFGS: 310 16:15:50 -3522.437735 8.663607 BFGS: 311 16:15:51 -3523.824998 8.659818 BFGS: 312 16:15:53 -3525.211642 8.656246 BFGS: 313 16:15:55 -3526.597730 8.652394 BFGS: 314 16:15:57 -3527.983076 8.648518 BFGS: 315 16:15:59 -3529.367634 8.644615 BFGS: 316 16:16:01 -3530.751360 8.640688 BFGS: 317 16:16:03 -3532.134207 8.636736 BFGS: 318 16:16:05 -3533.516145 8.633253 BFGS: 319 16:16:07 -3534.897209 8.629249 BFGS: 320 16:16:09 -3536.277247 8.625230 BFGS: 321 16:16:12 -3537.656216 8.621192 BFGS: 322 16:16:14 -3539.034072 8.617137 BFGS: 323 16:16:16 -3540.410834 8.614051 BFGS: 324 16:16:17 -3541.786571 8.609985 BFGS: 325 16:16:19 -3543.161053 8.605906 BFGS: 326 16:16:21 -3544.534248 8.601815 BFGS: 327 16:16:23 -3545.906125 8.597714 BFGS: 328 16:16:26 -3547.276655 8.593605 BFGS: 329 16:16:29 -3548.645814 8.589490 BFGS: 330 16:16:31 -3550.013580 8.585371 BFGS: 331 16:16:33 -3551.379934 8.581250 BFGS: 332 16:16:35 -3552.744861 8.577128 BFGS: 333 16:16:37 -3554.108516 8.573500 BFGS: 334 16:16:39 -3555.470841 8.569370 BFGS: 335 16:16:42 -3556.831706 8.565245 BFGS: 336 16:16:44 -3558.191109 8.561127 BFGS: 337 16:16:46 -3559.549057 8.557018 BFGS: 338 16:16:48 -3560.905555 8.552917 BFGS: 339 16:16:51 -3562.260615 8.548826 BFGS: 340 16:16:52 -3563.614253 8.544746 BFGS: 341 16:16:54 -3564.966486 8.540677 BFGS: 342 16:16:56 -3566.317334 8.536622 BFGS: 343 16:16:58 -3567.666820 8.532580 BFGS: 344 16:17:00 -3569.014971 8.528551 BFGS: 345 16:17:02 -3570.361813 8.524537 BFGS: 346 16:17:04 -3571.707376 8.520538 BFGS: 347 16:17:07 -3573.051691 8.516554 BFGS: 348 16:17:09 -3574.394788 8.512584 BFGS: 349 16:17:11 -3575.736701 8.508630 BFGS: 350 16:17:15 -3577.077464 8.504691 BFGS: 351 16:17:17 -3578.417110 8.500767 BFGS: 352 16:17:19 -3579.755674 8.496858 BFGS: 353 16:17:21 -3581.093188 8.492963 BFGS: 354 16:17:24 -3582.429740 8.489576 BFGS: 355 16:17:28 -3583.765469 8.485712 BFGS: 356 16:17:29 -3585.100230 8.481862 BFGS: 357 16:17:31 -3586.434062 8.478024 BFGS: 358 16:17:34 -3587.766999 8.474198 BFGS: 359 16:17:35 -3589.099075 8.470382 BFGS: 360 16:17:37 -3590.430321 8.466576 BFGS: 361 16:17:39 -3591.760768 8.462780 BFGS: 362 16:17:41 -3593.090447 8.458991 BFGS: 363 16:17:42 -3594.419385 8.455211 BFGS: 364 16:17:46 -3595.747611 8.451437 BFGS: 365 16:17:48 -3597.075150 8.447670 BFGS: 366 16:17:52 -3598.402027 8.443908 BFGS: 367 16:17:53 -3599.728268 8.440646 BFGS: 368 16:17:55 -3601.053996 8.436905 BFGS: 369 16:17:58 -3602.379128 8.433162 BFGS: 370 16:18:00 -3603.703685 8.429419 BFGS: 371 16:18:06 -3605.027686 8.425676 BFGS: 372 16:18:09 -3606.351151 8.421933 BFGS: 373 16:18:14 -3607.674100 8.418189 BFGS: 374 16:18:16 -3608.996550 8.414444 BFGS: 375 16:18:18 -3610.318518 8.410697 BFGS: 376 16:18:22 -3611.640019 8.406947 BFGS: 377 16:18:24 -3612.961070 8.403193 BFGS: 378 16:18:27 -3614.281683 8.399435 BFGS: 379 16:18:28 -3615.601874 8.395673 BFGS: 380 16:18:30 -3616.921654 8.391904 BFGS: 381 16:18:32 -3618.241072 8.388626 BFGS: 382 16:18:34 -3619.560218 8.385341 BFGS: 383 16:18:38 -3620.879033 8.381802 BFGS: 384 16:18:39 -3622.197519 8.378005 BFGS: 385 16:18:41 -3623.515641 8.374200 BFGS: 386 16:18:43 -3624.833412 8.370386 BFGS: 387 16:18:45 -3626.150898 8.367058 BFGS: 388 16:18:46 -3627.468075 8.363217 BFGS: 389 16:18:48 -3628.784931 8.359365 BFGS: 390 16:18:50 -3630.101481 8.355504 BFGS: 391 16:18:52 -3631.417728 8.351632 BFGS: 392 16:18:53 -3632.733723 8.348244 BFGS: 393 16:18:56 -3634.049493 8.344343 BFGS: 394 16:19:00 -3635.364981 8.340427 BFGS: 395 16:19:03 -3636.680192 8.336498 BFGS: 396 16:19:06 -3637.995134 8.332556 BFGS: 397 16:19:09 -3639.309825 8.329096 BFGS: 398 16:19:10 -3640.624347 8.325125 BFGS: 399 16:19:12 -3641.938599 8.321137 BFGS: 400 16:19:17 -3643.252602 8.317135 BFGS: 401 16:19:19 -3644.566362 8.313116 BFGS: 402 16:19:24 -3645.879885 8.309081 BFGS: 403 16:19:26 -3647.193179 8.305029 BFGS: 404 16:19:28 -3648.506247 8.300961 BFGS: 405 16:19:33 -3649.819095 8.296875 BFGS: 406 16:19:37 -3651.131728 8.292771 BFGS: 407 16:19:40 -3652.444150 8.288650 BFGS: 408 16:19:43 -3653.756397 8.285008 BFGS: 409 16:19:45 -3655.068435 8.280852 BFGS: 410 16:19:47 -3656.380313 8.277176 BFGS: 411 16:19:51 -3657.692152 8.273033 BFGS: 412 16:19:53 -3659.003783 8.268852 BFGS: 413 16:19:54 -3660.315211 8.264640 BFGS: 414 16:19:56 -3661.626475 8.260898 BFGS: 415 16:19:59 -3662.937516 8.256654 BFGS: 416 16:20:02 -3664.248396 8.252376 BFGS: 417 16:20:07 -3665.559109 8.248072 BFGS: 418 16:20:09 -3666.869659 8.243746 BFGS: 419 16:20:11 -3668.180046 8.239398 BFGS: 