element(s): ['B'] AFLOW prototype label: A_hR105_166_ac9h4i Parameter names: ['a', 'c/a', 'x2', 'x3', 'z3', 'x4', 'z4', 'x5', 'z5', 'x6', 'z6', 'x7', 'z7', 'x8', 'z8', 'x9', 'z9', 'x10', 'z10', 'x11', 'z11', 'x12', 'y12', 'z12', 'x13', 'y13', 'z13', 'x14', 'y14', 'z14', 'x15', 'y15', 'z15'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['10.91326', '2.1759805', '0.11520651', '0.49724858', '0.33645544', '0.40033609', '0.65871094', '0.50455492', '0.83541561', '0.39590867', '0.0096481682', '0.30113946', '0.81327725', '0.30083598', '0.99410799', '0.11558692', '0.9317672', '0.010731062', '0.27881581', '0.1184765', '0.28643653', '0.49610914', '0.150688', '0.32577354', '0.6048749', '0.94904375', '0.33403159', '0.29981658', '0.81592125', '0.12440485', '0.40404333', '0.9196975', '0.13644822'] model name: LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 ==== Building ASE atoms object with: ==== representative atom symbols = ['B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B'] representative atom coordinates = [[0. 0. 0. ] [0. 0. 0.11520651] [0.05359771 0.94640229 0.44365087] [0.91387505 0.08612495 0.48646104] [0.8897131 0.1102869 0.61484182] [0.1287535 0.8712465 0.26715517] [0.8292874 0.1707126 0.47185206] [0.76890933 0.23109067 0.53192665] [0.72793991 0.27206009 0.38764701] [0.91063842 0.08936158 0.10009264] [0.94401332 0.05598668 0.17446318] [0.00158331 0.17350223 0.32419023] [0.70471484 0.680273 0.62931675] [0.71102396 0.59745964 0.41338089] [0.64971854 0.56703218 0.48672968]] spacegroup = 166 cell = [[10.9133, 0, 0], [-5.45665, 9.4511950391207, 0], [0, 0, 23.747]] ========================================= Step Time Energy fmax BFGS: 0 15:40:57 -3347.577551 14.986828 BFGS: 1 15:40:57 -3442.741639 13.049234 BFGS: 2 15:40:58 -3490.426338 11.247892 BFGS: 3 15:40:59 -3523.800611 9.829589 BFGS: 4 15:41:00 -3543.981778 9.283807 BFGS: 5 15:41:02 -3557.028450 8.798983 BFGS: 6 15:41:05 -3567.057824 8.300616 BFGS: 7 15:41:07 -3573.489163 7.886166 BFGS: 8 15:41:09 -3577.608209 7.575387 BFGS: 9 15:41:09 -3580.514195 7.334216 BFGS: 10 15:41:10 -3582.727557 7.134131 BFGS: 11 15:41:11 -3584.545687 6.993501 BFGS: 12 15:41:13 -3586.113331 6.857749 BFGS: 13 15:41:13 -3587.509108 6.758945 BFGS: 14 15:41:14 -3588.795638 6.691811 BFGS: 15 15:41:14 -3590.008235 6.647295 BFGS: 16 15:41:15 -3591.169922 6.613257 BFGS: 17 15:41:15 -3592.295177 6.582175 BFGS: 18 15:41:15 -3593.394678 6.556085 BFGS: 19 15:41:16 -3594.474479 6.531422 BFGS: 20 15:41:16 -3595.538786 6.511098 BFGS: 21 15:41:17 -3596.591419 6.492005 BFGS: 22 15:41:17 -3597.634332 6.474346 BFGS: 23 15:41:17 -3598.669982 6.460204 BFGS: 24 15:41:18 -3599.699731 6.446864 BFGS: 25 15:41:18 -3600.724915 6.434612 BFGS: 26 15:41:19 -3601.746083 6.423591 BFGS: 27 15:41:19 -3602.763793 6.410754 BFGS: 28 15:41:20 -3603.779223 6.402465 BFGS: 29 15:41:20 -3604.792362 6.392077 BFGS: 30 15:41:20 -3605.804063 6.383361 BFGS: 31 15:41:21 -3606.814390 6.375067 BFGS: 32 15:41:21 -3607.823414 6.364787 BFGS: 33 15:41:22 -3608.831973 6.358333 BFGS: 34 15:41:22 -3609.839815 6.347361 BFGS: 35 15:41:22 -3610.848360 6.339866 BFGS: 36 15:41:23 -3611.857211 6.332168 BFGS: 37 15:41:23 -3612.866625 6.324105 BFGS: 38 15:41:23 -3613.876991 6.316070 BFGS: 39 15:41:24 -3614.888659 6.308243 BFGS: 40 15:41:24 -3615.887084 6.296290 BFGS: 41 15:41:25 -3616.982083 6.298435 BFGS: 42 15:41:25 -3618.058932 6.304938 BFGS: 43 15:41:25 -3619.144585 6.298620 BFGS: 44 15:41:26 -3620.232158 6.291060 BFGS: 45 15:41:26 -3621.316721 6.283384 BFGS: 46 15:41:27 -3622.401209 6.274919 BFGS: 47 15:41:27 -3623.485988 6.265743 BFGS: 48 15:41:27 -3624.574951 6.254515 BFGS: 49 15:41:28 -3625.662519 6.245632 BFGS: 50 15:41:28 -3626.751902 6.233621 BFGS: 51 15:41:28 -3627.840633 6.220934 BFGS: 52 15:41:29 -3628.930173 6.207157 BFGS: 53 15:41:29 -3630.016811 6.192410 BFGS: 54 15:41:30 -3631.099943 6.177003 BFGS: 55 15:41:30 -3632.179022 6.160794 BFGS: 56 15:41:30 -3633.253395 6.143938 BFGS: 57 15:41:31 -3634.322534 6.126417 BFGS: 58 15:41:31 -3635.385966 6.108305 BFGS: 59 15:41:31 -3636.443351 6.089662 BFGS: 60 15:41:32 -3637.494637 6.072116 BFGS: 61 15:41:32 -3638.540511 6.052360 BFGS: 62 15:41:33 -3639.579450 6.032275 BFGS: 63 15:41:33 -3640.611688 6.011995 BFGS: 64 15:41:33 -3641.637324 5.993533 BFGS: 65 15:41:34 -3642.656487 5.984662 BFGS: 66 15:41:34 -3643.669299 5.975074 BFGS: 67 15:41:34 -3644.675916 5.964977 BFGS: 68 15:41:35 -3645.676645 5.956217 BFGS: 69 15:41:35 -3646.673571 5.945306 BFGS: 70 15:41:36 -3647.663773 5.933551 BFGS: 71 15:41:36 -3648.648014 5.921630 BFGS: 72 15:41:36 -3649.626641 5.908962 BFGS: 73 15:41:37 -3650.599905 5.896343 BFGS: 74 15:41:37 -3651.567970 5.882950 BFGS: 75 15:41:37 -3652.531035 5.869785 BFGS: 76 15:41:38 -3653.488419 5.856049 BFGS: 77 15:41:38 -3654.440701 5.842476 BFGS: 78 15:41:38 -3655.386972 5.828904 BFGS: 79 15:41:39 -3656.327806 5.815947 BFGS: 80 15:41:39 -3657.263687 5.802460 BFGS: 81 15:41:40 -3658.195014 5.788351 BFGS: 82 15:41:40 -3659.120570 