element(s): ['O', 'Ti'] AFLOW prototype label: A11B6_aP102_2_33i_18i Parameter names: ['a', 'b/a', 'c/a', 'alpha', 'beta', 'gamma', 'x1', 'y1', 'z1', 'x2', 'y2', 'z2', 'x3', 'y3', 'z3', 'x4', 'y4', 'z4', 'x5', 'y5', 'z5', 'x6', 'y6', 'z6', 'x7', 'y7', 'z7', 'x8', 'y8', 'z8', 'x9', 'y9', 'z9', 'x10', 'y10', 'z10', 'x11', 'y11', 'z11', 'x12', 'y12', 'z12', 'x13', 'y13', 'z13', 'x14', 'y14', 'z14', 'x15', 'y15', 'z15', 'x16', 'y16', 'z16', 'x17', 'y17', 'z17', 'x18', 'y18', 'z18', 'x19', 'y19', 'z19', 'x20', 'y20', 'z20', 'x21', 'y21', 'z21', 'x22', 'y22', 'z22', 'x23', 'y23', 'z23', 'x24', 'y24', 'z24', 'x25', 'y25', 'z25', 'x26', 'y26', 'z26', 'x27', 'y27', 'z27', 'x28', 'y28', 'z28', 'x29', 'y29', 'z29', 'x30', 'y30', 'z30', 'x31', 'y31', 'z31', 'x32', 'y32', 'z32', 'x33', 'y33', 'z33', 'x34', 'y34', 'z34', 'x35', 'y35', 'z35', 'x36', 'y36', 'z36', 'x37', 'y37', 'z37', 'x38', 'y38', 'z38', 'x39', 'y39', 'z39', 'x40', 'y40', 'z40', 'x41', 'y41', 'z41', 'x42', 'y42', 'z42', 'x43', 'y43', 'z43', 'x44', 'y44', 'z44', 'x45', 'y45', 'z45', 'x46', 'y46', 'z46', 'x47', 'y47', 'z47', 'x48', 'y48', 'z48', 'x49', 'y49', 'z49', 'x50', 'y50', 'z50', 'x51', 'y51', 'z51'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['12.2841', '0.62702192', '1.1173875', '105.9878', '71.8804', '107.542', '0.17220044', '0.99797909', '0.6315218', '0.49906618', '0.057820806', '0.79148375', '0.4431569', '0.55908412', '0.096876329', '0.28706358', '0.099593406', '0.79347286', '0.66086095', '0.5205473', '0.092108655', '0.61615401', '0.11751286', '0.95072032', '0.048537266', '0.89260745', '0.80780981', '0.034428219', '0.53647992', '0.32451296', '0.77466269', '0.61221045', '0.25275141', '0.36074722', '0.18406027', '0.98709913', '0.10665029', '0.58877744', '0.49728029', '0.22906554', '0.67435721', '0.66213053', '0.82938789', '0.70386903', '0.451062', '0.10115459', '0.88195818', '0.42752465', '0.61844209', '0.74488282', '0.45037763', '0.32322976', '0.83752577', '0.41943115', '0.27697215', '0.46512645', '0.29445693', '0.43727944', '0.25843728', '0.17057724', '0.55888016', '0.36037422', '0.33463779', '0.71429817', '0.21586935', '0.13033346', '0.10382682', '0.28366717', '0.92192118', '0.83936169', '0.31964737', '0.95859764', '0.77903822', '0.93652977', '0.83217015', '0.89035154', '0.015253959', '0.99732669', '0.15452949', '0.38612993', '0.12511729', '0.77234748', '0.2188899', '0.76091815', '0.95233167', '0.42543358', '0.12468759', '0.98755421', '0.1798846', '0.75542818', '0.94583998', '0.79801094', '0.61956211', '0.37769824', '0.54145232', '0.46764195', '0.70048894', '0.86188691', '0.65843738', '0.43941765', '0.94602582', '0.59047924', '0.50345889', '0.64538458', '0.28995063', '0.96188475', '0.66916242', '0.47142457', '0.086193608', '0.73330624', '0.65883752', '0.14229036', '0.13081888', '0.77390357', '0.20670685', '0.66225563', '0.36073197', '0.75215154', '0.93588341', '0.50734106', '0.69060799', '0.52973611', '0.39053737', '0.62945114', '0.0060182892', '0.80805718', '0.41540451', '0.40765231', '0.32814047', '0.47617149', '0.80790038', '0.44376107', '0.5344649', '0.33077563', '0.027462958', '0.41699113', '0.27345574', '0.84110824', '0.36138085', '0.86627021', '0.72686295', '0.2936567', '0.33668042', '0.13889648', '0.74815235', '0.066594897', '0.99186122', '0.80531936', '0.4728004', '0.10720037', '0.87255889', '0.99710768', '0.69355234', '0.080620574', '0.59720556', '0.17289919', '0.024237779', '0.19135325', '0.057562238'] model name: Sim_LAMMPS_MEAM_ZhangTrinkle_2016_TiO__SM_513612626462_000 ==== Building ASE atoms object with: ==== representative atom symbols = ['O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti'] representative atom coordinates = [[0.17220044 0.99797909 0.6315218 ] [0.49906618 0.05782081 0.79148375] [0.4431569 0.55908412 0.09687633] [0.28706358 0.09959341 0.79347286] [0.66086095 0.5205473 0.09210865] [0.61615401 0.11751286 0.95072032] [0.04853727 0.89260745 0.80780981] [0.03442822 0.53647992 0.32451296] [0.77466269 0.61221045 0.25275141] [0.36074722 0.18406027 0.98709913] [0.10665029 0.58877744 0.49728029] [0.22906554 0.67435721 0.66213053] [0.82938789 0.70386903 0.451062 ] [0.10115459 0.88195818 0.42752465] [0.61844209 0.74488282 0.45037763] [0.32322976 0.83752577 0.41943115] [0.27697215 0.46512645 0.29445693] [0.43727944 0.25843728 0.17057724] [0.55888016 0.36037422 0.33463779] [0.71429817 0.21586935 0.13033346] [0.10382682 0.28366717 0.92192118] [0.83936169 0.31964737 0.95859764] [0.77903822 0.93652977 0.83217015] [0.89035154 0.01525396 0.99732669] [0.15452949 0.38612993 0.12511729] [0.77234748 0.2188899 0.76091815] [0.95233167 0.42543358 0.12468759] [0.98755421 0.1798846 0.75542818] [0.94583998 0.79801094 0.61956211] [0.37769824 0.54145232 0.46764195] [0.70048894 0.86188691 0.65843738] [0.43941765 0.94602582 0.59047924] [0.50345889 0.64538458 0.28995063] [0.96188475 0.66916242 0.47142457] [0.08619361 0.73330624 0.65883752] [0.14229036 0.13081888 0.77390357] [0.20670685 0.66225563 0.36073197] [0.75215154 0.93588341 0.50734106] [0.69060799 0.52973611 0.39053737] [0.62945114 0.00601829 0.80805718] [0.41540451 0.40765231 0.32814047] [0.47617149 0.80790038 0.44376107] [0.5344649 0.33077563 0.02746296] [0.41699113 0.27345574 0.84110824] [0.36138085 0.86627021 0.72686295] [0.2936567 0.33668042 0.13889648] [0.74815235 0.0665949 0.99186122] [0.80531936 0.4728004 0.10720037] [0.87255889 0.99710768 0.69355234] [0.08062057 0.59720556 0.17289919] [0.02423778 0.19135325 0.05756224]] spacegroup = 2 cell = [[12.2841, 