420 16:20:13 -3669.490274 8.235030 BFGS: 421 16:20:16 -3670.800346 8.230641 BFGS: 422 16:20:18 -3672.110263 8.226231 BFGS: 423 16:20:19 -3673.420028 8.221800 BFGS: 424 16:20:21 -3674.729644 8.217348 BFGS: 425 16:20:24 -3676.039114 8.212876 BFGS: 426 16:20:26 -3677.348438 8.208383 BFGS: 427 16:20:28 -3678.657620 8.203869 BFGS: 428 16:20:30 -3679.966662 8.199334 BFGS: 429 16:20:33 -3681.275566 8.194778 BFGS: 430 16:20:35 -3682.584334 8.190201 BFGS: 431 16:20:39 -3683.892968 8.185603 BFGS: 432 16:20:41 -3685.201470 8.180983 BFGS: 433 16:20:44 -3686.509842 8.176343 BFGS: 434 16:20:46 -3687.818085 8.171681 BFGS: 435 16:20:48 -3689.126202 8.166998 BFGS: 436 16:20:52 -3690.434193 8.162294 BFGS: 437 16:20:54 -3691.742062 8.157568 BFGS: 438 16:20:55 -3693.049809 8.152821 BFGS: 439 16:20:58 -3694.357436 8.148053 BFGS: 440 16:20:59 -3695.664944 8.143263 BFGS: 441 16:21:00 -3696.972366 8.138702 BFGS: 442 16:21:04 -3698.279697 8.133872 BFGS: 443 16:21:05 -3699.586909 8.129020 BFGS: 444 16:21:07 -3700.894006 8.124146 BFGS: 445 16:21:10 -3702.201002 8.119501 BFGS: 446 16:21:13 -3703.507911 8.114577 BFGS: 447 16:21:17 -3704.814712 8.109639 BFGS: 448 16:21:19 -3706.121425 8.105178 BFGS: 449 16:21:22 -3707.428148 8.100444 BFGS: 450 16:21:23 -3708.734754 8.095440 BFGS: 451 16:21:25 -3710.041326 8.091281 BFGS: 452 16:21:27 -3711.347953 8.086220 BFGS: 453 16:21:30 -3712.654465 8.081389 BFGS: 454 16:21:33 -3713.960887 8.076287 BFGS: 455 16:21:34 -3715.267201 8.071170 BFGS: 456 16:21:36 -3716.573412 8.066033 BFGS: 457 16:21:38 -3717.879521 8.060875 BFGS: 458 16:21:39 -3719.185660 8.056567 BFGS: 459 16:21:41 -3720.491852 8.051353 BFGS: 460 16:21:43 -3721.797900 8.046131 BFGS: 461 16:21:45 -3723.103825 8.040891 BFGS: 462 16:21:46 -3724.409632 8.035631 BFGS: 463 16:21:48 -3725.715327 8.030351 BFGS: 464 16:21:49 -3727.020912 8.025050 BFGS: 465 16:21:51 -3728.326405 8.019979 BFGS: 466 16:21:55 -3729.631814 8.014624 BFGS: 467 16:21:59 -3730.937114 8.009251 BFGS: 468 16:22:04 -3732.242308 8.003860 BFGS: 469 16:22:05 -3733.547398 7.998449 BFGS: 470 16:22:07 -3734.852385 7.993018 BFGS: 471 16:22:09 -3736.157270 7.987566 BFGS: 472 16:22:11 -3737.462052 7.982093 BFGS: 473 16:22:12 -3738.766731 7.976599 BFGS: 474 16:22:13 -3740.071308 7.971083 BFGS: 475 16:22:16 -3741.375782 7.965545 BFGS: 476 16:22:17 -3742.680154 7.959986 BFGS: 477 16:22:19 -3743.984422 7.954405 BFGS: 478 16:22:20 -3745.288586 7.948802 BFGS: 479 16:22:22 -3746.592647 7.943178 BFGS: 480 16:22:27 -3747.896603 7.937531 BFGS: 481 16:22:31 -3749.200455 7.931863 BFGS: 482 16:22:34 -3750.504201 7.926174 BFGS: 483 16:22:36 -3751.807841 7.920462 BFGS: 484 16:22:39 -3753.111374 7.914729 BFGS: 485 16:22:42 -3754.414853 7.909476 BFGS: 486 16:22:43 -3755.718282 7.903908 BFGS: 487 16:22:46 -3757.021651 7.898108 BFGS: 488 16:22:49 -3758.324897 7.892284 BFGS: 489 16:22:53 -3759.628024 7.886438 BFGS: 490 16:22:55 -3760.931033 7.880570 BFGS: 491 16:22:59 -3762.233924 7.874682 BFGS: 492 16:23:02 -3763.536703 7.869022 BFGS: 493 16:23:05 -3764.839366 7.863092 BFGS: 494 16:23:07 -3766.141937 7.858517 BFGS: 495 16:23:09 -3767.444620 7.853453 BFGS: 496 16:23:11 -3768.747240 7.847510 BFGS: 497 16:23:13 -3770.049672 7.841518 BFGS: 498 16:23:15 -3771.351988 7.835495 BFGS: 499 16:23:16 -3772.654212 7.830819 BFGS: 500 16:23:18 -3773.956382 7.824730 BFGS: 501 16:23:19 -3775.258474 7.818619 BFGS: 502 16:23:20 -3776.560464 7.812487 BFGS: 503 16:23:22 -3777.862339 7.806333 BFGS: 504 16:23:24 -3779.164093 7.800157 BFGS: 505 16:23:28 -3780.465803 7.794463 BFGS: 506 16:23:32 -3781.767415 7.788270 BFGS: 507 16:23:35 -3783.068892 7.782047 BFGS: 508 16:23:39 -3784.370231 7.775795 BFGS: 509 16:23:42 -3785.671430 7.769517 BFGS: 510 16:23:46 -3786.972487 7.763214 BFGS: 511 16:23:49 -3788.273400 7.756887 BFGS: 512 16:23:52 -3789.574168 7.750537 BFGS: 513 16:23:55 -3790.874789 7.744415 BFGS: 514 16:23:57 -3792.175224 7.738027 BFGS: 515 16:23:59 -3793.475521 7.731614 BFGS: 516 16:24:02 -3794.775676 7.725177 BFGS: 517 16:24:05 -3796.075683 7.718716 BFGS: 518 16:24:07 -3797.375541 7.712232 BFGS: 519 16:24:10 -3798.675316 7.706734 BFGS: 520 16:24:13 -3799.975095 7.701087 BFGS: 521 16:24:15 -3801.274890 7.695461 BFGS: 522 16:24:18 -3802.574484 7.689141 BFGS: 523 16:24:20 -3803.874034 7.683432 BFGS: 524 16:24:23 -3805.173310 7.676828 BFGS: 525 16:24:25 -3806.472454 7.670192 BFGS: 526 16:24:28 -3807.771430 7.663530 BFGS: 527 16:24:30 -3809.070231 7.656842 BFGS: 528 16:24:32 -3810.368854 7.650130 BFGS: 529 16:24:34 -3811.667444 7.644273 BFGS: 530 