5.774212 BFGS: 83 15:41:40 -3660.041640 5.759715 BFGS: 84 15:41:41 -3660.957913 5.745409 BFGS: 85 15:41:41 -3661.869930 5.779184 BFGS: 86 15:41:41 -3662.777293 5.832074 BFGS: 87 15:41:42 -3663.679932 5.884353 BFGS: 88 15:41:42 -3664.578840 5.931125 BFGS: 89 15:41:42 -3665.473799 5.977080 BFGS: 90 15:41:43 -3666.364849 6.019979 BFGS: 91 15:41:43 -3667.252189 6.059684 BFGS: 92 15:41:43 -3668.135776 6.098095 BFGS: 93 15:41:44 -3669.015918 6.131904 BFGS: 94 15:41:44 -3669.892510 6.165579 BFGS: 95 15:41:44 -3670.765909 6.193948 BFGS: 96 15:41:45 -3671.635971 6.222761 BFGS: 97 15:41:45 -3672.503068 6.246069 BFGS: 98 15:41:45 -3673.367097 6.270013 BFGS: 99 15:41:45 -3674.229187 6.289949 BFGS: 100 15:41:46 -3675.088031 6.309152 BFGS: 101 15:41:46 -3675.944169 6.324062 BFGS: 102 15:41:46 -3676.797618 6.338271 BFGS: 103 15:41:47 -3677.648189 6.346014 BFGS: 104 15:41:47 -3678.495859 6.350420 BFGS: 105 15:41:47 -3679.342128 6.355545 BFGS: 106 15:41:48 -3680.186573 6.360578 BFGS: 107 15:41:48 -3681.028651 6.361854 BFGS: 108 15:41:48 -3681.868946 6.363172 BFGS: 109 15:41:49 -3682.706952 6.360500 BFGS: 110 15:41:49 -3683.543424 6.357774 BFGS: 111 15:41:49 -3684.377080 6.347873 BFGS: 112 15:41:50 -3685.209909 6.342105 BFGS: 113 15:41:50 -3686.040845 6.331402 BFGS: 114 15:41:50 -3686.870392 6.320940 BFGS: 115 15:41:51 -3687.698226 6.307328 BFGS: 116 15:41:51 -3688.524799 6.292612 BFGS: 117 15:41:51 -3689.350395 6.277184 BFGS: 118 15:41:52 -3690.174012 6.259332 BFGS: 119 15:41:52 -3690.996686 6.238437 BFGS: 120 15:41:52 -3691.817831 6.217294 BFGS: 121 15:41:53 -3692.638139 6.192968 BFGS: 122 15:41:53 -3693.457149 6.168305 BFGS: 123 15:41:54 -3694.275756 6.142775 BFGS: 124 15:41:54 -3695.092834 6.113666 BFGS: 125 15:41:54 -3695.909238 6.084230 BFGS: 126 15:41:54 -3696.724258 6.052252 BFGS: 127 15:41:55 -3697.538917 6.018928 BFGS: 128 15:41:55 -3698.352512 5.983925 BFGS: 129 15:41:55 -3699.165691 5.947855 BFGS: 130 15:41:56 -3699.977925 5.909919 BFGS: 131 15:41:56 -3700.789798 5.870928 BFGS: 132 15:41:56 -3701.600830 5.830107 BFGS: 133 15:41:57 -3702.411590 5.788317 BFGS: 134 15:41:57 -3703.221678 5.744649 BFGS: 135 15:41:57 -3704.031926 5.701227 BFGS: 136 15:41:58 -3704.841196 5.654423 BFGS: 137 15:41:58 -3705.650436 5.607349 BFGS: 138 15:41:58 -3706.459060 5.558486 BFGS: 139 15:41:59 -3707.267681 5.507973 BFGS: 140 15:41:59 -3708.076108 5.458558 BFGS: 141 15:41:59 -3708.884361 5.405548 BFGS: 142 15:41:59 -3709.691147 5.350941 BFGS: 143 15:42:00 -3710.499220 5.295222 BFGS: 144 15:42:00 -3711.307145 5.239035 BFGS: 145 15:42:00 -3712.115267 5.182305 BFGS: 146 15:42:01 -3712.923215 5.123645 BFGS: 147 15:42:01 -3713.731317 5.065195 BFGS: 148 15:42:01 -3714.539347 5.004168 BFGS: 149 15:42:02 -3715.347564 4.943766 BFGS: 150 15:42:02 -3716.155926 4.880610 BFGS: 151 15:42:02 -3716.964211 4.851653 BFGS: 152 15:42:03 -3717.773155 4.841000 BFGS: 153 15:42:03 -3718.581865 4.830142 BFGS: 154 15:42:03 -3719.390833 4.820181 BFGS: 155 15:42:04 -3720.201050 4.809498 BFGS: 156 15:42:04 -3721.011302 4.798819 BFGS: 157 15:42:04 -3721.821896 4.788198 BFGS: 158 15:42:05 -3722.632643 4.777638 BFGS: 159 15:42:05 -3723.443699 4.767096 BFGS: 160 15:42:06 -3724.254997 4.756637 BFGS: 161 15:42:06 -3725.066726 4.747206 BFGS: 162 15:42:06 -3725.878320 4.736502 BFGS: 163 15:42:07 -3726.691247 4.726274 BFGS: 164 15:42:07 -3727.504147 4.715961 BFGS: 165 15:42:07 -3728.317653 4.705725 BFGS: 166 15:42:08 -3729.131689 4.697151 BFGS: 167 15:42:08 -3729.946425 4.686783 BFGS: 168 15:42:08 -3730.761194 4.676470 BFGS: 169 15:42:09 -3731.576234 4.667101 BFGS: 170 15:42:09 -3732.391680 4.655851 BFGS: 171 15:42:09 -3733.207345 4.645401 BFGS: 172 15:42:10 -3734.024712 4.635661 BFGS: 173 15:42:10 -3734.841829 4.625244 BFGS: 174 15:42:10 -3735.661810 4.616682 BFGS: 175 15:42:11 -3736.482002 4.608300 BFGS: 176 15:42:11 -3737.302147 4.599754 BFGS: 177 15:42:11 -3738.122350 4.591031 BFGS: 178 15:42:12 -3738.942814 4.582102 BFGS: 179 15:42:12 -3739.763821 4.573069 BFGS: 180 15:42:12 -3740.585540 4.563934 BFGS: 181 15:42:13 -3741.408169 4.554790 BFGS: 182 15:42:13 -3742.231822 4.545632 BFGS: 183 15:42:13 -3743.056647 4.536535 BFGS: 184 15:42:13 -3743.882741 4.527483 BFGS: 185 15:42:14 -3744.710231 4.518541 BFGS: 186 15:42:14 -3745.539211 4.509687 BFGS: 187 15:42:14 -3746.369951 4.501556 BFGS: 188 15:42:15 -3747.202509 4.499981 BFGS: 189 15:42:15 -3748.037320 4.498363 BFGS: 190 15:42:15 -3748.873945 4.497377 BFGS: 191 15:42:16 -3749.712803 4.496365 BFGS: 192 15:42:16 -3750.553759 4.496017 BFGS: 193 15:42:16 -3751.397197 4.495606 BFGS: 194 15:42:17 -3752.243005 4.495991 BFGS: 195 15:42:17 -3753.091618 4.496184 BFGS: 196 15:42:17 -3753.942878 4.497473 BFGS: 197 15:42:18 -3754.797408 4.498138 BFGS: 198 15:42:18 -3755.654927 4.500509 BFGS: 199 15:42:18 -3756.475274 4.477303 BFGS: 200 15:42:19 -3757.338940 4.478203 BFGS: 201 15:42:19 -3758.208961 4.482305 BFGS: 202 15:42:19 -3759.082338 4.485250 BFGS: 203 15:42:20 -3759.959330 4.490225 BFGS: 204 15:42:20 -3760.841224 4.493965 BFGS: 205 15:42:20 -3761.726904 4.500863 BFGS: 206 15:42:21 -3762.619434 4.503184 BFGS: 207 15:42:21 -3763.511159 4.500378 BFGS: 208 15:42:21 -3764.412696 4.509409 BFGS: 209 15:42:22 -3765.317896 4.516306 BFGS: 210 15:42:22 -3766.229910 4.526799 BFGS: 211 15:42:23 -3767.148540 4.535637 BFGS: 212 15:42:23 -3768.073548 4.546270 BFGS: 213 15:42:23 -3769.005159 4.557025 BFGS: 214 15:42:24 -3769.943740 4.569338 BFGS: 215 15:42:24 -3770.889743 4.583645 BFGS: 216 15:42:24 -3771.843497 4.597801 BFGS: 217 15:42:25 -3772.805023 4.614105 BFGS: 218 15:42:25 -3773.775733 4.630168 BFGS: 219 15:42:25 -3774.754619 4.647014 BFGS: 220 15:42:26 -3775.739056 4.665363 BFGS: 221 15:42:26 -3776.729271 4.684184 BFGS: 222 15:42:26 -3777.724798 4.704800 BFGS: 223 15:42:27 -3778.726193 4.725645 BFGS: 224 15:42:27 -3779.732834 4.748559 BFGS: 225 15:42:27 -3780.745760 4.771654 BFGS: 226 15:42:28 -3781.764442 4.797285 BFGS: 227 15:42:28 -3782.789267 4.822053 BFGS: 228 15:42:28 -3783.818654 4.850155 BFGS: 229 15:42:29 -3784.854025 4.876234 BFGS: 230 15:42:29 -3785.892582 4.907584 BFGS: 231 15:42:29 -3786.937670 4.925198 BFGS: 232 15:42:30 -3787.983762 4.950584 BFGS: 233 15:42:30 -3789.037683 4.984009 BFGS: 234 15:42:30 -3790.093969 5.017660 BFGS: 235 15:42:31 -3791.155206 5.051623 BFGS: 236 15:42:31 -3792.218089 5.085865 BFGS: 237 15:42:31 -3793.285066 5.120783 BFGS: 238 15:42:32 -3794.342862 5.157068 BFGS: 239 15:42:32 -3795.407799 5.192987 BFGS: 240 15:42:32 -3796.483457 5.228002 BFGS: 241 15:42:33 -3797.558064 5.263848 BFGS: 242 15:42:33 -3798.630003 5.300387 BFGS: 243 15:42:33 -3799.702668 5.338011 BFGS: 244 15:42:34 -3800.774836 5.374933 BFGS: 245 15:42:34 -3801.846184 5.412591 BFGS: 246 15:42:34 -3802.916233 5.449736 BFGS: 247 15:42:34 -3803.984031 5.487403 BFGS: 248 15:42:35 -3805.045623 5.523441 BFGS: 249 15:42:35 -3806.110380 5.560954 BFGS: 250 15:42:35 -3807.173665 5.600345 BFGS: 251 15:42:36 -3808.232066 5.638903 BFGS: 252 15:42:36 -3809.215775 5.692286 BFGS: 253 15:42:36 -3810.289738 5.729586 BFGS: 254 15:42:37 -3811.540048 5.781065 BFGS: 255 15:42:37 -3812.583329 5.816956 BFGS: 256 15:42:37 -3813.621020 5.844975 BFGS: 257 15:42:38 -3814.664016 5.877042 BFGS: 258 15:42:38 -3815.700672 5.911469 BFGS: 259 15:42:38 -3816.727734 5.949922 BFGS: 260 15:42:39 -3817.765666 5.982731 BFGS: 261 15:42:39 -3818.778851 6.014231 BFGS: 262 15:42:40 -3819.792294 6.045894 BFGS: 263 15:42:40 -3820.805676 6.077870 BFGS: 264 15:42:40 -3821.818535 6.109604 BFGS: 265 15:42:41 -3822.830875 6.141483 BFGS: 266 15:42:41 -3823.842808 6.173835 BFGS: 267 15:42:41 -3824.854604 6.206482 BFGS: 268 15:42:42 -3825.865338 6.238956 BFGS: 269 15:42:42 -3826.875192 6.271001 BFGS: 270 15:42:42 -3827.883456 6.303173 BFGS: 271 15:42:43 -3828.890601 6.335199 BFGS: 272 15:42:43 -3829.896289 6.367227 BFGS: 273 15:42:43 -3830.900697 6.399167 BFGS: 274 15:42:44 -3831.903684 6.431069 BFGS: 275 15:42:44 -3832.905917 6.466850 BFGS: 276 15:42:44 -3833.906814 6.499226 BFGS: 277 15:42:45 -3834.906440 6.531300 BFGS: 278 15:42:45 -3835.904842 6.563382 BFGS: 279 15:42:45 -3836.902286 6.595606 BFGS: 280 15:42:46 -3837.897592 6.627639 BFGS: 281 15:42:46 -3838.891563 6.659636 BFGS: 282 15:42:46 -3839.883837 6.691569 BFGS: 283 15:42:47 -3840.874738 6.723457 BFGS: 284 15:42:47 -3841.864314 6.759031 BFGS: 285 15:42:47 -3842.853619 6.791725 BFGS: 286 15:42:48 -3843.841010 6.824369 BFGS: 287 15:42:48 -3844.827114 6.856542 BFGS: 288 15:42:48 -3845.811903 6.888858 BFGS: 289 15:42:49 -3846.795494 6.921102 BFGS: 290 15:42:49 -3847.777959 6.953437 BFGS: 291 15:42:49 -3848.759382 6.985782 BFGS: 292 15:42:50 -3849.739869 7.018219 BFGS: 293 15:42:50 -3850.719518 7.050712 BFGS: 294 15:42:51 -3851.698526 7.082289 BFGS: 295 15:42:51 -3852.677719 7.115175 BFGS: 296 15:42:51 -3853.656759 7.148144 BFGS: 297 15:42:52 -3854.635762 7.180741 BFGS: 298 15:42:52 -3855.615002 7.214509 BFGS: 299 15:42:52 -3856.594084 7.248203 BFGS: 300 15:42:53 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15:53:21 -6100.351158 7.299786 BFGS: 1968 15:53:21 -6100.490929 7.524423 BFGS: 1969 15:53:22 -6100.611350 7.746036 BFGS: 1970 15:53:22 -6100.714514 7.957565 BFGS: 1971 15:53:22 -6100.802000 8.158379 BFGS: 1972 15:53:23 -6100.876584 8.348366 BFGS: 1973 15:53:23 -6100.940235 8.528774 BFGS: 1974 15:53:24 -6100.994130 8.696251 BFGS: 1975 15:53:24 -6101.039936 8.850457 BFGS: 1976 15:53:25 -6101.078743 8.988940 BFGS: 1977 15:53:25 -6101.111953 9.110478 BFGS: 1978 15:53:25 -6101.140719 9.209618 BFGS: 1979 15:53:26 -6101.166724 9.279287 BFGS: 1980 15:53:26 -6101.189384 9.287106 BFGS: 1981 15:53:27 -6101.208684 9.213446 BFGS: 1982 15:53:27 -6101.225846 9.076016 BFGS: 1983 15:53:27 -6101.235862 8.960976 BFGS: 1984 15:53:28 -6101.243556 8.868520 BFGS: 1985 15:53:28 -6101.251990 8.799266 BFGS: 1986 15:53:29 -6101.268994 8.717219 BFGS: 1987 15:53:29 -6101.314077 8.632356 BFGS: 1988 15:53:29 -6101.418508 8.539877 BFGS: 1989 15:53:30 -6101.663863 8.518107 BFGS: 1990 15:53:30 -6101.941906 