0, 0], [-2.3215405601967, 7.3442096366703, 0], [4.2688386249538, -2.6156030754322, 12.780510887906]] ========================================= Step Time Energy fmax BFGS: 0 15:50:10 -593.170095 3.630413 BFGS: 1 15:50:10 -597.861686 3.316287 BFGS: 2 15:50:11 -601.799633 3.052508 BFGS: 3 15:50:11 -605.043007 2.833232 BFGS: 4 15:50:11 -607.501616 2.776532 BFGS: 5 15:50:11 -609.292564 2.745897 BFGS: 6 15:50:11 -610.586803 2.715272 BFGS: 7 15:50:12 -611.543065 2.686562 BFGS: 8 15:50:12 -612.271998 2.660278 BFGS: 9 15:50:12 -612.853099 2.636587 BFGS: 10 15:50:12 -613.333083 2.615033 BFGS: 11 15:50:12 -613.737698 2.594086 BFGS: 12 15:50:13 -614.089109 2.572242 BFGS: 13 15:50:13 -614.403434 2.551961 BFGS: 14 15:50:13 -614.692789 2.534082 BFGS: 15 15:50:13 -614.964070 2.517060 BFGS: 16 15:50:13 -615.222933 2.497107 BFGS: 17 15:50:14 -615.472822 2.476295 BFGS: 18 15:50:14 -615.714943 2.454459 BFGS: 19 15:50:14 -615.949540 2.435652 BFGS: 20 15:50:14 -616.175161 2.421815 BFGS: 21 15:50:14 -616.394365 2.403153 BFGS: 22 15:50:15 -616.609697 2.382772 BFGS: 23 15:50:15 -616.822079 2.362046 BFGS: 24 15:50:15 -617.031513 2.340676 BFGS: 25 15:50:15 -617.238109 2.319442 BFGS: 26 15:50:16 -617.442017 2.297787 BFGS: 27 15:50:16 -617.643418 2.275475 BFGS: 28 15:50:16 -617.842422 2.252847 BFGS: 29 15:50:16 -618.039140 2.229950 BFGS: 30 15:50:16 -618.233718 2.206939 BFGS: 31 15:50:17 -618.426257 2.183737 BFGS: 32 15:50:17 -618.616841 2.160417 BFGS: 33 15:50:17 -618.805531 2.136981 BFGS: 34 15:50:17 -618.992408 2.113492 BFGS: 35 15:50:18 -619.177546 2.089929 BFGS: 36 15:50:18 -619.360993 2.066898 BFGS: 37 15:50:18 -619.542793 2.043977 BFGS: 38 15:50:18 -619.723035 2.021192 BFGS: 39 15:50:18 -619.901826 1.998648 BFGS: 40 15:50:19 -620.079306 1.976185 BFGS: 41 15:50:19 -620.255564 1.953702 BFGS: 42 15:50:19 -620.430699 1.931237 BFGS: 43 15:50:19 -620.604841 1.908808 BFGS: 44 15:50:19 -620.778187 1.886915 BFGS: 45 15:50:20 -620.950955 1.865728 BFGS: 46 15:50:20 -621.123466 1.844679 BFGS: 47 15:50:20 -621.295942 1.823512 BFGS: 48 15:50:20 -621.468739 1.802348 BFGS: 49 15:50:21 -621.642095 1.781342 BFGS: 50 15:50:21 -621.816059 1.760145 BFGS: 51 15:50:21 -621.989984 1.738487 BFGS: 52 15:50:21 -622.163728 1.716528 BFGS: 53 15:50:22 -622.337227 1.694731 BFGS: 54 15:50:22 -622.510466 1.672972 BFGS: 55 15:50:22 -622.683273 1.651201 BFGS: 56 15:50:22 -622.855509 1.629343 BFGS: 57 15:50:22 -623.027138 1.607535 BFGS: 58 15:50:23 -623.198358 1.585884 BFGS: 59 15:50:23 -623.369351 1.564183 BFGS: 60 15:50:23 -623.540235 1.542249 BFGS: 61 15:50:23 -623.711111 1.520291 BFGS: 62 15:50:23 -623.882071 1.498102 BFGS: 63 15:50:23 -624.053177 1.475827 BFGS: 64 15:50:24 -624.224501 1.453496 BFGS: 65 15:50:24 -624.395976 1.430939 BFGS: 66 15:50:24 -624.567278 1.408123 BFGS: 67 15:50:24 -624.738068 1.385169 BFGS: 68 15:50:25 -624.908203 1.362086 BFGS: 69 15:50:25 -625.077754 1.338967 BFGS: 70 15:50:25 -625.246905 1.315735 BFGS: 71 15:50:26 -625.415743 1.303476 BFGS: 72 15:50:26 -625.584481 1.314304 BFGS: 73 15:50:26 -625.753327 1.319632 BFGS: 74 15:50:27 -625.922413 1.319859 BFGS: 75 15:50:27 -626.091281 1.315888 BFGS: 76 15:50:27 -626.259300 1.360514 BFGS: 77 15:50:27 -626.426192 1.409039 BFGS: 78 15:50:28 -626.591697 1.444468 BFGS: 79 15:50:28 -626.755871 1.462644 BFGS: 80 15:50:28 -626.918100 1.465815 BFGS: 81 15:50:29 -627.078254 1.453807 BFGS: 82 15:50:29 -627.236059 1.429013 BFGS: 83 15:50:29 -627.391407 1.393099 BFGS: 84 15:50:30 -627.544204 1.347727 BFGS: 85 15:50:30 -627.694455 1.296815 BFGS: 86 15:50:30 -627.842147 1.236897 BFGS: 87 15:50:31 -627.987263 1.174206 BFGS: 88 15:50:31 -628.129958 1.110235 BFGS: 89 15:50:31 -628.270005 1.044095 BFGS: 90 15:50:32 -628.407356 0.979023 BFGS: 91 15:50:32 -628.542073 0.941431 BFGS: 92 15:50:32 -628.674255 0.958319 BFGS: 93 15:50:33 -628.803944 0.977873 BFGS: 94 15:50:33 -628.931121 0.999526 BFGS: 95 15:50:33 -629.055743 1.022356 BFGS: 96 15:50:34 -629.177744 1.046019 BFGS: 97 15:50:34 -629.297019 1.071293 BFGS: 98 15:50:34 -629.413475 1.097078 BFGS: 99 15:50:35 -629.526982 1.121921 BFGS: 100 15:50:35 -629.637422 1.145339 BFGS: 101 15:50:35 -629.744685 1.166607 BFGS: 102 15:50:36 -629.848652 1.185382 BFGS: 103 15:50:36 -629.949258 1.201379 BFGS: 104 15:50:36 -630.046370 1.214147 BFGS: 105 15:50:37 -630.139685 1.224409 BFGS: 106 15:50:37 -630.229327 1.233207 BFGS: 107 15:50:37 -630.315395 1.238444 BFGS: 108 15:50:38 -630.397749 1.239861 BFGS: 109 15:50:38 -630.476449 1.237658 BFGS: 110 15:50:38 -630.551703 1.231995 BFGS: 111 15:50:39 -630.623777 1.223534 BFGS: 112 15:50:39 -630.693066 1.212548 BFGS: 113 15:50:39 -630.759745 1.229977 BFGS: 114 15:50:40 -630.823067 1.254800 BFGS: 115 15:50:40 -630.883117 1.276758 BFGS: 116 15:50:40 -630.940173 1.292681 BFGS: 117 15:50:41 -630.994603 1.303454 BFGS: 118 15:50:41 -631.046878 1.310142 BFGS: 119 15:50:41 -631.097713 1.313646 BFGS: 120 15:50:42 -631.147817 1.315361 BFGS: 121 15:50:42 -631.197788 1.315606 BFGS: 122 15:50:42 -631.248196 1.314641 BFGS: 123 15:50:43 -631.299326 1.313997 BFGS: 124 15:50:43 -631.351077 1.312755 BFGS: 125 15:50:43 -631.403917 1.309700 BFGS: 126 15:50:44 -631.458032 1.305614 BFGS: 127 15:50:44 -631.512898 1.300867 BFGS: 128 15:50:45 -631.568163 1.294933 BFGS: 129 15:50:45 -631.623874 1.283331 BFGS: 130 15:50:45 -631.679430 1.267128 BFGS: 131 15:50:46 -631.734162 1.247312 BFGS: 132 15:50:46 -631.787626 1.221639 BFGS: 133 15:50:46 -631.839473 1.188624 BFGS: 134 15:50:47 -631.889351 1.147831 BFGS: 135 15:50:47 -631.937493 1.097801 