16:24:36 -3812.965881 7.637572 BFGS: 531 16:24:39 -3814.264131 7.630824 BFGS: 532 16:24:42 -3815.562181 7.624037 BFGS: 533 16:24:45 -3816.860032 7.617219 BFGS: 534 16:24:49 -3818.157685 7.610372 BFGS: 535 16:24:51 -3819.455140 7.603499 BFGS: 536 16:24:54 -3820.752506 7.597985 BFGS: 537 16:24:57 -3822.049736 7.591039 BFGS: 538 16:24:59 -3823.346732 7.584076 BFGS: 539 16:25:00 -3824.643522 7.577095 BFGS: 540 16:25:02 -3825.940103 7.570093 BFGS: 541 16:25:04 -3827.236476 7.563069 BFGS: 542 16:25:06 -3828.532637 7.556021 BFGS: 543 16:25:07 -3829.828581 7.548951 BFGS: 544 16:25:09 -3831.124305 7.541856 BFGS: 545 16:25:10 -3832.419806 7.534738 BFGS: 546 16:25:12 -3833.715079 7.527596 BFGS: 547 16:25:13 -3835.010122 7.520429 BFGS: 548 16:25:15 -3836.304964 7.513679 BFGS: 549 16:25:17 -3837.599664 7.506971 BFGS: 550 16:25:19 -3838.894109 7.500612 BFGS: 551 16:25:20 -3840.188394 7.493354 BFGS: 552 16:25:22 -3841.482592 7.487829 BFGS: 553 16:25:24 -3842.776616 7.480717 BFGS: 554 16:25:27 -3844.070477 7.473363 BFGS: 555 16:25:29 -3845.364095 7.465990 BFGS: 556 16:25:31 -3846.657452 7.458599 BFGS: 557 16:25:33 -3847.950542 7.451187 BFGS: 558 16:25:36 -3849.243360 7.443751 BFGS: 559 16:25:39 -3850.535903 7.436291 BFGS: 560 16:25:41 -3851.828167 7.428806 BFGS: 561 16:25:45 -3853.120149 7.421296 BFGS: 562 16:25:47 -3854.411844 7.413760 BFGS: 563 16:25:49 -3855.703331 7.407081 BFGS: 564 16:25:51 -3856.994536 7.399557 BFGS: 565 16:25:52 -3858.285472 7.391971 BFGS: 566 16:25:54 -3859.576118 7.384347 BFGS: 567 16:25:55 -3860.866468 7.376691 BFGS: 568 16:25:57 -3862.156517 7.369512 BFGS: 569 16:25:58 -3863.446284 7.361766 BFGS: 570 16:25:59 -3864.735744 7.354005 BFGS: 571 16:26:01 -3866.024891 7.346226 BFGS: 572 16:26:04 -3867.313731 7.338932 BFGS: 573 16:26:06 -3868.602296 7.331120 BFGS: 574 16:26:09 -3869.890530 7.323276 BFGS: 575 16:26:12 -3871.178431 7.315403 BFGS: 576 16:26:14 -3872.465993 7.307503 BFGS: 577 16:26:14 -3873.753213 7.299576 BFGS: 578 16:26:16 -3875.040083 7.291621 BFGS: 579 16:26:17 -3876.326633 7.284082 BFGS: 580 16:26:18 -3877.612881 7.276043 BFGS: 581 16:26:21 -3878.898753 7.267991 BFGS: 582 16:26:22 -3880.184246 7.259918 BFGS: 583 16:26:23 -3881.469375 7.252077 BFGS: 584 16:26:25 -3882.754186 7.243970 BFGS: 585 16:26:27 -3884.038591 7.235831 BFGS: 586 16:26:29 -3885.322622 7.228105 BFGS: 587 16:26:30 -3886.606438 7.220443 BFGS: 588 16:26:32 -3887.889845 7.212261 BFGS: 589 16:26:35 -3889.172868 7.204035 BFGS: 590 16:26:36 -3890.455581 7.196279 BFGS: 591 16:26:38 -3891.737952 7.187987 BFGS: 592 16:26:40 -3893.019904 7.179657 BFGS: 593 16:26:42 -3894.301428 7.171297 BFGS: 594 16:26:44 -3895.582520 7.162908 BFGS: 595 16:26:45 -3896.863320 7.155886 BFGS: 596 16:26:47 -3898.143648 7.148358 BFGS: 597 16:26:49 -3899.423654 7.139839 BFGS: 598 16:26:51 -3900.703211 7.131312 BFGS: 599 16:26:53 -3901.982335 7.123649 BFGS: 600 16:26:57 -3903.261136 7.115076 BFGS: 601 16:26:58 -3904.539461 7.106472 BFGS: 602 16:27:00 -3905.817302 7.097839 BFGS: 603 16:27:02 -3907.094655 7.089179 BFGS: 604 16:27:04 -3908.371516 7.080490 BFGS: 605 16:27:05 -3909.647879 7.071774 BFGS: 606 16:27:07 -3910.923740 7.063029 BFGS: 607 16:27:08 -3912.199096 7.054255 BFGS: 608 16:27:11 -3913.473939 7.045452 BFGS: 609 16:27:12 -3914.748266 7.036620 BFGS: 610 16:27:14 -3916.022071 7.027758 BFGS: 611 16:27:16 -3917.295349 7.018866 BFGS: 612 16:27:17 -3918.568093 7.009945 BFGS: 613 16:27:19 -3919.840386 7.002015 BFGS: 614 16:27:21 -3921.112126 6.993048 BFGS: 615 16:27:22 -3922.383370 6.984031 BFGS: 616 16:27:24 -3923.654062 6.974987 BFGS: 617 16:27:26 -3924.924203 6.965914 BFGS: 618 16:27:28 -3926.193802 6.957065 BFGS: 619 16:27:30 -3927.462940 6.948966 BFGS: 620 16:27:32 -3928.731613 6.939803 BFGS: 621 16:27:34 -3929.999672 6.930861 BFGS: 622 16:27:38 -3931.267182 6.922112 BFGS: 623 16:27:39 -3932.534105 6.913311 BFGS: 624 16:27:41 -3933.800511 6.904025 BFGS: 625 16:27:43 -3935.066281 6.894703 BFGS: 626 16:27:44 -3936.331412 6.885347 BFGS: 627 16:27:46 -3937.595906 6.875960 BFGS: 628 16:27:48 -3938.859759 6.866540 BFGS: 629 16:27:50 -3940.122965 6.857089 BFGS: 630 16:27:52 -3941.385520 6.847605 BFGS: 631 16:27:55 -3942.647438 6.838534 BFGS: 632 16:27:57 -3943.908808 6.829850 BFGS: 633 16:27:59 -3945.169490 6.820227 BFGS: 634 16:28:02 -3946.429459 6.810602 BFGS: 635 16:28:05 -3947.688752 6.801841 BFGS: 636 16:28:07 -3948.947383 6.792111 BFGS: 637 16:28:09 -3950.205344 6.782372 BFGS: 638 16:28:12 -3951.462633 6.773125 BFGS: 639 16:28:14 -3952.719192 6.763345 BFGS: 640 16:28:16 -3953.975097 6.753788 BFGS: 641 16:28:19 -3955.230342 6.743944 BFGS: 642 16:28:20 -3956.484858 6.734065 BFGS: 643 16:28:22 -3957.738760 6.725044 BFGS: 644 16:28:24 -3958.991818 6.715108 BFGS: 645 16:28:26 -3960.244193 6.705396 BFGS: 646 16:28:29 -3961.495838 6.695407 BFGS: 647 16:28:31 -3962.746696 6.685371 BFGS: 648 16:28:33 -3963.996765 6.675295 BFGS: 649 16:28:35 -3965.246036 6.665181 BFGS: 650 16:28:36 -3966.494591 6.655543 BFGS: 651 16:28:37 -3967.742418 6.645355 BFGS: 652 16:28:38 -3968.989433 6.635125 BFGS: 653 16:28:39 -3970.235621 6.624860 BFGS: 654 16:28:41 -3971.480974 6.614559 BFGS: 655 16:28:42 -3972.725484 6.604222 BFGS: 656 16:28:45 -3973.969196 6.594364 BFGS: 657 16:28:46 -3975.212096 6.584465 BFGS: 658 16:28:48 -3976.454149 6.574035 BFGS: 659 16:28:50 -3977.695324 6.563555 BFGS: 660 16:28:51 -3978.935627 6.553043 BFGS: 661 16:28:53 -3980.175042 6.542492 BFGS: 662 16:28:55 -3981.413690 6.532797 BFGS: 663 16:28:56 -3982.651365 6.522182 BFGS: 664 16:28:57 -3983.888134 6.511535 BFGS: 665 16:28:59 -3985.123996 6.500847 BFGS: 666 16:29:00 -3986.358963 6.490634 BFGS: 667 16:29:01 -3987.593097 6.479866 BFGS: 668 16:29:03 -3988.826279 6.469057 BFGS: 669 16:29:04 -3990.058503 6.458209 BFGS: 670 16:29:05 -3991.289759 6.447322 BFGS: 671 16:29:06 -3992.520117 6.436910 BFGS: 672 16:29:08 -3993.749539 6.425956 BFGS: 673 16:29:09 -3994.977950 6.414954 BFGS: 674 16:29:10 -3996.205407 6.404359 BFGS: 675 16:29:12 -3997.431855 6.393302 BFGS: 676 16:29:14 -3998.657261 6.382190 BFGS: 677 16:29:15 -3999.881624 6.371033 BFGS: 678 16:29:17 -4001.104938 6.359835 BFGS: 679 16:29:19 -4002.327194 6.348595 BFGS: 680 16:29:20 -4003.548547 6.338726 BFGS: 681 16:29:21 -4004.768985 6.328323 BFGS: 682 16:29:23 -4005.988322 6.316978 BFGS: 683 16:29:24 -4007.206641 6.306482 BFGS: 684 16:29:26 -4008.423866 6.295048 BFGS: 685 16:29:27 -4009.639977 6.283570 BFGS: 686 16:29:28 -4010.854965 6.272051 BFGS: 687 16:29:30 -4012.068821 6.260491 BFGS: 688 16:29:31 -4013.281563 6.249337 BFGS: 689 16:29:33 -4014.493250 6.238185 BFGS: 690 16:29:34 -4015.703806 6.226500 BFGS: 691 16:29:35 -4016.913177 6.214779 BFGS: 692 16:29:36 -4018.121363 6.203015 BFGS: 693 16:29:38 -4019.328409 6.192106 BFGS: 694 16:29:39 -4020.534310 6.180250 BFGS: 695 16:29:41 -4021.738956 6.168364 BFGS: 696 16:29:42 -4022.942380 6.156432 BFGS: 697 16:29:43 -4024.144568 6.144716 BFGS: 698 16:29:45 -4025.345544 6.132713 BFGS: 699 16:29:46 -4026.545267 6.120665 BFGS: 700 16:29:47 -4027.743724 6.108570 BFGS: 701 16:29:50 -4028.940907 6.096429 BFGS: 702 16:29:52 -4030.136875 6.085657 BFGS: 703 16:29:54 -4031.331810 6.074440 BFGS: 704 16:29:55 -4032.525409 6.063070 BFGS: 705 16:29:57 -4033.717788 6.050762 BFGS: 706 16:29:59 -4034.908829 6.038408 BFGS: 707 16:30:00 -4036.098528 6.026005 BFGS: 708 16:30:02 -4037.286878 6.013557 BFGS: 709 16:30:03 -4038.473868 6.001062 BFGS: 710 16:30:05 -4039.659489 5.988522 BFGS: 711 16:30:06 -4040.843827 5.976836 BFGS: 712 16:30:08 -4042.026800 5.964232 BFGS: 713 16:30:10 -4043.208353 5.951572 BFGS: 714 16:30:11 -4044.388503 5.939378 BFGS: 715 16:30:13 -4045.567301 5.927487 BFGS: 716 16:30:15 -4046.744705 5.914661 BFGS: 717 16:30:17 -4047.920661 5.901791 BFGS: 718 16:30:18 -4049.095160 5.888875 BFGS: 719 16:30:20 -4050.268188 5.875914 BFGS: 720 16:30:21 -4051.439733 5.862907 BFGS: 721 16:30:23 -4052.609783 5.849853 BFGS: 722 16:30:24 -4053.778327 5.836753 BFGS: 723 16:30:26 -4054.945416 5.824506 BFGS: 724 16:30:28 -4056.111020 5.811312 BFGS: 725 16:30:29 -4057.275064 5.798066 BFGS: 726 16:30:30 -4058.437604 5.785167 BFGS: 727 16:30:31 -4059.598618 5.771804 BFGS: 728 16:30:32 -4060.758017 5.758411 BFGS: 729 16:30:34 -4061.915821 5.745754 BFGS: 730 16:30:35 -4063.072118 5.732803 BFGS: 731 16:30:36 -4064.226970 5.719274 BFGS: 732 16:30:38 -4065.380207 5.705694 BFGS: 733 16:30:40 -4066.531833 5.692584 BFGS: 734 16:30:41 -4067.681929 5.679360 BFGS: 735 16:30:43 -4068.830333 5.666145 BFGS: 736 16:30:44 -4069.977186 5.654015 BFGS: 737 16:30:46 -4071.122485 5.640191 BFGS: 738 16:30:47 -4072.266111 5.626317 BFGS: 739 16:30:49 -4073.408028 5.612392 BFGS: 740 16:30:51 -4074.548232 5.598935 BFGS: 741 16:30:53 -4075.686711 5.584911 BFGS: 742 16:30:55 -4076.823454 5.571287 BFGS: 743 16:30:56 -4077.958436 5.557160 BFGS: 744 16:30:57 -4079.091662 5.542979 BFGS: 745 16:30:59 -4080.223153 5.529266 BFGS: 746 16:31:01 -4081.352831 5.514975 BFGS: 747 16:31:03 -4082.480718 5.500635 BFGS: 748 16:31:05 -4083.606798 5.486242 BFGS: 749 16:31:06 -4084.731054 5.471797 BFGS: 750 16:31:07 -4085.853525 5.458203 BFGS: 751 16:31:08 -4086.974312 5.443641 BFGS: 752 16:31:10 -4088.093215 5.429485 BFGS: 753 16:31:11 -4089.210215 5.414792 BFGS: 754 16:31:12 -4090.325327 5.400065 BFGS: 755 16:31:13 -4091.438542 5.385291 BFGS: 756 16:31:14 -4092.549835 5.370466 BFGS: 757 16:31:15 -4093.659196 5.355588 BFGS: 758 16:31:16 -4094.766658 5.342081 BFGS: 759 16:31:17 -4095.872216 5.327083 BFGS: 760 16:31:18 -4096.975821 5.312037 BFGS: 761 16:31:20 -4098.077450 5.296937 BFGS: 762 16:31:21 -4099.177084 5.281782 BFGS: 763 16:31:23 -4100.274709 5.266573 BFGS: 764 16:31:24 -4101.370313 5.251307 BFGS: 765 16:31:25 -4102.463882 5.235985 BFGS: 766 16:31:26 -4103.555424 5.220868 BFGS: 767 16:31:27 -4104.644943 5.205453 BFGS: 768 16:31:28 -4105.732376 5.189972 BFGS: 769 16:31:29 -4106.817716 5.174429 BFGS: 770 16:31:30 -4107.900958 5.158828 BFGS: 771 16:31:31 -4108.982086 5.143168 BFGS: 772 16:31:33 -4110.061090 5.127450 BFGS: 773 16:31:34 -4111.137955 5.111675 BFGS: 774 16:31:36 -4112.212723 5.096236 BFGS: 775 16:31:37 -4113.285280 5.080380 BFGS: 776 16:31:39 -4114.355671 5.064447 BFGS: 777 16:31:40 -4115.423880 5.048452 BFGS: 778 16:31:41 -4116.489893 5.032391 BFGS: 779 16:31:42 -4117.553695 5.016270 BFGS: 780 16:31:43 -4118.615269 5.000088 BFGS: 781 16:31:45 -4119.674603 4.983845 BFGS: 782 16:31:47 -4120.731682 4.967542 BFGS: 783 16:31:48 -4121.786493 4.951179 BFGS: 784 16:31:50 -4122.839021 4.934756 BFGS: 785 16:31:51 -4123.889255 4.918271 BFGS: 786 16:31:52 -4124.937179 4.901727 BFGS: 787 16:31:53 -4125.982783 4.885121 BFGS: 788 16:31:54 -4127.026050 4.868454 BFGS: 789 16:31:55 -4128.066970 4.851727 BFGS: 790 16:31:56 -4129.105582 4.835460 BFGS: 791 16:31:58 -4130.141775 4.818610 BFGS: 792 16:32:00 -4131.175601 4.801695 BFGS: 793 16:32:01 -4132.207029 4.784722 BFGS: 794 16:32:02 -4133.236154 4.768470 BFGS: 795 16:32:03 -4134.262875 4.751384 BFGS: 796 16:32:04 -4135.287222 4.735134 BFGS: 797 16:32:05 -4136.309074 4.735163 BFGS: 798 16:32:07 -4137.328506 4.738145 BFGS: 799 16:32:08 -4138.345535 4.741183 BFGS: 800 16:32:11 -4139.360069 4.744071 BFGS: 801 16:32:12 -4140.372087 4.746985 BFGS: 802 16:32:13 -4141.381639 4.749840 BFGS: 803 16:32:15 -4142.388679 4.752504 BFGS: 804 16:32:17 -4143.393154 4.755322 BFGS: 805 16:32:19 -4144.395074 4.758082 BFGS: 806 16:32:22 -4145.394419 4.760789 BFGS: 807 16:32:23 -4146.391179 4.763434 BFGS: 808 16:32:24 -4147.385522 4.766022 BFGS: 809 16:32:26 -4148.377391 4.768761 BFGS: 810 16:32:28 -4149.366688 4.771093 BFGS: 811 16:32:30 -4150.353399 4.773602 BFGS: 812 16:32:31 -4151.337423 4.775944 BFGS: 813 16:32:33 -4152.318795 4.778206 BFGS: 814 16:32:36 -4153.297479 4.780446 BFGS: 815 16:32:38 -4154.273478 4.782644 BFGS: 816 16:32:40 -4155.246771 4.784795 BFGS: 817 16:32:41 -4156.217351 4.786900 BFGS: 818 16:32:43 -4157.185245 4.788952 BFGS: 819 16:32:44 -4158.150363 4.791007 BFGS: 820 16:32:45 -4159.112726 4.792955 BFGS: 821 16:32:46 -4160.072337 4.794803 BFGS: 822 16:32:47 -4161.029228 4.796625 BFGS: 823 16:32:48 -4161.983298 4.798353 BFGS: 824 16:32:49 -4162.934595 4.800072 BFGS: 825 16:32:51 -4163.883089 4.801745 BFGS: 826 16:32:53 -4164.828796 4.803355 BFGS: 827 16:32:55 -4165.771719 4.805919 BFGS: 828 16:32:57 -4166.711897 4.807090 BFGS: 829 16:32:59 -4167.649246 4.808396 BFGS: 830 16:33:01 -4168.583713 4.809720 BFGS: 831 16:33:03 -4169.515364 4.812011 BFGS: 832 16:33:04 -4170.444147 4.812898 BFGS: 833 16:33:05 -4171.370006 4.814067 BFGS: 834 16:33:07 -4172.292930 4.815127 BFGS: 835 16:33:08 -4173.212909 4.816183 BFGS: 836 16:33:11 -4174.129929 4.817187 BFGS: 837 16:33:13 -4175.043979 4.818150 BFGS: 838 16:33:15 -4175.955044 4.819061 BFGS: 839 16:33:16 -4176.863112 4.819921 BFGS: 840 16:33:19 -4177.768171 4.820728 BFGS: 841 16:33:20 -4178.670207 4.821480 BFGS: 842 16:33:21 -4179.569207 4.822176 BFGS: 843 16:33:22 -4180.465160 4.822817 BFGS: 844 16:33:23 -4181.358051 4.823401 BFGS: 845 16:33:24 -4182.247869 4.823928 BFGS: 846 16:33:25 -4183.134601 4.824397 BFGS: 847 16:33:27 -4184.018234 4.824809 BFGS: 848 16:33:28 -4184.898756 4.825163 BFGS: 849 16:33:30 -4185.776154 4.825459 BFGS: 850 16:33:31 -4186.650416 4.825697 BFGS: 851 16:33:33 -4187.521529 4.825875 BFGS: 852 16:33:35 -4188.389481 4.825995 BFGS: 853 16:33:36 -4189.254282 4.826056 BFGS: 854 16:33:37 -4190.115896 4.826051 BFGS: 855 16:33:38 -4190.974319 4.825991 BFGS: 856 16:33:39 -4191.829635 4.825875 BFGS: 857 16:33:40 -4192.681744 4.825931 BFGS: 858 16:33:42 -4193.530645 4.825807 BFGS: 859 16:33:45 -4194.376347 4.825414 BFGS: 860 16:33:46 -4195.218801 