8.553385 BFGS: 1991 15:53:31 -6102.220838 8.600859 BFGS: 1992 15:53:31 -6102.526675 8.643568 BFGS: 1993 15:53:32 -6102.866487 8.677853 BFGS: 1994 15:53:32 -6103.240574 8.703021 BFGS: 1995 15:53:32 -6103.647874 8.718191 BFGS: 1996 15:53:33 -6104.085656 8.723792 BFGS: 1997 15:53:33 -6104.548809 8.719407 BFGS: 1998 15:53:34 -6105.040091 8.707497 BFGS: 1999 15:53:34 -6105.554256 8.686170 BFGS: 2000 15:53:34 -6106.089524 8.657272 BFGS: 2001 15:53:35 -6106.642475 8.622105 BFGS: 2002 15:53:35 -6107.209816 8.580826 BFGS: 2003 15:53:36 -6107.789815 8.527299 BFGS: 2004 15:53:36 -6108.381527 8.469284 BFGS: 2005 15:53:37 -6108.980278 8.403464 BFGS: 2006 15:53:37 -6109.584779 8.332174 BFGS: 2007 15:53:37 -6110.191629 8.254190 BFGS: 2008 15:53:38 -6110.801110 8.171055 BFGS: 2009 15:53:38 -6111.406414 8.081488 BFGS: 2010 15:53:39 -6112.004018 7.987463 BFGS: 2011 15:53:39 -6112.597658 7.887592 BFGS: 2012 15:53:39 -6113.183245 7.778173 BFGS: 2013 15:53:40 -6113.748735 7.671776 BFGS: 2014 15:53:40 -6114.308986 7.558368 BFGS: 2015 15:53:41 -6114.855161 7.439036 BFGS: 2016 15:53:41 -6115.385756 7.314424 BFGS: 2017 15:53:42 -6115.898093 7.184606 BFGS: 2018 15:53:42 -6116.392915 7.050409 BFGS: 2019 15:53:42 -6116.862354 6.910399 BFGS: 2020 15:53:43 -6117.308353 6.766566 BFGS: 2021 15:53:43 -6117.728344 6.617501 BFGS: 2022 15:53:44 -6118.121246 6.464126 BFGS: 2023 15:53:44 -6118.484928 6.305609 BFGS: 2024 15:53:44 -6118.818102 6.146325 BFGS: 2025 15:53:45 -6119.119977 5.980682 BFGS: 2026 15:53:45 -6119.384336 5.809618 BFGS: 2027 15:53:46 -6119.615573 5.683765 BFGS: 2028 15:53:46 -6119.809041 5.654647 BFGS: 2029 15:53:47 -6119.964328 5.621844 BFGS: 2030 15:53:47 -6120.079710 5.586067 BFGS: 2031 15:53:47 -6120.154618 5.546777 BFGS: 2032 15:53:48 -6120.190835 5.504480 BFGS: 2033 15:53:48 -6120.201592 5.490175 BFGS: 2034 15:53:49 -6120.252970 5.479565 BFGS: 2035 15:53:49 -6120.326674 5.620957 BFGS: 2036 15:53:49 -6120.500258 5.863772 BFGS: 2037 15:53:50 -6120.857541 5.909851 BFGS: 2038 15:53:50 -6121.466662 5.552535 BFGS: 2039 15:53:51 -6122.249413 4.686030 BFGS: 2040 15:53:51 -6122.853635 4.601772 BFGS: 2041 15:53:52 -6123.131541 4.570173 BFGS: 2042 15:53:52 -6123.334802 4.533031 BFGS: 2043 15:53:52 -6123.504624 4.492320 BFGS: 2044 15:53:53 -6123.655615 4.449715 BFGS: 2045 15:53:53 -6123.793224 4.531455 BFGS: 2046 15:53:54 -6123.919915 4.600210 BFGS: 2047 15:53:54 -6124.037977 4.658623 BFGS: 2048 15:53:54 -6124.148107 4.711116 BFGS: 2049 15:53:55 -6124.250655 4.766044 BFGS: 2050 15:53:55 -6124.346307 4.874520 BFGS: 2051 15:53:56 -6124.435156 4.983921 BFGS: 2052 15:53:56 -6124.517465 5.094116 BFGS: 2053 15:53:57 -6124.593493 5.205034 BFGS: 2054 15:53:57 -6124.662767 5.311088 BFGS: 2055 15:53:57 -6124.726740 5.424309 BFGS: 2056 15:53:58 -6124.785169 5.536457 BFGS: 2057 15:53:58 -6124.838341 5.649872 BFGS: 2058 15:53:59 -6124.886531 5.763502 BFGS: 2059 15:53:59 -6124.929484 5.873752 BFGS: 2060 15:53:59 -6124.968063 5.987729 BFGS: 2061 15:54:00 -6125.002450 6.100953 BFGS: 2062 15:54:00 -6125.033002 6.215170 BFGS: 2063 15:54:01 -6125.059683 6.328891 BFGS: 2064 15:54:01 -6125.082706 6.443242 BFGS: 2065 15:54:02 -6125.102134 6.557358 BFGS: 2066 15:54:02 -6125.117799 6.666480 BFGS: 2067 15:54:02 -6125.130134 6.784682 BFGS: 2068 15:54:03 -6125.138473 6.894821 BFGS: 2069 15:54:03 -6125.142108 6.955820 BFGS: 2070 15:54:04 -6125.144080 7.008063 BFGS: 2071 15:54:04 -6125.144795 7.021250 BFGS: 2072 15:54:04 -6125.145640 7.028877 BFGS: 2073 15:54:05 -6125.145779 7.024833 BFGS: 2074 15:54:05 -6125.145871 7.016460 BFGS: 2075 15:54:06 -6125.145905 7.014296 BFGS: 2076 15:54:06 -6125.145932 7.012848 BFGS: 2077 15:54:07 -6125.145939 7.013642 BFGS: 2078 15:54:07 -6125.145951 7.016823 BFGS: 2079 15:54:07 -6125.145967 7.019531 BFGS: 2080 15:54:08 -6125.146016 7.025472 BFGS: 2081 15:54:08 -6125.146134 7.034020 BFGS: 2082 15:54:09 -6125.146444 7.048381 BFGS: 2083 15:54:09 -6125.147237 7.070727 BFGS: 2084 15:54:10 -6125.149294 7.106616 BFGS: 2085 15:54:10 -6125.154616 7.163134 BFGS: 2086 15:54:10 -6125.168422 7.253040 BFGS: 2087 15:54:11 -6125.204223 7.394518 BFGS: 2088 15:54:11 -6125.290797 7.598126 BFGS: 2089 15:54:12 -6125.426027 7.775495 BFGS: 2090 15:54:12 -6125.618163 7.919951 BFGS: 2091 15:54:13 -6125.854786 8.032428 BFGS: 2092 15:54:13 -6126.133359 8.128356 BFGS: 2093 15:54:13 -6126.444700 8.204544 BFGS: 2094 15:54:14 -6126.782347 8.266642 BFGS: 2095 15:54:14 -6127.141148 8.316973 BFGS: 2096 15:54:15 -6127.517085 8.357732 BFGS: 2097 15:54:15 -6127.907349 8.390540 BFGS: 2098 15:54:15 -6128.309855 8.416653 BFGS: 2099 15:54:16 -6128.718722 8.435520 BFGS: 2100 15:54:16 -6129.138360 8.453733 BFGS: 2101 15:54:17 -6129.566630 8.465340 BFGS: 2102 15:54:17 -6130.002907 8.473156 BFGS: 2103 15:54:18 -6130.445879 8.477312 BFGS: 2104 15:54:18 -6130.894817 8.478423 BFGS: 2105 15:54:18 -6131.349168 8.476733 BFGS: 2106 15:54:19 -6131.804136 8.473696 BFGS: 2107 15:54:19 -6132.265980 8.467168 BFGS: 2108 15:54:20 -6132.729352 8.457519 BFGS: 