BFGS: 136 15:50:47 -631.984713 1.028873 BFGS: 137 15:50:48 -632.032712 0.946649 BFGS: 138 15:50:48 -632.082906 0.954156 BFGS: 139 15:50:48 -632.134994 0.962264 BFGS: 140 15:50:49 -632.190225 0.967977 BFGS: 141 15:50:49 -632.248802 0.972417 BFGS: 142 15:50:49 -632.309661 0.974478 BFGS: 143 15:50:50 -632.372591 0.977077 BFGS: 144 15:50:50 -632.439251 1.014613 BFGS: 145 15:50:51 -632.509748 1.028155 BFGS: 146 15:50:51 -632.584336 1.020134 BFGS: 147 15:50:51 -632.663274 0.983994 BFGS: 148 15:50:52 -632.746249 0.919438 BFGS: 149 15:50:52 -632.832086 0.830350 BFGS: 150 15:50:52 -632.921120 0.722126 BFGS: 151 15:50:53 -633.013553 0.615782 BFGS: 152 15:50:53 -633.111099 0.612815 BFGS: 153 15:50:53 -633.212685 0.607793 BFGS: 154 15:50:54 -633.321862 0.598243 BFGS: 155 15:50:54 -633.424784 0.585131 BFGS: 156 15:50:54 -633.514974 0.571453 BFGS: 157 15:50:55 -633.599152 0.591931 BFGS: 158 15:50:55 -633.681420 0.602462 BFGS: 159 15:50:55 -633.764245 0.600253 BFGS: 160 15:50:56 -633.850574 0.581056 BFGS: 161 15:50:56 -633.948290 0.535399 BFGS: 162 15:50:56 -634.058143 0.485642 BFGS: 163 15:50:57 -634.146512 0.489019 BFGS: 164 15:50:57 -634.211370 0.494557 BFGS: 165 15:50:57 -634.260649 0.494906 BFGS: 166 15:50:58 -634.305040 0.492239 BFGS: 167 15:50:58 -634.347203 0.489301 BFGS: 168 15:50:58 -634.387998 0.485362 BFGS: 169 15:50:59 -634.426624 0.479978 BFGS: 170 15:50:59 -634.463427 0.474302 BFGS: 171 15:50:59 -634.498696 0.469032 BFGS: 172 15:51:00 -634.532075 0.463334 BFGS: 173 15:51:00 -634.564127 0.457523 BFGS: 174 15:51:01 -634.594848 0.451583 BFGS: 175 15:51:01 -634.624426 0.445875 BFGS: 176 15:51:01 -634.652863 0.440090 BFGS: 177 15:51:02 -634.680518 0.434348 BFGS: 178 15:51:02 -634.707512 0.428492 BFGS: 179 15:51:02 -634.733940 0.422911 BFGS: 180 15:51:03 -634.759889 0.417615 BFGS: 181 15:51:03 -634.785412 0.412197 BFGS: 182 15:51:03 -634.810636 0.406760 BFGS: 183 15:51:04 -634.835597 0.401131 BFGS: 184 15:51:04 -634.860372 0.395421 BFGS: 185 15:51:04 -634.884945 0.389658 BFGS: 186 15:51:05 -634.909389 0.383737 BFGS: 187 15:51:05 -634.933718 0.378506 BFGS: 188 15:51:05 -634.957512 0.378532 BFGS: 189 15:51:06 -634.981130 0.381967 BFGS: 190 15:51:06 -635.004624 0.385261 BFGS: 191 15:51:07 -635.028035 0.384252 BFGS: 192 15:51:07 -635.051095 0.383249 BFGS: 193 15:51:07 -635.073828 0.383367 BFGS: 194 15:51:08 -635.096366 0.383502 BFGS: 195 15:51:08 -635.118721 0.383761 BFGS: 196 15:51:08 -635.140840 0.383987 BFGS: 197 15:51:09 -635.162835 0.383723 BFGS: 198 15:51:09 -635.184689 0.383192 BFGS: 199 15:51:09 -635.206406 0.376269 BFGS: 200 15:51:10 -635.227633 0.372738 BFGS: 201 15:51:10 -635.248711 0.368560 BFGS: 202 15:51:10 -635.269506 0.365403 BFGS: 203 15:51:11 -635.290104 0.361914 BFGS: 204 15:51:11 -635.310406 0.359797 BFGS: 205 15:51:11 -635.330516 0.357562 BFGS: 206 15:51:12 -635.350369 0.355678 BFGS: 207 15:51:12 -635.370122 0.354472 BFGS: 208 15:51:13 -635.389788 0.352887 BFGS: 209 15:51:13 -635.409339 0.350940 BFGS: 210 15:51:13 -635.428729 0.349050 BFGS: 211 15:51:14 -635.447983 0.347438 BFGS: 212 15:51:14 -635.467122 0.346049 BFGS: 213 15:51:15 -635.486136 0.344635 BFGS: 214 15:51:15 -635.504992 0.343517 BFGS: 215 15:51:15 -635.523673 0.342474 BFGS: 216 15:51:16 -635.542232 0.341041 BFGS: 217 15:51:16 -635.560672 0.339593 BFGS: 218 15:51:16 -635.579000 0.338242 BFGS: 219 15:51:17 -635.597223 0.336973 BFGS: 220 15:51:17 -635.615321 0.335875 BFGS: 221 15:51:17 -635.633269 0.335293 BFGS: 222 15:51:18 -635.651147 0.334044 BFGS: 223 15:51:18 -635.668893 0.333368 BFGS: 224 15:51:18 -635.686542 0.332244 BFGS: 225 15:51:19 -635.704105 0.330655 BFGS: 226 15:51:19 -635.721627 0.328679 BFGS: 227 15:51:19 -635.739158 0.326443 BFGS: 228 15:51:20 -635.756641 0.324232 BFGS: 229 15:51:20 -635.774092 0.321369 BFGS: 230 15:51:21 -635.791494 0.318553 BFGS: 231 15:51:21 -635.808914 0.314941 BFGS: 232 15:51:21 -635.826271 0.313828 BFGS: 233 15:51:22 -635.843671 0.311866 BFGS: 234 15:51:22 -635.861069 0.310761 BFGS: 235 15:51:22 -635.878563 0.309124 BFGS: 236 15:51:23 -635.896118 0.307933 BFGS: 237 15:51:23 -635.913699 0.306372 BFGS: 238 15:51:23 -635.931307 0.304056 BFGS: 239 15:51:24 -635.948953 0.301963 BFGS: 240 15:51:24 -635.966640 0.299927 BFGS: 241 15:51:25 -635.984367 0.297643 BFGS: 242 15:51:25 -636.002139 0.300761 BFGS: 243 15:51:25 -636.019897 0.309467 BFGS: 244 15:51:26 -636.037719 0.318368 BFGS: 245 15:51:26 -636.055433 0.327057 BFGS: 246 15:51:26 -636.073247 0.335971 BFGS: 247 15:51:27 -636.091015 0.344780 BFGS: 248 15:51:27 -636.108901 0.353776 BFGS: 249 15:51:27 -636.126751 0.362627 BFGS: 250 15:51:28 -636.144693 0.371642 BFGS: 251 15:51:28 -636.162510 0.380649 BFGS: 252 15:51:28 -636.180460 0.390032 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65.911197 BFGS: 676 15:55:08 -695.438521 112.497088 BFGS: 677 15:55:09 -695.436903 293.932228 BFGS: 678 15:55:10 -695.602444 178.675507 BFGS: 679 15:55:10 -695.738168 133.559559 BFGS: 680 15:55:11 -696.017793 135.155052 BFGS: 681 15:55:12 -696.296598 94.254511 BFGS: 682 15:55:13 -696.551074 70.747071 BFGS: 683 15:55:13 -696.796565 54.989043 BFGS: 684 15:55:14 -697.031897 44.244749 BFGS: 685 15:55:15 -697.264567 36.441369 BFGS: 686 15:55:15 -697.494777 30.798127 BFGS: 687 15:55:16 -697.727219 26.786046 BFGS: 688 15:55:17 -697.959669 24.167536 BFGS: 689 15:55:17 -698.193288 22.605228 BFGS: 690 15:55:18 -698.422655 21.664391 BFGS: 691 15:55:19 -698.657354 21.132968 BFGS: 692 15:55:19 -698.891640 20.953078 BFGS: 693 15:55:20 -699.128106 20.877612 BFGS: 