4.825051 BFGS: 861 16:33:47 -4196.057999 4.824596 BFGS: 862 16:33:48 -4196.893947 4.824803 BFGS: 863 16:33:49 -4197.726673 4.824118 BFGS: 864 16:33:51 -4198.556088 4.823358 BFGS: 865 16:33:52 -4199.382180 4.822656 BFGS: 866 16:33:55 -4200.204941 4.821893 BFGS: 867 16:33:58 -4201.024381 4.821081 BFGS: 868 16:33:59 -4201.840498 4.820286 BFGS: 869 16:34:01 -4202.653253 4.819468 BFGS: 870 16:34:02 -4203.462624 4.818475 BFGS: 871 16:34:03 -4204.268624 4.817409 BFGS: 872 16:34:03 -4205.071227 4.816281 BFGS: 873 16:34:04 -4205.870426 4.815017 BFGS: 874 16:34:05 -4206.666272 4.813785 BFGS: 875 16:34:08 -4207.458795 4.813126 BFGS: 876 16:34:09 -4208.247912 4.811709 BFGS: 877 16:34:11 -4209.033647 4.810817 BFGS: 878 16:34:13 -4209.815935 4.809480 BFGS: 879 16:34:14 -4210.594752 4.808043 BFGS: 880 16:34:15 -4211.370292 4.807027 BFGS: 881 16:34:16 -4212.142329 4.805617 BFGS: 882 16:34:18 -4212.910853 4.803747 BFGS: 883 16:34:20 -4213.675847 4.801967 BFGS: 884 16:34:22 -4214.437299 4.800078 BFGS: 885 16:34:24 -4215.195201 4.798137 BFGS: 886 16:34:26 -4215.949537 4.796129 BFGS: 887 16:34:28 -4216.700301 4.794055 BFGS: 888 16:34:29 -4217.447477 4.791918 BFGS: 889 16:34:30 -4218.191056 4.789715 BFGS: 890 16:34:31 -4218.931025 4.787446 BFGS: 891 16:34:32 -4219.667375 4.785111 BFGS: 892 16:34:33 -4220.400093 4.782710 BFGS: 893 16:34:34 -4221.129168 4.780242 BFGS: 894 16:34:36 -4221.854589 4.777708 BFGS: 895 16:34:37 -4222.576345 4.775105 BFGS: 896 16:34:39 -4223.294424 4.772436 BFGS: 897 16:34:41 -4224.008816 4.769698 BFGS: 898 16:34:43 -4224.719509 4.766892 BFGS: 899 16:34:45 -4225.426492 4.764018 BFGS: 900 16:34:46 -4226.129754 4.761075 BFGS: 901 16:34:48 -4226.829328 4.758063 BFGS: 902 16:34:50 -4227.525384 4.754359 BFGS: 903 16:34:51 -4228.217680 4.752270 BFGS: 904 16:34:53 -4228.906218 4.748836 BFGS: 905 16:34:56 -4229.590982 4.745738 BFGS: 906 16:34:57 -4230.272013 4.742384 BFGS: 907 16:34:59 -4230.949227 4.738967 BFGS: 908 16:35:01 -4231.622634 4.735438 BFGS: 909 16:35:02 -4232.292227 4.731872 BFGS: 910 16:35:04 -4232.958029 4.728159 BFGS: 911 16:35:06 -4233.619975 4.724406 BFGS: 912 16:35:06 -4234.278073 4.720588 BFGS: 913 16:35:08 -4234.932306 4.717039 BFGS: 914 16:35:09 -4235.582732 4.713386 BFGS: 915 16:35:10 -4236.229294 4.709148 BFGS: 916 16:35:12 -4236.871961 4.705044 BFGS: 917 16:35:15 -4237.510838 4.700827 BFGS: 918 16:35:16 -4238.145811 4.698288 BFGS: 919 16:35:17 -4238.777026 4.693280 BFGS: 920 16:35:19 -4239.404307 4.688736 BFGS: 921 16:35:22 -4240.027643 4.684143 BFGS: 922 16:35:23 -4240.647032 4.679521 BFGS: 923 16:35:24 -4241.262453 4.674853 BFGS: 924 16:35:25 -4241.873899 4.670107 BFGS: 925 16:35:27 -4242.481393 4.665309 BFGS: 926 16:35:28 -4243.084891 4.660518 BFGS: 927 16:35:29 -4243.684388 4.655424 BFGS: 928 16:35:31 -4244.279861 4.650422 BFGS: 929 16:35:33 -4244.871308 4.645252 BFGS: 930 16:35:34 -4245.458707 4.640084 BFGS: 931 16:35:36 -4246.042056 4.634785 BFGS: 932 16:35:38 -4246.621338 4.629450 BFGS: 933 16:35:39 -4247.196546 4.624002 BFGS: 934 16:35:41 -4247.767666 4.618499 BFGS: 935 16:35:42 -4248.334691 4.612891 BFGS: 936 16:35:43 -4248.897608 4.607219 BFGS: 937 16:35:45 -4249.456454 4.601446 BFGS: 938 16:35:46 -4250.011185 4.595607 BFGS: 939 16:35:47 -4250.561785 4.589843 BFGS: 940 16:35:48 -4251.108242 4.583769 BFGS: 941 16:35:49 -4251.650538 4.577689 BFGS: 942 16:35:50 -4252.188665 4.571471 BFGS: 943 16:35:52 -4252.722611 4.565192 BFGS: 944 16:35:53 -4253.252468 4.558805 BFGS: 945 16:35:54 -4253.778169 4.551798 BFGS: 946 16:35:56 -4254.299709 4.545522 BFGS: 947 16:35:57 -4254.817117 4.538900 BFGS: 948 16:35:58 -4255.330292 4.532189 BFGS: 949 16:36:00 -4255.839210 4.525397 BFGS: 950 16:36:01 -4256.343877 4.518440 BFGS: 951 16:36:03 -4256.844272 4.511472 BFGS: 952 16:36:04 -4257.340397 4.504315 BFGS: 953 16:36:05 -4257.832233 4.497144 BFGS: 954 16:36:06 -4258.319779 4.489793 BFGS: 955 16:36:08 -4258.803018 4.482412 BFGS: 956 16:36:10 -4259.281945 4.474864 BFGS: 957 16:36:11 -4259.756546 4.467270 BFGS: 958 16:36:12 -4260.226823 4.459521 BFGS: 959 16:36:14 -4260.692824 4.452755 BFGS: 960 16:36:16 -4261.154620 4.444191 BFGS: 961 16:36:17 -4261.612046 4.435895 BFGS: 962 16:36:19 -4262.065104 4.427565 BFGS: 963 16:36:20 -4262.513775 4.419260 BFGS: 964 16:36:21 -4262.958058 4.410802 BFGS: 965 16:36:23 -4263.397935 4.402331 BFGS: 966 16:36:26 -4263.833401 4.393683 BFGS: 967 16:36:27 -4264.264441 4.385000 BFGS: 968 16:36:28 -4264.691052 4.376136 BFGS: 969 16:36:31 -4265.113245 4.367223 BFGS: 970 16:36:33 -4265.530973 