2109 15:54:20 -6133.199322 8.448204 BFGS: 2110 15:54:21 -6133.672977 8.435875 BFGS: 2111 15:54:21 -6134.150307 8.422152 BFGS: 2112 15:54:21 -6134.630623 8.406703 BFGS: 2113 15:54:22 -6135.113731 8.389851 BFGS: 2114 15:54:22 -6135.599344 8.371620 BFGS: 2115 15:54:23 -6136.087277 8.352133 BFGS: 2116 15:54:23 -6136.577338 8.331460 BFGS: 2117 15:54:23 -6137.069375 8.308330 BFGS: 2118 15:54:24 -6137.562023 8.286503 BFGS: 2119 15:54:24 -6138.056714 8.263069 BFGS: 2120 15:54:25 -6138.551576 8.237976 BFGS: 2121 15:54:25 -6139.040154 8.214650 BFGS: 2122 15:54:25 -6139.536321 8.189054 BFGS: 2123 15:54:26 -6140.034887 8.162594 BFGS: 2124 15:54:26 -6140.536105 8.135108 BFGS: 2125 15:54:27 -6141.039132 8.106652 BFGS: 2126 15:54:27 -6141.542360 8.077829 BFGS: 2127 15:54:27 -6142.046981 8.048298 BFGS: 2128 15:54:28 -6142.552395 8.018251 BFGS: 2129 15:54:28 -6143.056660 7.987664 BFGS: 2130 15:54:29 -6143.563635 7.958131 BFGS: 2131 15:54:29 -6144.071235 7.926497 BFGS: 2132 15:54:30 -6144.579141 7.894603 BFGS: 2133 15:54:30 -6145.087483 7.862244 BFGS: 2134 15:54:30 -6145.596169 7.829521 BFGS: 2135 15:54:31 -6146.103051 7.799789 BFGS: 2136 15:54:31 -6146.609895 7.765971 BFGS: 2137 15:54:32 -6147.118664 7.732636 BFGS: 2138 15:54:32 -6147.625937 7.700346 BFGS: 2139 15:54:33 -6148.133671 7.665908 BFGS: 2140 15:54:33 -6148.642909 7.631736 BFGS: 2141 15:54:33 -6149.152189 7.597041 BFGS: 2142 15:54:34 -6149.661820 7.562241 BFGS: 2143 15:54:34 -6150.171399 7.527178 BFGS: 2144 15:54:35 -6150.680987 7.491967 BFGS: 2145 15:54:35 -6151.190454 7.456578 BFGS: 2146 15:54:36 -6151.695196 7.421860 BFGS: 2147 15:54:36 -6152.202959 7.387011 BFGS: 2148 15:54:36 -6152.710798 7.351329 BFGS: 2149 15:54:37 -6153.219112 7.315680 BFGS: 2150 15:54:37 -6153.727227 7.279812 BFGS: 2151 15:54:38 -6154.235248 7.243888 BFGS: 2152 15:54:38 -6154.742979 7.207867 BFGS: 2153 15:54:39 -6155.242497 7.172084 BFGS: 2154 15:54:39 -6155.746333 7.136837 BFGS: 2155 15:54:39 -6156.252153 7.100769 BFGS: 2156 15:54:40 -6156.759778 7.065696 BFGS: 2157 15:54:40 -6157.265931 7.029367 BFGS: 2158 15:54:41 -6157.771705 6.993206 BFGS: 2159 15:54:41 -6158.274271 6.958074 BFGS: 2160 15:54:42 -6158.772611 6.920556 BFGS: 2161 15:54:42 -6159.272859 6.886122 BFGS: 2162 15:54:42 -6159.774226 6.850132 BFGS: 2163 15:54:43 -6160.276647 6.814490 BFGS: 2164 15:54:43 -6160.778801 6.778548 BFGS: 2165 15:54:44 -6161.273868 6.742713 BFGS: 2166 15:54:44 -6161.773866 6.707259 BFGS: 2167 15:54:44 -6162.274551 6.671820 BFGS: 2168 15:54:45 -6162.774616 6.636146 BFGS: 2169 15:54:45 -6163.274679 6.600737 BFGS: 2170 15:54:46 -6163.774055 6.565230 BFGS: 2171 15:54:46 -6164.273090 6.529900 BFGS: 2172 15:54:47 -6164.771484 6.494575 BFGS: 2173 15:54:47 -6165.269425 6.459385 BFGS: 2174 15:54:48 -6165.764289 6.425065 BFGS: 2175 15:54:48 -6166.260170 6.390131 BFGS: 2176 15:54:48 -6166.756081 6.353161 BFGS: 2177 15:54:49 -6167.246773 6.321040 BFGS: 2178 15:54:49 -6167.734820 6.288625 BFGS: 2179 15:54:50 -6168.225693 6.254232 BFGS: 2180 15:54:50 -6168.710994 6.221630 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BFGS: 2276 15:55:30 -6210.714293 6.854701 BFGS: 2277 15:55:30 -6211.054304 6.863938 BFGS: 2278 15:55:31 -6211.387520 6.875517 BFGS: 2279 15:55:31 -6211.720958 6.884273 BFGS: 2280 15:55:31 -6212.047965 6.896227 BFGS: 2281 15:55:32 -6212.375410 6.904498 BFGS: 2282 15:55:32 -6212.695050 6.916952 BFGS: 2283 15:55:33 -6213.016016 6.924657 BFGS: 2284 15:55:33 -6213.327997 6.937676 BFGS: 2285 15:55:33 -6213.640989 6.953985 BFGS: 2286 15:55:34 -6213.945843 6.974434 BFGS: 2287 15:55:34 -6214.253144 6.992524 BFGS: 2288 15:55:35 -6214.549725 7.013940 BFGS: 2289 15:55:35 -6214.849991 7.031040 BFGS: 2290 15:55:35 -6215.138096 7.053144 BFGS: 2291 15:55:36 -6215.430979 7.069550 BFGS: 2292 15:55:36 -6215.709428 7.092702 BFGS: 2293 15:55:37 -6215.994193 7.108226 BFGS: 2294 15:55:37 -6216.266725 7.131249 BFGS: 2295 15:55:38 -6216.543437 7.147318 BFGS: 2296 15:55:38 -6216.807742 7.169501 BFGS: 2297 15:55:38 -6217.075185 7.186140 BFGS: 2298 15:55:39 -6217.331668 7.207723 BFGS: 2299 15:55:39 -6217.586343 7.226949 BFGS: 2300 15:55:40 -6217.834300 7.247350 BFGS: 2301 15:55:40 -6218.082539 7.265695 BFGS: 2302 15:55:40 -6218.323162 7.286189 BFGS: 2303 15:55:41 -6218.562288 7.304193 BFGS: 2304 15:55:41 -6218.793389 7.324024 BFGS: 2305 15:55:42 -6219.022874 7.342554 BFGS: 2306 15:55:42 -6219.246224 7.361859 BFGS: 2307 15:55:42 -6219.465843 7.380205 BFGS: 2308 15:55:43 -6219.681055 7.399464 BFGS: 2309 15:55:43 -6219.892643 7.418332 BFGS: 2310 15:55:44 -6220.097563 7.438187 BFGS: 2311 15:55:44 -6220.300134 7.455353 BFGS: 2312 15:55:44 -6220.495571 7.475639 BFGS: 2313 15:55:45 -6220.688456 7.492799 BFGS: 2314 15:55:45 -6220.874234 7.513219 BFGS: 2315 15:55:46 -6221.058300 7.529389 BFGS: 2316 15:55:46 -6221.234067 7.551962 BFGS: 2317 15:55:47 -6221.406289 7.567072 BFGS: 2318 15:55:47 -6221.572017 7.588666 BFGS: 2319 15:55:47 -6221.735293 7.604073 BFGS: 2320 15:55:48 -6221.891405 7.626033 BFGS: 2321 