694 15:55:21 -699.364860 20.826026 BFGS: 695 15:55:21 -699.601809 20.706230 BFGS: 696 15:55:22 -699.838958 20.495457 BFGS: 697 15:55:23 -700.077841 20.199400 BFGS: 698 15:55:24 -700.318022 19.819527 BFGS: 699 15:55:24 -700.560131 19.356635 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16:07:47 -1226.078766 204474.933963 BFGS: 1871 16:07:47 -1226.195624 116952.253001 BFGS: 1872 16:07:48 -1226.228754 131566.123196 BFGS: 1873 16:07:48 -1226.321254 362591.872107 BFGS: 1874 16:07:49 -1225.849067 1886151.962423 BFGS: 1875 16:07:49 -1218.615289 1065881.683229 BFGS: 1876 16:07:50 -1216.182375 377388.437082 BFGS: 1877 16:07:51 -1218.490504 366786.986976 BFGS: 1878 16:07:51 -1219.691858 324968.841120 BFGS: 1879 16:07:52 -1220.547419 290790.451093 BFGS: 1880 16:07:52 -1221.139172 251846.897873 BFGS: 1881 16:07:53 -1221.670071 227235.508018 BFGS: 1882 16:07:54 -1219.207276 212873.692639 BFGS: 1883 16:07:54 -1219.662166 215748.511375 BFGS: 1884 16:07:55 -1219.036472 215764.722100 BFGS: 1885 16:07:55 -1220.835185 225621.480434 BFGS: 1886 16:07:56 -1221.616641 237553.211879 BFGS: 1887 16:07:56 -1221.981403 250094.259095 BFGS: 1888 16:07:57 -1222.446629 283328.850024 BFGS: 1889 16:07:57 -1223.201409 248928.930822 BFGS: 1890 16:07:58 -1221.509381 638379.224534 BFGS: 1891 16:07:58 -1223.662653 198335.763286 BFGS: 1892 16:07:59 -1223.835021 199136.976669 BFGS: 1893 16:08:00 -1224.129501 433111.099529 BFGS: 1894 16:08:00 -1224.304954 213452.843148 BFGS: 1895 16:08:01 -1224.509498 191697.795972 BFGS: 1896 16:08:01 -1224.734011 183302.059347 BFGS: 1897 16:08:02 -1224.867113 265751.872466 BFGS: 1898 16:08:02 -1225.028092 227297.411213 BFGS: 1899 16:08:03 -1225.139112 192376.565427 BFGS: 1900 16:08:04 -1225.288332 311305.919304 BFGS: 1901 16:08:04 -1225.090049 634617.202842 BFGS: 1902 16:08:05 -1225.032763 109296.173362 BFGS: 1903 16:08:06 -1225.312803 193629.481291 BFGS: 1904 16:08:06 -1225.460498 325126.781290 BFGS: 1905 16:08:07 -1225.456088 240061.639622 BFGS: 1906 16:08:07 -1225.564696 277467.442833 BFGS: 1907 16:08:08 -1225.518782 420282.128791 BFGS: 1908 16:08:08 -1225.592884 287498.326092 BFGS: 1909 16:08:09 -1225.535883 504395.759120 BFGS: 1910 16:08:10 -1225.664293 221642.419880 BFGS: 1911 16:08:10 -1225.652593 714247.580525 BFGS: 1912 16:08:11 -1225.766792 362700.314461 BFGS: 1913 16:08:11 -1223.503025 34383078.959925 BFGS: 1914 16:08:12 -1223.635123 3332605.314782 BFGS: 1915 16:08:12 -1225.352581 726676.021178 BFGS: 1916 16:08:13 -1225.346338 1371939.300003 BFGS: 1917 16:08:14 -1225.460341 618182.994680 BFGS: 1918 16:08:14 -1225.537344 979438.309901 BFGS: 1919 16:08:15 -1225.623878 761870.513903 BFGS: 1920 16:08:15 -1225.641646 822464.427903 BFGS: 1921 16:08:16 -1225.680317 156798.391109 BFGS: 1922 16:08:17 -1225.728210 477475.516910 BFGS: 1923 16:08:17 -1225.765039 714219.998162 BFGS: 1924 16:08:18 -1225.783988 448394.619987 BFGS: 1925 16:08:18 -1225.775598 758458.951211 BFGS: 1926 16:08:19 -1225.807472 169292.729945 BFGS: 1927 16:08:20 -1225.812741 253811.814377 BFGS: 1928 16:08:20 -1225.826287 234451.902135 BFGS: 1929 16:08:21 -1225.834774 272442.353128 BFGS: 1930 16:08:21 -1225.858604 846575.789307 BFGS: 1931 16:08:22 -1225.558215 3020156.732652 BFGS: 1932 16:08:23 -1223.511473 1861670.873249 BFGS: 1933 16:08:23 -1223.976939 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-1225.858547 30536492.042168 BFGS: 1997 16:09:00 -1226.081725 4589625.896284 BFGS: 1998 16:09:01 -1225.362032 89209144.596032 BFGS: 1999 16:09:01 -1226.041796 3330509.867294 BFGS: 2000 16:09:02 -1225.739525 13277442.469027 BFGS: 2001 16:09:02 -1226.072267 1485149.768919 BFGS: 2002 16:09:03 -1226.089992 1913504.886271 BFGS: 2003 16:09:04 -1226.098559 901566.762131 BFGS: 2004 16:09:04 -1226.106145 632857.177228 BFGS: 2005 16:09:05 -1226.118937 1207113.783141 BFGS: 2006 16:09:05 -1226.129103 1892749.627217 BFGS: 2007 16:09:06 -1226.130637 3289380.757119 BFGS: 2008 16:09:07 -1226.126802 1907057.638518 BFGS: 2009 16:09:07 -1226.089451 2253680.290566 BFGS: 2010 16:09:08 -1226.135341 1556941.806404 BFGS: 2011 16:09:09 -1060.478611 62012745.188552 BFGS: 2012 16:09:09 -1060.759171 7203663.482689 BFGS: 2013 16:09:10 -1060.890160 2688956.965776 BFGS: 2014 16:09:11 -1062.332118 1506328.320501 BFGS: 2015 16:09:11 -1064.423818 1247445.012278 BFGS: 2016 16:09:12 -1066.968893 1044691.767429 BFGS: 2017 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-1115.058196 836007.012342 BFGS: 2080 16:09:48 -1115.719935 814269.992914 BFGS: 2081 16:09:49 -1117.064536 783676.392951 BFGS: 2082 16:09:50 -1117.978319 758355.464581 BFGS: 2083 16:09:50 -1119.554630 720649.024223 BFGS: 2084 16:09:51 -1119.939416 705817.895460 BFGS: 2085 16:09:51 -1120.725349 685363.461504 BFGS: 2086 16:09:52 -1122.026431 665808.602465 BFGS: 2087 16:09:53 -1125.103196 619144.912209 BFGS: 2088 16:09:53 -1126.444735 591260.852705 BFGS: 2089 16:09:54 -1127.279513 577866.973503 BFGS: 2090 16:09:54 -1131.755764 506345.629655 BFGS: 2091 16:09:55 -1133.348799 482083.550149 BFGS: 2092 16:09:55 -1136.047681 449886.315875 BFGS: 2093 16:09:56 -1138.776444 417893.035984 BFGS: 2094 16:09:57 -1141.135023 460202.042068 BFGS: 2095 16:09:57 -1144.349224 529907.019962 BFGS: 2096 16:09:58 -1147.582592 555139.811763 BFGS: 2097 16:09:58 -1150.213700 645971.779837 BFGS: 2098 16:09:59 -1152.680525 709069.313373 BFGS: 2099 16:10:00 -1154.823031 745892.203021 BFGS: 2100 16:10:00 -1157.678818 716306.723505 BFGS: 2101 16:10:01 -1159.350954 687633.969658 BFGS: 2102 16:10:01 -1160.875759 697567.365911 