4.358253 BFGS: 971 16:36:34 -4265.944249 4.348998 BFGS: 972 16:36:36 -4266.353105 4.339410 BFGS: 973 16:36:37 -4266.757511 4.329713 BFGS: 974 16:36:39 -4267.157422 4.320146 BFGS: 975 16:36:41 -4267.552855 4.310322 BFGS: 976 16:36:43 -4267.943778 4.300558 BFGS: 977 16:36:44 -4268.330193 4.290512 BFGS: 978 16:36:46 -4268.712109 4.280504 BFGS: 979 16:36:48 -4269.089522 4.270276 BFGS: 980 16:36:49 -4269.462402 4.260023 BFGS: 981 16:36:50 -4269.830796 4.250003 BFGS: 982 16:36:52 -4270.194660 4.239176 BFGS: 983 16:36:54 -4270.553958 4.228598 BFGS: 984 16:36:56 -4270.908689 4.217556 BFGS: 985 16:36:57 -4271.258836 4.206585 BFGS: 986 16:36:59 -4271.604402 4.195284 BFGS: 987 16:37:01 -4271.945372 4.183988 BFGS: 988 16:37:03 -4272.281799 4.172391 BFGS: 989 16:37:05 -4272.613633 4.160754 BFGS: 990 16:37:06 -4272.940865 4.148719 BFGS: 991 16:37:07 -4273.263508 4.136759 BFGS: 992 16:37:09 -4273.581537 4.124451 BFGS: 993 16:37:10 -4273.894943 4.112194 BFGS: 994 16:37:11 -4274.203728 4.099569 BFGS: 995 16:37:12 -4274.507882 4.086944 BFGS: 996 16:37:13 -4274.807475 4.073959 BFGS: 997 16:37:14 -4275.102401 4.060916 BFGS: 998 16:37:15 -4275.392700 4.047154 BFGS: 999 16:37:16 -4275.678394 4.033816 BFGS: 1000 16:37:18 -4275.959485 4.020080 BFGS: 1001 16:37:19 -4276.235940 4.006422 BFGS: 1002 16:37:21 -4276.507776 3.992282 BFGS: 1003 16:37:23 -4276.774978 3.978164 BFGS: 1004 16:37:25 -4277.037563 3.963489 BFGS: 1005 16:37:27 -4277.295537 3.948972 BFGS: 1006 16:37:29 -4277.548933 3.933786 BFGS: 1007 16:37:30 -4277.797718 3.918828 BFGS: 1008 16:37:30 -4278.041917 3.903165 BFGS: 1009 16:37:31 -4278.281531 3.887698 BFGS: 1010 16:37:32 -4278.516587 3.871492 BFGS: 1011 16:37:33 -4278.747084 3.855533 BFGS: 1012 16:37:34 -4278.973059 3.838766 BFGS: 1013 16:37:36 -4279.194513 3.822303 BFGS: 1014 16:37:37 -4279.411489 3.804934 BFGS: 1015 16:37:38 -4279.623993 3.787945 BFGS: 1016 16:37:39 -4279.832077 3.769925 BFGS: 1017 16:37:41 -4280.035751 3.752385 BFGS: 1018 16:37:43 -4280.235077 3.733656 BFGS: 1019 16:37:44 -4280.430085 3.714949 BFGS: 1020 16:37:45 -4280.620838 3.695936 BFGS: 1021 16:37:47 -4280.807354 3.677155 BFGS: 1022 16:37:49 -4280.989726 3.656897 BFGS: 1023 16:37:50 -4281.167984 3.637473 BFGS: 1024 16:37:52 -4281.342238 3.616228 BFGS: 1025 16:37:53 -4281.512564 3.596118 BFGS: 1026 16:37:55 -4281.679082 3.573963 BFGS: 1027 16:37:57 -4281.841829 3.553124 BFGS: 1028 16:37:59 -4282.000961 3.529806 BFGS: 1029 16:38:00 -4282.156688 3.509203 BFGS: 1030 16:38:02 -4282.309005 3.484181 BFGS: 1031 16:38:03 -4282.458091 3.461169 BFGS: 1032 16:38:04 -4282.604178 3.435338 BFGS: 1033 16:38:05 -4282.747423 3.411219 BFGS: 1034 16:38:06 -4282.888106 3.384104 BFGS: 1035 16:38:08 -4283.026517 3.358554 BFGS: 1036 16:38:09 -4283.162879 3.330151 BFGS: 1037 16:38:10 -4283.297529 3.303015 BFGS: 1038 16:38:12 -4283.430894 3.272804 BFGS: 1039 16:38:13 -4283.563376 3.243576 BFGS: 1040 16:38:14 -4283.695535 3.211316 BFGS: 1041 16:38:15 -4283.827836 3.179379 BFGS: 1042 16:38:16 -4283.961164 3.145015 BFGS: 1043 16:38:18 -4284.095840 3.110835 BFGS: 1044 16:38:20 -4284.232961 3.073527 BFGS: 1045 16:38:21 -4284.373480 3.035562 BFGS: 1046 16:38:23 -4284.518558 2.994341 BFGS: 1047 16:38:24 -4284.669493 2.952138 BFGS: 1048 16:38:25 -4284.827850 2.906078 BFGS: 1049 16:38:27 -4284.995420 2.858387 BFGS: 1050 16:38:28 -4285.174389 2.806060 BFGS: 1051 16:38:30 -4285.367334 2.751070 BFGS: 1052 16:38:32 -4285.577469 2.690235 BFGS: 1053 16:38:33 -4285.808918 2.625591 BFGS: 1054 16:38:34 -4286.066165 2.552690 BFGS: 1055 16:38:35 -4286.356424 2.472388 BFGS: 1056 16:38:36 -4286.688909 2.392998 BFGS: 1057 16:38:37 -4287.077495 2.427415 BFGS: 1058 16:38:38 -4287.544003 2.460718 BFGS: 1059 16:38:39 -4288.127452 2.491335 BFGS: 1060 16:38:41 -4288.906940 2.519479 BFGS: 1061 16:38:43 -4290.132364 2.541576 BFGS: 1062 16:38:45 -4292.142750 2.516847 BFGS: 1063 16:38:46 -4292.592523 2.469329 BFGS: 1064 16:38:46 -4292.985259 2.422743 BFGS: 1065 16:38:48 -4293.358802 2.376763 BFGS: 1066 16:38:48 -4293.720674 2.330751 BFGS: 1067 16:38:49 -4294.073549 2.285205 BFGS: 1068 16:38:51 -4294.418554 2.239579 BFGS: 1069 16:38:52 -4294.756299 2.194659 BFGS: 1070 16:38:54 -4295.087167 2.149836 BFGS: 1071 16:38:55 -4295.411355 2.104697 BFGS: 1072 16:38:56 -4295.728861 2.059710 BFGS: 1073 16:38:57 -4296.039801 2.015348 BFGS: 1074 16:38:58 -4296.344308 1.970662 BFGS: 1075 16:38:59 -4296.642373 1.926389 BFGS: 1076 16:39:01 -4296.934095 1.882918 BFGS: 1077 16:39:01 -4297.219443 1.838677 BFGS: 1078 16:39:03 -4297.498370 1.794548 