15:55:48 -6222.044202 7.641055 BFGS: 2322 15:55:49 -6222.189908 7.663702 BFGS: 2323 15:55:49 -6222.333189 7.679915 BFGS: 2324 15:55:49 -6222.469472 7.701060 BFGS: 2325 15:55:50 -6222.602489 7.716293 BFGS: 2326 15:55:50 -6222.728674 7.738123 BFGS: 2327 15:55:51 -6222.851241 7.753106 BFGS: 2328 15:55:51 -6222.967659 7.774319 BFGS: 2329 15:55:52 -6223.079433 7.790114 BFGS: 2330 15:55:52 -6223.185438 7.811530 BFGS: 2331 15:55:53 -6223.286498 7.827040 BFGS: 2332 15:55:53 -6223.382277 7.848202 BFGS: 2333 15:55:53 -6223.472585 7.921017 BFGS: 2334 15:55:54 -6223.558149 8.001520 BFGS: 2335 15:55:54 -6223.636863 8.077014 BFGS: 2336 15:55:55 -6223.712273 8.159794 BFGS: 2337 15:55:55 -6223.780096 8.236105 BFGS: 2338 15:55:56 -6223.843891 8.318068 BFGS: 2339 15:55:56 -6223.901958 8.396292 BFGS: 2340 15:55:56 -6223.957074 8.482354 BFGS: 2341 15:55:57 -6224.005512 8.563741 BFGS: 2342 15:55:57 -6224.050772 8.650623 BFGS: 2343 15:55:58 -6224.089338 8.733153 BFGS: 2344 15:55:58 -6224.125051 8.822432 BFGS: 2345 15:55:58 -6224.154165 8.906978 BFGS: 2346 15:55:59 -6224.180587 8.997001 BFGS: 2347 15:55:59 -6224.201723 9.088737 BFGS: 2348 15:56:00 -6224.220607 9.179643 BFGS: 2349 15:56:00 -6224.235217 9.283139 BFGS: 2350 15:56:00 -6224.249205 9.368387 BFGS: 2351 15:56:01 -6224.262241 9.440114 BFGS: 2352 15:56:01 -6224.289483 9.457657 BFGS: 2353 15:56:02 -6224.310554 9.414197 BFGS: 2354 15:56:02 -6224.323300 9.334159 BFGS: 2355 15:56:02 -6224.331386 9.253091 BFGS: 2356 15:56:03 -6224.336503 9.146323 BFGS: 2357 15:56:03 -6224.338679 9.086860 BFGS: 2358 15:56:04 -6224.339900 9.016499 BFGS: 2359 15:56:04 -6224.340507 8.991757 BFGS: 2360 15:56:04 -6224.341143 8.971037 BFGS: 2361 15:56:05 -6224.341378 8.974942 BFGS: 2362 15:56:05 -6224.341492 8.988549 BFGS: 2363 15:56:06 -6224.341538 8.997002 BFGS: 2364 15:56:06 -6224.341557 9.008964 BFGS: 2365 15:56:07 -6224.341565 9.011836 BFGS: 2366 15:56:07 -6224.341570 9.016047 BFGS: 2367 15:56:07 -6224.341571 9.017225 BFGS: 2368 15:56:08 -6224.341572 9.017523 BFGS: 2369 15:56:08 -6224.341573 9.017559 BFGS: 2370 15:56:09 -6224.341573 9.017491 BFGS: 2371 15:56:09 -6224.341573 9.017430 BFGS: 2372 15:56:10 -6224.341573 9.017373 BFGS: 2373 15:56:10 -6224.341573 9.017329 BFGS: 2374 15:56:11 -6224.341573 9.017312 BFGS: 2375 15:56:11 -6224.341573 9.017319 BFGS: 2376 15:56:11 -6224.341573 9.017328 BFGS: 2377 15:56:12 -6224.341573 9.017346 BFGS: 2378 15:56:12 -6224.341573 9.017374 BFGS: 2379 15:56:13 -6224.341573 9.017421 BFGS: 2380 15:56:13 -6224.341573 9.017497 BFGS: 2381 15:56:14 -6224.341573 9.017621 BFGS: 2382 15:56:14 -6224.341574 9.017824 BFGS: 2383 15:56:14 -6224.341575 9.018154 BFGS: 2384 15:56:15 -6224.341578 9.018691 BFGS: 2385 15:56:15 -6224.341586 9.019565 BFGS: 2386 15:56:16 -6224.341608 9.020985 BFGS: 2387 15:56:16 -6224.341664 9.023291 BFGS: 2388 15:56:16 -6224.341812 9.027036 BFGS: 2389 15:56:17 -6224.342199 9.033113 BFGS: 2390 15:56:17 -6224.343212 9.042968 BFGS: 2391 15:56:18 -6224.345863 9.058938 BFGS: 2392 15:56:18 -6224.352796 9.084782 BFGS: 2393 15:56:19 -6224.370927 9.126495 BFGS: 2394 15:56:19 -6224.418287 9.193419 BFGS: 2395 15:56:20 -6224.541704 9.299263 BFGS: 2396 15:56:20 -6224.861675 9.460568 BFGS: 2397 15:56:21 -6225.679531 9.686722 BFGS: 2398 15:56:21 -6227.112442 9.817213 BFGS: 2399 15:56:21 -6228.895453 9.790170 BFGS: 2400 15:56:22 -6231.001422 9.634478 BFGS: 2401 15:56:22 -6233.387365 9.368534 BFGS: 2402 15:56:23 -6235.978496 9.010548 BFGS: 2403 15:56:23 -6238.719658 8.567428 BFGS: 2404 15:56:24 -6241.535656 8.050627 BFGS: 2405 15:56:24 -6244.336823 7.470644 BFGS: 2406 15:56:25 -6247.062252 6.827277 BFGS: 2407 15:56:25 -6249.614636 6.136086 BFGS: 2408 15:56:26 -6251.958442 5.391977 BFGS: 2409 15:56:26 -6253.985426 4.618278 BFGS: 2410 15:56:27 -6255.674243 3.815265 BFGS: 2411 15:56:27 -6256.992121 3.527145 BFGS: 2412 15:56:27 -6257.896312 3.485392 BFGS: 2413 15:56:28 -6258.378167 3.444953 BFGS: 2414 15:56:28 -6258.461156 3.418784 BFGS: 2415 15:56:29 -6258.462518 3.415264 BFGS: 2416 15:56:29 -6258.464979 3.406335 BFGS: 2417 15:56:30 -6258.465241 3.407349 BFGS: 2418 15:56:30 -6258.465560 3.409783 BFGS: 2419 15:56:31 -6258.465919 3.411764 BFGS: 2420 15:56:31 -6258.467011 3.416108 BFGS: 2421 15:56:32 -6258.469475 3.420932 BFGS: 2422 15:56:32 -6258.475924 3.429535 BFGS: 2423 15:56:33 -6258.492184 3.438039 BFGS: 2424 15:56:33 -6258.532521 3.447778 BFGS: 2425 15:56:33 -6258.599468 3.444755 BFGS: 2426 15:56:34 -6258.688078 3.433366 BFGS: 2427 15:56:34 -6258.805894 3.412062 BFGS: 2428 15:56:35 -6258.945481 3.383965 BFGS: 2429 15:56:35 -6259.107255 3.349126 BFGS: 2430 15:56:36 -6259.286957 3.308989 BFGS: 2431 15:56:36 -6259.483282 3.263945 BFGS: 2432 15:56:37 -6259.693656 3.214726 BFGS: 2433 15:56:37 -6259.916503 3.161716 BFGS: 2434 15:56:38 -6260.149931 3.105365 BFGS: 2435 15:56:38 -6260.392499 3.047267 BFGS: 2436 15:56:39 -6260.641245 2.985605 BFGS: 2437 15:56:39 -6260.897058 2.921140 BFGS: 2438 15:56:39 -6261.157020 2.854694 BFGS: 2439 15:56:40 -6261.420274 