BFGS: 2103 16:10:02 -1163.922809 744867.133313 BFGS: 2104 16:10:02 -1167.188726 707461.230784 BFGS: 2105 16:10:03 -1169.628728 732608.354581 BFGS: 2106 16:10:03 -1171.946588 726016.783039 BFGS: 2107 16:10:04 -1174.662065 710220.866064 BFGS: 2108 16:10:05 -1177.386546 671900.263811 BFGS: 2109 16:10:05 -1180.129976 602964.152207 BFGS: 2110 16:10:06 -1183.668614 570551.362788 BFGS: 2111 16:10:06 -1186.001934 553028.247032 BFGS: 2112 16:10:07 -1188.687246 537991.365076 BFGS: 2113 16:10:07 -1191.674154 505186.127536 BFGS: 2114 16:10:08 -1193.909009 490625.895881 BFGS: 2115 16:10:09 -1197.129688 495426.715697 BFGS: 2116 16:10:09 -1199.665117 509641.138074 BFGS: 2117 16:10:10 -1202.175714 498766.230307 BFGS: 2118 16:10:10 -1205.122040 472834.737064 BFGS: 2119 16:10:11 -1206.943312 484619.436442 BFGS: 2120 16:10:12 -1209.295342 476051.647091 BFGS: 2121 16:10:12 -1210.984769 479905.069366 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4998 16:35:35 -3050.795853 43067152.982856 BFGS: 4999 16:35:36 -3050.807900 45852098.373275 BFGS: 5000 16:35:36 -3050.146809 3219394.014500 BFGS: 5001 16:35:36 -3050.481564 18123974.994592 BFGS: 5002 16:35:37 -3050.613768 32026400.420078 BFGS: 5003 16:35:37 -3050.774241 21024257.862057 BFGS: 5004 16:35:37 -3050.910588 31146159.447593 BFGS: 5005 16:35:38 -3051.069444 31049978.494264 BFGS: 5006 16:35:38 -3051.378132 25869376.972536 BFGS: 5007 16:35:38 -3051.280605 14533553.394187 BFGS: 5008 16:35:39 -3050.761628 8091995.803502 BFGS: 5009 16:35:39 -3050.786158 4502848.580629 BFGS: 5010 16:35:39 -3050.950972 6050737.739487 BFGS: 5011 16:35:40 -3049.836569 33816953.640437 BFGS: 5012 16:35:40 -3051.212047 22953870.978181 BFGS: 5013 16:35:41 -3051.008506 32468968.127698 BFGS: 5014 16:35:41 -3051.034479 16692645.787065 BFGS: 5015 16:35:41 -3051.131986 20061618.691380 BFGS: 5016 16:35:42 -3051.515545 21008306.938818 BFGS: 5017 16:35:42 -3051.461372 3433979.569083 BFGS: 5018 16:35:42 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16:36:40 -3053.713485 6649078.348736 BFGS: 5162 16:36:41 -3054.307470 5205580.997509 BFGS: 5163 16:36:41 -3054.521545 7764803.316715 BFGS: 5164 16:36:42 -3054.541990 9630933.917725 BFGS: 5165 16:36:42 -3054.285941 24850937.436619 BFGS: 5166 16:36:43 -3054.663567 9052550.251348 BFGS: 5167 16:36:43 -3054.706510 12951885.705064 BFGS: 5168 16:36:43 -3054.648773 4541960.261615 BFGS: 5169 16:36:44 -3054.659795 24812144.997406 BFGS: 5170 16:36:44 -3054.730831 22611301.334788 BFGS: 5171 16:36:44 -3054.713707 24906560.368833 BFGS: 5172 16:36:45 -3054.986567 25674826.376396 BFGS: 5173 16:36:45 -3055.197795 23691049.974909 BFGS: 5174 16:36:45 -3055.593346 16333692.979252 BFGS: 5175 16:36:46 -3055.662638 13390241.466891 BFGS: 5176 16:36:46 -3055.778197 13435841.653734 BFGS: 5177 16:36:47 -3054.934137 50058449.227781 BFGS: 5178 16:36:47 -3056.151252 40304393.776768 BFGS: 5179 16:36:47 -3056.197773 30137517.061453 BFGS: 5180 16:36:48 -3056.295512 26040367.179536 BFGS: 5181 16:36:48 -3056.457969 23814446.308768 BFGS: 5182 16:36:49 -3056.726172 24379760.253051 BFGS: 5183 16:36:49 -3056.609526 16964351.258139 BFGS: 5184 16:36:49 -3056.647123 18169854.094576 BFGS: 5185 16:36:50 -3056.753398 19156902.721700 BFGS: 5186 16:36:50 -3056.599655 38328159.938446 BFGS: 5187 16:36:50 -3056.700509 30773704.400250 BFGS: 5188 16:36:51 -3056.606132 17843984.424053 BFGS: 5189 16:36:51 -3056.909618 28831988.241050 BFGS: 5190 16:36:52 -3056.837487 29998690.433819 BFGS: 5191 16:36:52 -3056.802053 31592631.221590 BFGS: 5192 16:36:52 -3056.861355 35547227.493917 BFGS: 5193 16:36:53 -3056.585939 56344055.515025 BFGS: 5194 16:36:53 -3056.749659 55211273.750434 BFGS: 5195 16:36:54 -3056.908383 41699864.941149 BFGS: 5196 16:36:54 -3057.083514 34344856.868387 BFGS: 5197 16:36:54 -3056.707581 36824079.572230 BFGS: 5198 16:36:55 -3056.735300 35206777.070195 BFGS: 5199 16:36:55 -3056.878747 38423448.018483 BFGS: 5200 16:36:56 -3056.998515 15129566.140438 BFGS: 5201 16:36:56 -3057.119938 8563072.677008 BFGS: 5202 16:36:56 -3057.176463 29794810.211770 BFGS: 5203 16:36:57 -3057.109418 33132601.483208 BFGS: 5204 16:36:57 -3057.213119 18738865.591911 BFGS: 5205 16:36:57 -3057.045473 23419573.687732 BFGS: 5206 16:36:58 -3057.208107 19291280.570908 BFGS: 5207 16:36:58 -3056.945154 13099653.699836 BFGS: 5208 16:36:59 -3057.002787 34889890.190943 BFGS: 5209 16:36:59 -3057.217696 15189625.318703 BFGS: 5210 16:36:59 -3057.331148 10593539.938686 BFGS: 5211 16:37:00 -3057.315218 16479050.164123 BFGS: 5212 16:37:00 -3057.020432 27634885.488192 BFGS: 5213 16:37:01 -3057.145495 28029995.171276 BFGS: 5214 16:37:01 -3056.901018 49598226.832503 BFGS: 5215 16:37:01 -3057.046053 36638088.499863 BFGS: 5216 16:37:02 -3057.395271 22908517.579033 BFGS: 5217 16:37:02 -3057.342922 23372773.444156 BFGS: 5218 16:37:02 -3057.331745 20358028.294413 BFGS: 5219 16:37:03 -3057.348616 11553229.962922 BFGS: 5220 16:37:03 -3057.061836 18506548.922903 BFGS: 5221 16:37:04 -3056.344346 6405471.472657 BFGS: 5222 16:37:04 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5263 16:37:20 -3057.583618 14157480.594243 BFGS: 5264 16:37:20 -3057.485951 21030389.128663 BFGS: 5265 16:37:21 -3057.369823 22157517.196954 BFGS: 5266 16:37:21 -3057.722306 12646990.500868 BFGS: 5267 16:37:21 -3057.868281 11379213.034079 BFGS: 5268 16:37:22 -3057.845291 14067318.731547 BFGS: 5269 16:37:22 -3057.538221 10994527.246133 BFGS: 5270 16:37:22 -3057.897546 18998944.680164 BFGS: 5271 16:37:23 -3057.877785 10597146.441378 BFGS: 5272 16:37:23 -3057.790160 10718111.515125 BFGS: 5273 16:37:23 -3057.902144 7918674.639357 BFGS: 5274 16:37:24 -3057.931344 7171593.038829 BFGS: 5275 16:37:24 -3057.610613 16222374.987250 BFGS: 5276 16:37:25 -3057.706213 15583776.100560 BFGS: 5277 16:37:25 -3057.799354 10193535.353598 BFGS: 5278 16:37:25 -3057.832255 12500969.383706 BFGS: 5279 16:37:26 -3057.878226 18681428.752675 BFGS: 5280 16:37:26 -3058.004557 9898090.336489 BFGS: 5281 16:37:26 -3057.922762 14683318.777509 BFGS: 5282 16:37:27 -3057.770475 22429418.224107 BFGS: 5283 16:37:27 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14050449.794681 BFGS: 5304 16:37:35 -3058.364540 9903582.783821 BFGS: 5305 16:37:35 -3058.403421 12673935.401041 BFGS: 5306 16:37:35 -3058.515512 14775589.211672 BFGS: 5307 16:37:36 -3058.558098 18100020.894046 BFGS: 5308 16:37:36 -3058.251005 6079905.867392 BFGS: 5309 16:37:36 -3058.065873 10401929.341185 BFGS: 5310 16:37:37 -3058.385728 15115321.851832 BFGS: 5311 16:37:37 -3058.380556 10332645.946778 BFGS: 5312 16:37:37 -3058.512927 10740714.073077 BFGS: 5313 16:37:38 -3058.775434 976637.752844 BFGS: 5314 16:37:38 -3058.765510 7796083.030808 BFGS: 5315 16:37:38 -3056.801716 41849471.317366 BFGS: 5316 16:37:39 -3057.316093 41626711.599713 BFGS: 5317 16:37:39 -3057.262459 54551226.398625 BFGS: 5318 16:37:40 -3057.558354 56149053.940169 BFGS: 5319 16:37:40 -3058.606968 1268762.651688 BFGS: 5320 16:37:40 -3058.824633 15309122.447993 BFGS: 5321 16:37:41 -3058.620587 8903582.849082 BFGS: 5322 16:37:41 -3058.570996 8680328.574821 BFGS: 5323 16:37:41 -3058.613806 10087704.118174 BFGS: 5324 16:37:42 -3058.570135 6738643.890953 BFGS: 5325 16:37:42 -3058.750067 13324893.777460 BFGS: 5326 16:37:43 -3058.725980 16797111.517001 BFGS: 5327 16:37:43 -3058.820239 18465534.223657 BFGS: 5328 16:37:43 -3058.559491 15930331.169759 BFGS: 5329 16:37:44 -3058.765815 13904140.303106 BFGS: 5330 16:37:44 -3056.533985 33269245.691888 BFGS: 5331 16:37:45 -3058.577338 29484570.554904 BFGS: 5332 16:37:45 -3058.706248 10328770.904652 BFGS: 5333 16:37:45 -3059.008057 3768647.189419 BFGS: 5334 16:37:46 -3059.023101 5868907.683134 BFGS: 5335 16:37:46 -3058.717681 2599073.422642 BFGS: 5336 16:37:47 -3058.999646 7207406.340331 BFGS: 5337 16:37:47 -3059.012287 2018196.691519 BFGS: 5338 16:37:47 -3058.666674 8068676.176264 BFGS: 5339 16:37:48 -3059.179528 16053233.478420 BFGS: 5340 16:37:48 -3059.057351 16427620.302588 BFGS: 5341 16:37:49 -3059.112905 14936642.289765 BFGS: 5342 16:37:49 -3059.238808 9264111.270253 BFGS: 5343 16:37:49 -3059.305839 19198045.897419 BFGS: 5344 16:37:50 -3059.304979 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16:37:58 -3059.360159 5418197.115262 BFGS: 5366 16:37:58 -3059.377001 18006833.531203 BFGS: 5367 16:37:58 -3059.495306 9832981.829290 BFGS: 5368 16:37:59 -3059.362392 30956551.453545 BFGS: 5369 16:37:59 -3059.293462 32780431.175917 BFGS: 5370 16:37:59 -3059.423906 20697273.591099 BFGS: 5371 16:37:59 -3059.567552 15388744.158289 BFGS: 5372 16:38:00 -3059.620175 19781981.398131 BFGS: 5373 16:38:00 -3059.753630 17128904.100398 BFGS: 5374 16:38:00 -3059.535510 35147023.976301 BFGS: 5375 16:38:01 -3059.531994 35048029.893878 BFGS: 5376 16:38:01 -3059.211634 18528819.845959 BFGS: 5377 16:38:01 -3058.543133 34023353.011167 BFGS: 5378 16:38:02 -3058.965249 21140945.718524 BFGS: 5379 16:38:02 -3059.063478 14766185.443525 BFGS: 5380 16:38:02 -3059.128399 13221568.661563 BFGS: 5381 16:38:03 -3059.396852 6742150.827567 BFGS: 5382 16:38:03 -3059.449328 9421642.534240 BFGS: 5383 16:38:03 -3059.328366 5564264.423062 BFGS: 5384 16:38:04 -3059.562955 27398865.154469 BFGS: 5385 16:38:04 -3059.769529 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16:53:06 -3163.223419 675138163.952031 BFGS: 7800 16:53:06 -3163.701762 893821898.936524 BFGS: 7801 16:53:07 -3163.448425 1042146416.327265 BFGS: 7802 16:53:07 -3153.308964 1772292663.391119 BFGS: 7803 16:53:07 -3156.535917 2180790730.918559 BFGS: 7804 16:53:08 -3159.129094 1953906225.019025 BFGS: 7805 16:53:08 -3157.408818 661784572.983703 BFGS: 7806 16:53:08 -3157.502062 583544281.642627 BFGS: 7807 16:53:09 -3159.041285 661418525.525500 BFGS: 7808 16:53:09 -3155.031102 5064176557.722281 BFGS: 7809 16:53:09 -3156.214037 4201429504.896226 BFGS: 7810 16:53:10 -3157.259552 3795732174.394758 BFGS: 7811 16:53:10 -3157.916115 2342571423.405020 BFGS: 7812 16:53:11 -3159.821335 763600027.280009 BFGS: 7813 16:53:11 -3160.130817 802685502.910901 BFGS: 7814 16:53:11 -3161.150986 701154806.222931 BFGS: 7815 16:53:12 -3161.559589 675329523.860511 BFGS: 7816 16:53:12 -3162.149078 677594682.040688 BFGS: 7817 16:53:12 -3162.978618 700336754.360476 BFGS: 7818 16:53:13 -3125.624650 49658986785.750526 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BFGS: 8150 16:55:17 -3175.470615 2125444956.134919 BFGS: 8151 16:55:17 -3175.477109 982323368.012761 BFGS: 8152 16:55:18 -3175.566894 1143293819.411082 BFGS: 8153 16:55:18 -3175.564949 1670947431.747286 BFGS: 8154 16:55:18 -3175.581864 1619794165.894411 BFGS: 8155 16:55:19 -3175.537351 1368968889.480470 BFGS: 8156 16:55:19 -3175.687352 1792611131.886180 BFGS: 8157 16:55:19 -3175.694629 1013947684.773469 BFGS: 8158 16:55:20 -3175.723894 1319688149.501771 BFGS: 8159 16:55:20 -3175.561885 2353491774.449630 BFGS: 8160 16:55:20 -3175.656880 1775002484.136981 BFGS: 8161 16:55:21 -3175.788637 1025712370.879391 BFGS: 8162 16:55:21 -3175.743890 1749069535.683011 BFGS: 8163 16:55:21 -3175.700098 1483214565.014102 BFGS: 8164 16:55:22 -3175.750305 1503208736.117052 