BFGS: 1079 16:39:04 -4297.770946 1.750834 BFGS: 1080 16:39:05 -4298.037189 1.706965 BFGS: 1081 16:39:07 -4298.297104 1.663512 BFGS: 1082 16:39:09 -4298.550743 1.620168 BFGS: 1083 16:39:10 -4298.798087 1.576691 BFGS: 1084 16:39:11 -4299.039160 1.533610 BFGS: 1085 16:39:12 -4299.273939 1.490379 BFGS: 1086 16:39:13 -4299.502439 1.447287 BFGS: 1087 16:39:14 -4299.724673 1.404321 BFGS: 1088 16:39:16 -4299.940669 1.362422 BFGS: 1089 16:39:17 -4300.150560 1.319713 BFGS: 1090 16:39:18 -4300.354184 1.277129 BFGS: 1091 16:39:19 -4300.551568 1.234668 BFGS: 1092 16:39:20 -4300.742717 1.192331 BFGS: 1093 16:39:21 -4300.927644 1.150120 BFGS: 1094 16:39:23 -4301.106355 1.108033 BFGS: 1095 16:39:25 -4301.278860 1.066070 BFGS: 1096 16:39:26 -4301.445165 1.024232 BFGS: 1097 16:39:29 -4301.605277 0.984999 BFGS: 1098 16:39:30 -4301.759204 0.964287 BFGS: 1099 16:39:32 -4301.906951 0.943052 BFGS: 1100 16:39:33 -4302.048525 0.921304 BFGS: 1101 16:39:35 -4302.184014 0.899020 BFGS: 1102 16:39:36 -4302.313403 0.875474 BFGS: 1103 16:39:38 -4302.436652 0.851768 BFGS: 1104 16:39:40 -4302.553761 0.827766 BFGS: 1105 16:39:41 -4302.664731 0.803347 BFGS: 1106 16:39:42 -4302.769563 0.778348 BFGS: 1107 16:39:43 -4302.868261 0.752790 BFGS: 1108 16:39:44 -4302.960826 0.726565 BFGS: 1109 16:39:46 -4303.047262 0.699699 BFGS: 1110 16:39:47 -4303.127570 0.672101 BFGS: 1111 16:39:49 -4303.201822 0.643776 BFGS: 1112 16:39:50 -4303.269960 0.614541 BFGS: 1113 16:39:51 -4303.331967 0.584662 BFGS: 1114 16:39:52 -4303.387848 0.553830 BFGS: 1115 16:39:54 -4303.437602 0.521924 BFGS: 1116 16:39:55 -4303.481229 0.488890 BFGS: 1117 16:39:56 -4303.518728 0.454542 BFGS: 1118 16:39:57 -4303.550143 0.418698 BFGS: 1119 16:39:58 -4303.575469 0.381056 BFGS: 1120 16:39:59 -4303.594684 0.341011 BFGS: 1121 16:40:00 -4303.607908 0.296349 BFGS: 1122 16:40:01 -4303.615145 0.248164 BFGS: 1123 16:40:02 -4303.617135 0.215610 BFGS: 1124 16:40:03 -4303.618662 0.191517 BFGS: 1125 16:40:04 -4303.623689 0.109920 BFGS: 1126 16:40:05 -4303.628444 0.040173 BFGS: 1127 16:40:06 -4303.631332 0.020666 BFGS: 1128 16:40:07 -4303.631865 0.015158 BFGS: 1129 16:40:08 -4303.631905 0.014111 BFGS: 1130 16:40:09 -4303.631912 0.012409 BFGS: 1131 16:40:10 -4303.631918 0.011416 BFGS: 1132 16:40:11 -4303.631941 0.004598 BFGS: 1133 16:40:13 -4303.631948 0.003682 BFGS: 1134 16:40:14 -4303.631951 0.003869 BFGS: 1135 16:40:15 -4303.631953 0.003157 BFGS: 1136 16:40:16 -4303.631954 0.001548 BFGS: 1137 16:40:17 -4303.631955 0.000396 BFGS: 1138 16:40:18 -4303.631955 0.000232 BFGS: 1139 16:40:19 -4303.631955 0.000199 BFGS: 1140 16:40:20 -4303.631955 0.000126 BFGS: 1141 16:40:21 -4303.631955 0.000020 BFGS: 1142 16:40:22 -4303.631955 0.000016 BFGS: 1143 16:40:23 -4303.631955 0.000006 BFGS: 1144 16:40:24 -4303.631955 0.000002 BFGS: 1145 16:40:25 -4303.631955 0.000001 BFGS: 1146 16:40:26 -4303.631955 0.000000 BFGS: 1147 16:40:27 -4303.631955 0.000000 BFGS: 1148 16:40:28 -4303.631955 0.000000 BFGS: 1149 16:40:29 -4303.631955 0.000000 BFGS: 1150 16:40:30 -4303.631955 0.000000 BFGS: 1151 16:40:31 -4303.631955 0.000000 BFGS: 1152 16:40:32 -4303.631955 0.000000 BFGS: 1153 16:40:33 -4303.631955 0.000000 Minimization converged after 1153 steps. Maximum force component: 4.782283022675082e-09 eV/Angstrom Maximum stress component: 1.4053821524891495e-11 eV/Angstrom^3 ==== Minimized structure obtained from ASE ==== symbols = ['Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', 'Li', '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 = [[0.80384868 0.80384868 0.80384868] [0.19615132 0.19615132 0.80384868] [0.19615132 0.80384868 0.19615132] ... [0.07483119 0.75 0.75 ] [0.07483119 0.25 0.25 ] [0.92516881 0.75 0.25 ]] cellpar = Cell([[16.318084968389986, -1.3698590614956453e-32, 2.059734292472425e-32], [-6.414273413376696e-32, 16.318084968389986, -7.32063009975184e-19], [-2.0617882611285353e-32, -7.320630099751128e-19, 16.318084968389986]]) forces = [[ 1.45880339e-09 1.45880339e-09 1.45880339e-09] [-1.45880339e-09 -1.45880339e-09 1.45880339e-09] [-1.45880339e-09 1.45880339e-09 -1.45880339e-09] ... [ 1.91493962e-09 5.89998717e-30 -2.14544988e-29] [ 1.91493962e-09 -4.29089976e-30 1.39454242e-29] [-1.91493962e-09 6.87214415e-30 4.23726351e-29]] stress = [ 1.40538215e-11 1.40538215e-11 1.40538215e-11 -1.79976323e-30 7.90006720e-33 -1.74697137e-51] energy per atom = -10.345269123113745 =============================================== Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them. Successfully added property instance for parameter set 0