2.787231 BFGS: 2440 15:56:40 -6261.685443 2.718299 BFGS: 2441 15:56:41 -6261.948526 2.647584 BFGS: 2442 15:56:41 -6262.207850 2.576548 BFGS: 2443 15:56:42 -6262.463242 2.506344 BFGS: 2444 15:56:42 -6262.713720 2.434592 BFGS: 2445 15:56:43 -6262.959400 2.362845 BFGS: 2446 15:56:43 -6263.198889 2.291798 BFGS: 2447 15:56:44 -6263.433059 2.220279 BFGS: 2448 15:56:44 -6263.661065 2.148767 BFGS: 2449 15:56:45 -6263.882743 2.078613 BFGS: 2450 15:56:45 -6264.097301 2.008776 BFGS: 2451 15:56:45 -6264.304669 1.939545 BFGS: 2452 15:56:46 -6264.505624 1.868994 BFGS: 2453 15:56:46 -6264.699961 1.798734 BFGS: 2454 15:56:47 -6264.887407 1.728684 BFGS: 2455 15:56:47 -6265.067781 1.660101 BFGS: 2456 15:56:48 -6265.240842 1.590610 BFGS: 2457 15:56:48 -6265.406721 1.521677 BFGS: 2458 15:56:49 -6265.565541 1.454926 BFGS: 2459 15:56:49 -6265.716179 1.387108 BFGS: 2460 15:56:50 -6265.860629 1.319568 BFGS: 2461 15:56:50 -6265.997900 1.254890 BFGS: 2462 15:56:50 -6266.127605 1.188673 BFGS: 2463 15:56:51 -6266.250711 1.123262 BFGS: 2464 15:56:51 -6266.366509 1.057858 BFGS: 2465 15:56:52 -6266.475587 0.992779 BFGS: 2466 15:56:52 -6266.577722 0.929467 BFGS: 2467 15:56:53 -6266.673171 0.866536 BFGS: 2468 15:56:53 -6266.761464 0.803363 BFGS: 2469 15:56:54 -6266.843301 0.740715 BFGS: 2470 15:56:54 -6266.918002 0.682078 BFGS: 2471 15:56:54 -6266.985522 0.622036 BFGS: 2472 15:56:55 -6267.046769 0.562977 BFGS: 2473 15:56:55 -6267.101064 0.505643 BFGS: 2474 15:56:56 -6267.149299 0.449353 BFGS: 2475 15:56:56 -6267.191528 0.396593 BFGS: 2476 15:56:57 -6267.228201 0.342904 BFGS: 2477 15:56:57 -6267.259299 0.290573 BFGS: 2478 15:56:58 -6267.284888 0.240180 BFGS: 2479 15:56:58 -6267.305553 0.191107 BFGS: 2480 15:56:58 -6267.321424 0.143838 BFGS: 2481 15:56:59 -6267.332874 0.098752 BFGS: 2482 15:56:59 -6267.340192 0.054700 BFGS: 2483 15:57:00 -6267.343768 0.024303 BFGS: 2484 15:57:00 -6267.344461 0.020958 BFGS: 2485 15:57:01 -6267.344525 0.018886 BFGS: 2486 15:57:01 -6267.344688 0.008182 BFGS: 2487 15:57:02 -6267.344698 0.004742 BFGS: 2488 15:57:02 -6267.344705 0.001213 BFGS: 2489 15:57:02 -6267.344706 0.000504 BFGS: 2490 15:57:03 -6267.344706 0.000316 BFGS: 2491 15:57:03 -6267.344706 0.000142 BFGS: 2492 15:57:04 -6267.344706 0.000013 BFGS: 2493 15:57:04 -6267.344706 0.000004 BFGS: 2494 15:57:05 -6267.344706 0.000003 BFGS: 2495 15:57:05 -6267.344706 0.000001 BFGS: 2496 15:57:06 -6267.344706 0.000000 BFGS: 2497 15:57:06 -6267.344706 0.000000 BFGS: 2498 15:57:06 -6267.344706 0.000000 BFGS: 2499 15:57:07 -6267.344706 0.000000 BFGS: 2500 15:57:07 -6267.344706 0.000000 BFGS: 2501 15:57:08 -6267.344706 0.000000 Minimization converged after 2501 steps. Maximum force component: 5.4950802800746746e-09 eV/Angstrom Maximum stress component: 9.45784437115392e-11 eV/Angstrom^3 ==== Minimized structure obtained from ASE ==== symbols = ['B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B'] basis = [[0.00000000e+00 0.00000000e+00 0.00000000e+00] [6.66666667e-01 3.33333333e-01 3.33333333e-01] [3.33333333e-01 6.66666667e-01 6.66666667e-01] [1.30904368e-17 0.00000000e+00 8.26857303e-02] [0.00000000e+00 1.08265606e-17 9.17314270e-01] [6.66666667e-01 3.33333333e-01 4.16019064e-01] [6.66666667e-01 3.33333333e-01 2.50647603e-01] [3.33333333e-01 6.66666667e-01 7.49352397e-01] [3.33333333e-01 6.66666667e-01 5.83980936e-01] [6.29453066e-02 9.37054693e-01 3.98578016e-01] [6.29453066e-02 1.25890613e-01 3.98578016e-01] [8.74109387e-01 9.37054693e-01 3.98578016e-01] [9.37054693e-01 6.29453066e-02 6.01421984e-01] [1.25890613e-01 6.29453066e-02 6.01421984e-01] [9.37054693e-01 8.74109387e-01 6.01421984e-01] [7.29611973e-01 2.70388027e-01 7.31911349e-01] [7.29611973e-01 4.59223946e-01 7.31911349e-01] [5.40776054e-01 2.70388027e-01 7.31911349e-01] [6.03721360e-01 3.96278640e-01 9.34755317e-01] [7.92557280e-01 3.96278640e-01 9.34755317e-01] [6.03721360e-01 2.07442720e-01 9.34755317e-01] [3.96278640e-01 6.03721360e-01 6.52446826e-02] [3.96278640e-01 7.92557280e-01 6.52446826e-02] [2.07442720e-01 6.03721360e-01 6.52446826e-02] [2.70388027e-01 7.29611973e-01 2.68088651e-01] [4.59223946e-01 7.29611973e-01 2.68088651e-01] 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5.63996661e-10] [-1.43063137e-09 3.45231132e-11 -5.63996661e-10] [ 7.45213580e-10 1.22170156e-09 -5.63996661e-10] [ 6.85417794e-10 -1.25622467e-09 -5.63996661e-10] [-9.43869436e-10 -5.76102491e-10 -3.58900483e-10] [ 9.70854110e-10 -5.29363664e-10 -3.58900483e-10] [-2.69846740e-11 1.10546615e-09 -3.58900483e-10] [-2.69846740e-11 -1.10546615e-09 3.58900483e-10] [-9.43869436e-10 5.76102491e-10 3.58900483e-10] [ 9.70854110e-10 5.29363664e-10 3.58900483e-10] [-9.43869436e-10 -5.76102491e-10 -3.58900483e-10] [ 9.70854110e-10 -5.29363664e-10 -3.58900483e-10] [-2.69846740e-11 1.10546615e-09 -3.58900483e-10] [-2.69846740e-11 -1.10546615e-09 3.58900483e-10] [-9.43869436e-10 5.76102491e-10 3.58900483e-10] [ 9.70854110e-10 5.29363664e-10 3.58900483e-10] [-9.43869436e-10 -5.76102491e-10 -3.58900483e-10] [ 9.70854110e-10 -5.29363664e-10 -3.58900483e-10] [-2.69846740e-11 1.10546615e-09 -3.58900483e-10] [-2.69846740e-11 -1.10546615e-09 3.58900483e-10] [-9.43869436e-10 5.76102491e-10 3.58900483e-10] [ 9.70854110e-10 5.29363664e-10 3.58900483e-10] [ 9.43869436e-10 5.76102491e-10 3.58900483e-10] [-9.70854110e-10 5.29363664e-10 3.58900483e-10] [ 2.69846740e-11 -1.10546615e-09 3.58900483e-10] [ 2.69846740e-11 1.10546615e-09 -3.58900483e-10] [ 9.43869436e-10 -5.76102491e-10 -3.58900483e-10] [-9.70854110e-10 -5.29363664e-10 -3.58900483e-10] [ 9.43869436e-10 5.76102491e-10 3.58900483e-10] [-9.70854110e-10 5.29363664e-10 3.58900483e-10] [ 2.69846740e-11 -1.10546615e-09 3.58900483e-10] [ 2.69846740e-11 1.10546615e-09 -3.58900483e-10] [ 9.43869436e-10 -5.76102491e-10 -3.58900483e-10] [-9.70854110e-10 -5.29363664e-10 -3.58900483e-10] [ 9.43869436e-10 5.76102491e-10 3.58900483e-10] [-9.70854110e-10 5.29363664e-10 3.58900483e-10] [ 2.69846740e-11 -1.10546615e-09 3.58900483e-10] [ 2.69846740e-11 1.10546615e-09 -3.58900483e-10] [ 9.43869436e-10 -5.76102491e-10 -3.58900483e-10] [-9.70854110e-10 -5.29363664e-10 -3.58900483e-10] [ 1.06264518e-09 2.43187046e-10 2.74051300e-10] [-7.41928751e-10 7.98684199e-10 2.74051300e-10] [-3.20716431e-10 -1.04187125e-09 2.74051300e-10] [-3.20716431e-10 1.04187125e-09 -2.74051300e-10] [ 1.06264518e-09 -2.43187046e-10 -2.74051300e-10] [-7.41928751e-10 -7.98684199e-10 -2.74051300e-10] [ 1.06264518e-09 2.43187046e-10 2.74051300e-10] [-7.41928751e-10 7.98684199e-10 2.74051300e-10] [-3.20716431e-10 -1.04187125e-09 2.74051300e-10] [-3.20716431e-10 1.04187125e-09 -2.74051300e-10] [ 1.06264518e-09 -2.43187046e-10 -2.74051300e-10] [-7.41928751e-10 -7.98684199e-10 -2.74051300e-10] [ 1.06264518e-09 2.43187046e-10 2.74051300e-10] [-7.41928751e-10 7.98684199e-10 2.74051300e-10] [-3.20716431e-10 -1.04187125e-09 2.74051300e-10] [-3.20716431e-10 1.04187125e-09 -2.74051300e-10] [ 1.06264518e-09 -2.43187046e-10 -2.74051300e-10] [-7.41928751e-10 -7.98684199e-10 -2.74051300e-10] [-1.06264518e-09 -2.43187046e-10 -2.74051300e-10] [ 7.41928751e-10 -7.98684199e-10 -2.74051300e-10] [ 3.20716431e-10 1.04187125e-09 -2.74051300e-10] [ 3.20716431e-10 -1.04187125e-09 2.74051300e-10] [-1.06264518e-09 2.43187046e-10 2.74051300e-10] [ 7.41928751e-10 7.98684199e-10 2.74051300e-10] [-1.06264518e-09 -2.43187046e-10 -2.74051300e-10] [ 7.41928751e-10 -7.98684199e-10 -2.74051300e-10] [ 3.20716431e-10 1.04187125e-09 -2.74051300e-10] [ 3.20716431e-10 -1.04187125e-09 2.74051300e-10] [-1.06264518e-09 2.43187046e-10 2.74051300e-10] [ 7.41928751e-10 7.98684199e-10 2.74051300e-10] [-1.06264518e-09 -2.43187046e-10 -2.74051300e-10] [ 7.41928751e-10 -7.98684199e-10 -2.74051300e-10] [ 3.20716431e-10 1.04187125e-09 -2.74051300e-10] [ 3.20716431e-10 -1.04187125e-09 2.74051300e-10] [-1.06264518e-09 2.43187046e-10 2.74051300e-10] [ 7.41928751e-10 7.98684199e-10 2.74051300e-10] [ 1.04517051e-09 3.43719937e-11 -2.12582129e-10] [-5.52352274e-10 8.87958214e-10 -2.12582129e-10] [-4.92818234e-10 -9.22330208e-10 -2.12582129e-10] [-4.92818234e-10 9.22330208e-10 2.12582129e-10] [ 1.04517051e-09 -3.43719937e-11 2.12582129e-10] [-5.52352274e-10 -8.87958214e-10 2.12582129e-10] [ 1.04517051e-09 3.43719937e-11 -2.12582129e-10] [-5.52352274e-10 8.87958214e-10 -2.12582129e-10] [-4.92818234e-10 -9.22330208e-10 -2.12582129e-10] [-4.92818234e-10 9.22330208e-10 2.12582129e-10] [ 1.04517051e-09 -3.43719937e-11 2.12582129e-10] [-5.52352274e-10 -8.87958214e-10 2.12582129e-10] [ 1.04517051e-09 3.43719937e-11 -2.12582129e-10] [-5.52352274e-10 8.87958214e-10 -2.12582129e-10] [-4.92818234e-10 -9.22330208e-10 -2.12582129e-10] [-4.92818234e-10 9.22330208e-10 2.12582129e-10] [ 1.04517051e-09 -3.43719937e-11 2.12582129e-10] [-5.52352274e-10 -8.87958214e-10 2.12582129e-10] [-1.04517051e-09 -3.43719937e-11 2.12582129e-10] [ 5.52352274e-10 -8.87958214e-10 2.12582129e-10] [ 4.92818234e-10 9.22330208e-10 2.12582129e-10] [ 4.92818234e-10 -9.22330208e-10 -2.12582129e-10] [-1.04517051e-09 3.43719937e-11 -2.12582129e-10] [ 5.52352274e-10 8.87958214e-10 -2.12582129e-10] [-1.04517051e-09 -3.43719937e-11 2.12582129e-10] [ 5.52352274e-10 -8.87958214e-10 2.12582129e-10] [ 4.92818234e-10 9.22330208e-10 2.12582129e-10] [ 4.92818234e-10 -9.22330208e-10 -2.12582129e-10] [-1.04517051e-09 3.43719937e-11 -2.12582129e-10] [ 5.52352274e-10 8.87958214e-10 -2.12582129e-10] [-1.04517051e-09 -3.43719937e-11 2.12582129e-10] [ 5.52352274e-10 -8.87958214e-10 2.12582129e-10] [ 4.92818234e-10 9.22330208e-10 2.12582129e-10] [ 4.92818234e-10 -9.22330208e-10 -2.12582129e-10] [-1.04517051e-09 3.43719937e-11 -2.12582129e-10] [ 5.52352274e-10 8.87958214e-10 -2.12582129e-10]] stress = [ 8.44554298e-11 8.44554298e-11 -9.45784437e-11 -2.83015234e-24 -9.79365170e-25 -7.07779435e-26] energy per atom = -19.896332400946935 =============================================== Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them. Successfully added property instance for parameter set 0