BFGS: 8165 16:55:22 -3175.772095 1114571251.295905 BFGS: 8166 16:55:22 -3175.431814 1043372150.944087 BFGS: 8167 16:55:23 -3175.722733 1772359290.037658 BFGS: 8168 16:55:23 -3175.833218 1294892226.716302 BFGS: 8169 16:55:23 -3175.844370 1543418485.054344 BFGS: 8170 16:55:24 -3175.903188 1441301663.504946 BFGS: 8171 16:55:24 -3175.786140 1310368743.362515 BFGS: 8172 16:55:24 -3175.845414 1177464183.817008 BFGS: 8173 16:55:25 -3175.815490 1407341904.517234 BFGS: 8174 16:55:25 -3175.886786 1223365679.757531 BFGS: 8175 16:55:25 -3175.758316 1907283826.924513 BFGS: 8176 16:55:26 -3175.798834 1458656501.435218 BFGS: 8177 16:55:26 -3175.902052 1182040647.899477 BFGS: 8178 16:55:27 -3175.839990 1003384463.380100 BFGS: 8179 16:55:27 -3175.857586 933138748.259515 BFGS: 8180 16:55:27 -3175.656079 1042219484.259192 BFGS: 8181 16:55:28 -3175.839488 506798483.468711 BFGS: 8182 16:55:28 -3175.812772 1750082517.049040 BFGS: 8183 16:55:29 -3175.810491 1635313232.915771 BFGS: 8184 16:55:29 -3175.831392 1561047845.756838 BFGS: 8185 16:55:29 -3175.766456 918051676.491637 BFGS: 8186 16:55:30 -3176.039563 288031548.189301 BFGS: 8187 16:55:30 -3176.093820 914350173.962737 BFGS: 8188 16:55:30 -3176.055170 1274120770.966599 BFGS: 8189 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1350350927.160054 BFGS: 8209 16:55:38 -3176.137226 1505601214.237447 BFGS: 8210 16:55:38 -3176.058558 1067976474.629845 BFGS: 8211 16:55:38 -3176.134738 1427199366.864212 BFGS: 8212 16:55:39 -3176.235794 1595102789.099124 BFGS: 8213 16:55:39 -3176.248033 1709223253.960716 BFGS: 8214 16:55:39 -3176.285170 1475216473.511618 BFGS: 8215 16:55:40 -3176.451057 333045326.999883 BFGS: 8216 16:55:40 -3176.349476 1894235831.252996 BFGS: 8217 16:55:40 -3176.387988 1047033782.494005 BFGS: 8218 16:55:41 -3176.307973 1438209303.572313 BFGS: 8219 16:55:41 -3176.390444 946744605.687485 BFGS: 8220 16:55:41 -3176.460162 129242819.583687 BFGS: 8221 16:55:42 -3176.473149 305063075.032264 BFGS: 8222 16:55:42 -3176.023788 733634217.257496 BFGS: 8223 16:55:42 -3176.051203 866558436.352442 BFGS: 8224 16:55:43 -3176.220818 1466012236.987595 BFGS: 8225 16:55:43 -3176.327579 218410393.904808 BFGS: 8226 16:55:43 -3176.447067 361160133.623855 BFGS: 8227 16:55:44 -3176.519724 1283856541.638481 BFGS: 8228 16:55:44 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16:55:51 -3177.009372 3488119908.884888 BFGS: 8249 16:55:52 -3177.444443 2822565053.653894 BFGS: 8250 16:55:52 -3177.563445 2676319739.818836 BFGS: 8251 16:55:52 -3177.396996 1767108828.751230 BFGS: 8252 16:55:53 -3177.444928 1751029459.416412 BFGS: 8253 16:55:53 -3177.598503 4045871049.042327 BFGS: 8254 16:55:54 -3177.264829 2027906762.883815 BFGS: 8255 16:55:54 -3177.239983 2795862096.875845 BFGS: 8256 16:55:54 -3177.476875 2961651242.700009 BFGS: 8257 16:55:55 -3177.755719 2696134777.934517 BFGS: 8258 16:55:55 -3177.704982 1755508736.324435 BFGS: 8259 16:55:55 -3177.728049 1816057277.241410 BFGS: 8260 16:55:56 -3177.907013 4223895986.037601 BFGS: 8261 16:55:56 -3177.900063 3988809418.180264 BFGS: 8262 16:55:56 -3177.813694 2860618769.685730 BFGS: 8263 16:55:57 -3177.943469 1328871169.700015 BFGS: 8264 16:55:57 -3177.875568 1612502879.865849 BFGS: 8265 16:55:57 -3178.116411 2920306470.366074 BFGS: 8266 16:55:58 -3177.054413 10282189475.869450 BFGS: 8267 16:55:58 -3178.088275 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16:57:41 -3181.684225 1176680608.351925 BFGS: 8542 16:57:41 -3181.716849 1153027260.561956 BFGS: 8543 16:57:42 -3182.003243 1177586951.320016 BFGS: 8544 16:57:42 -3182.104010 1154544995.900934 BFGS: 8545 16:57:42 -3182.133599 1179861693.644357 BFGS: 8546 16:57:43 -3181.743590 1308449055.141857 BFGS: 8547 16:57:43 -3181.775955 1342894427.645711 BFGS: 8548 16:57:44 -3181.874831 1349942164.301120 BFGS: 8549 16:57:44 -3182.025820 1348551527.920935 BFGS: 8550 16:57:44 -3182.084850 1341594400.380050 BFGS: 8551 16:57:45 -3182.361220 1302577701.345822 BFGS: 8552 16:57:45 -3182.419291 1276466131.983376 BFGS: 8553 16:57:45 -3182.307123 1249074316.778692 BFGS: 8554 16:57:46 -3182.349021 1244022590.472502 BFGS: 8555 16:57:46 -3182.421942 1281906902.120787 BFGS: 8556 16:57:46 -3182.508724 1297883822.739087 BFGS: 8557 16:57:47 -3182.469681 1362547494.642532 BFGS: 8558 16:57:47 -3182.510432 1294622386.134078 BFGS: 8559 16:57:48 -3182.496112 1316233216.740752 BFGS: 8560 16:57:48 -3182.518689 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16:57:55 -3182.457421 1406106277.821589 BFGS: 8581 16:57:56 -3182.498394 1467341143.828690 BFGS: 8582 16:57:56 -3182.324895 1496578070.637163 BFGS: 8583 16:57:57 -3182.017978 1657313647.555577 BFGS: 8584 16:57:57 -3182.169540 1591964620.882370 BFGS: 8585 16:57:57 -3182.044624 1537332341.484560 BFGS: 8586 16:57:58 -3182.250200 1532070467.955920 BFGS: 8587 16:57:58 -3182.275803 1494534479.550905 BFGS: 8588 16:57:58 -3182.335520 1549227236.263169 BFGS: 8589 16:57:59 -3182.370901 1553197364.107207 BFGS: 8590 16:57:59 -3182.447734 1383366730.426049 BFGS: 8591 16:57:59 -3182.501018 1381520523.766231 BFGS: 8592 16:58:00 -3182.535786 1471881753.003424 BFGS: 8593 16:58:00 -3182.608619 1475881845.680243 BFGS: 8594 16:58:00 -3182.588336 1472800524.190357 BFGS: 8595 16:58:01 -3182.596470 1460260928.316762 BFGS: 8596 16:58:01 -3182.609223 1377204682.431756 BFGS: 8597 16:58:02 -3182.157858 1359404234.979004 BFGS: 8598 16:58:02 -3182.200778 1515900700.632304 BFGS: 8599 16:58:02 -3182.170874 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16:58:10 -3182.368024 1401082540.823855 BFGS: 8620 16:58:10 -3182.447147 1447562602.976776 BFGS: 8621 16:58:11 -3182.558946 1428157085.034139 BFGS: 8622 16:58:11 -3182.763613 1473190617.415504 BFGS: 8623 16:58:12 -3182.197912 2979005778.944068 BFGS: 8624 16:58:12 -3182.458567 2735971135.134306 BFGS: 8625 16:58:13 -3182.588664 2528406278.280634 BFGS: 8626 16:58:13 -3182.756881 2427976592.228733 BFGS: 8627 16:58:14 -3182.762830 2285928589.015417 BFGS: 8628 16:58:14 -3182.787575 2251597833.441747 BFGS: 8629 16:58:15 -3182.627460 2000803899.407589 BFGS: 8630 16:58:15 -3182.390470 2089215543.861611 BFGS: 8631 16:58:16 -3182.636281 2066481696.742090 BFGS: 8632 16:58:16 -3182.660313 2161032447.597986 BFGS: 8633 16:58:17 -3182.788807 2086835298.956306 BFGS: 8634 16:58:17 -3182.912415 2123074409.252367 BFGS: 8635 16:58:18 -3182.914353 2148878590.262066 BFGS: 8636 16:58:18 -3182.871288 2172958476.387123 BFGS: 8637 16:58:19 -3182.912534 2080623108.579320 BFGS: 8638 16:58:19 -3182.910647 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16:58:29 -3182.696658 2341968722.557621 BFGS: 8659 16:58:29 -3182.555591 2579951191.553881 BFGS: 8660 16:58:30 -3182.626345 2532639820.209919 BFGS: 8661 16:58:30 -3182.785492 2406093745.072141 BFGS: 8662 16:58:31 -3182.806291 2391875626.460180 BFGS: 8663 16:58:31 -3182.851290 2307786733.371572 BFGS: 8664 16:58:32 -3182.841852 2242193097.232859 BFGS: 8665 16:58:32 -3182.904341 2231467253.270388 BFGS: 8666 16:58:33 -3182.921446 2227021398.923823 BFGS: 8667 16:58:33 -3183.016937 2210482220.533217 BFGS: 8668 16:58:33 -3182.915723 2336196404.492119 BFGS: 8669 16:58:34 -3183.187906 2356965239.782221 BFGS: 8670 16:58:34 -3183.200296 2363535222.885991 BFGS: 8671 16:58:34 -3183.282092 2277018799.395562 BFGS: 8672 16:58:35 -3183.039983 2135275170.564257 BFGS: 8673 16:58:35 -3183.301501 2165066290.399591 BFGS: 8674 16:58:35 -3183.283499 2198313590.850540 BFGS: 8675 16:58:36 -3183.217989 2206489575.276631 BFGS: 8676 16:58:36 -3182.930135 2346834770.102587 BFGS: 8677 16:58:36 -3183.140386 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16:58:44 -3183.313229 2100481102.255295 BFGS: 8698 16:58:45 -3183.323032 2188681248.131368 BFGS: 8699 16:58:45 -3183.380737 2227533743.976398 BFGS: 8700 16:58:46 -3183.188025 2203798351.505839 BFGS: 8701 16:58:46 -3182.725271 2070338944.211565 BFGS: 8702 16:58:46 -3183.200021 2077739183.938320 BFGS: 8703 16:58:47 -3183.269445 2092625401.423472 BFGS: 8704 16:58:47 -3183.355063 2113928614.420182 BFGS: 8705 16:58:47 -3183.409562 2087281329.595311 BFGS: 8706 16:58:48 -3183.493713 2252075164.736506 BFGS: 8707 16:58:48 -3183.505131 2271354693.472486 BFGS: 8708 16:58:49 -3183.381584 2206758337.997528 BFGS: 8709 16:58:49 -3183.374044 2242134653.079377 BFGS: 8710 16:58:49 -3183.383476 2270330648.266678 BFGS: 8711 16:58:50 -3183.427714 2221001718.410895 BFGS: 8712 16:58:50 -3183.425967 2218832086.228117 BFGS: 8713 16:58:50 -3181.859916 2235176006.552071 BFGS: 8714 16:58:51 -3182.447953 2087374472.308561 BFGS: 8715 16:58:51 -3182.954910 2036973727.160325 BFGS: 8716 16:58:52 -3183.299543 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16:58:59 -3183.512473 2161194611.693083 BFGS: 8737 16:58:59 -3183.547796 2190942385.190220 BFGS: 8738 16:59:00 -3183.495031 2169551556.001410 BFGS: 8739 16:59:00 -3183.583387 2195734395.193890 BFGS: 8740 16:59:01 -3183.343886 2172810648.258062 BFGS: 8741 16:59:01 -3183.325318 2146392174.988527 BFGS: 8742 16:59:01 -3183.513579 2177928238.237338 BFGS: 8743 16:59:02 -3183.538584 2206132759.683573 BFGS: 8744 16:59:02 -3183.584871 2257975658.135058 BFGS: 8745 16:59:03 -3183.593688 2317052259.432365 BFGS: 8746 16:59:03 -3182.170414 3104426494.622763 BFGS: 8747 16:59:03 -3182.968362 2915966403.156427 BFGS: 8748 16:59:04 -3183.412765 2587988443.588613 BFGS: 8749 16:59:04 -3183.461189 2585907894.683337 BFGS: 8750 16:59:04 -3183.480623 2642117799.602986 BFGS: 8751 16:59:05 -3183.507987 2663266401.502013 BFGS: 8752 16:59:05 -3183.756145 2500566029.438500 BFGS: 8753 16:59:06 -3183.702598 2473335760.065728 BFGS: 8754 16:59:06 -3183.773511 2320071048.438398 BFGS: 8755 16:59:06 -3183.785499 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16:59:14 -3183.966106 2080201422.001214 BFGS: 8776 16:59:15 -3183.987562 2077681049.910183 BFGS: 8777 16:59:15 -3184.030938 2061030266.441527 BFGS: 8778 16:59:16 -3184.005136 1982986278.153609 BFGS: 8779 16:59:16 -3184.061079 2058522798.214036 BFGS: 8780 16:59:17 -3184.096280 2152191580.187720 BFGS: 8781 16:59:17 -3184.041697 2142943462.558368 BFGS: 8782 16:59:17 -3184.052640 2165991703.272865 BFGS: 8783 16:59:18 -3183.710174 2428461318.330396 BFGS: 8784 16:59:18 -3183.735120 2285260793.100203 BFGS: 8785 16:59:18 -3183.957679 2369169395.572623 BFGS: 8786 16:59:19 -3183.971706 2408984017.210589 BFGS: 8787 16:59:19 -3184.067877 2313509132.529125 BFGS: 8788 16:59:20 -3184.112332 2363992857.906040 BFGS: 8789 16:59:20 -3183.966793 2344534751.237604 BFGS: 8790 16:59:21 -3183.814779 2783783321.909528 BFGS: 8791 16:59:21 -3183.788761 2539694514.222700 BFGS: 8792 16:59:22 -3183.712192 2429524757.622123 BFGS: 8793 16:59:22 -3182.704673 2054911525.755375 BFGS: 8794 16:59:22 -3183.066180 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16:59:29 -3184.032884 1890729023.011686 BFGS: 8815 16:59:29 -3184.080038 1952013276.498705 BFGS: 8816 16:59:30 -3184.208555 1962218664.948652 BFGS: 8817 16:59:30 -3184.212771 2025424100.580699 BFGS: 8818 16:59:30 -3184.240691 1946789086.516374 BFGS: 8819 16:59:31 -3184.425057 1833745792.562778 BFGS: 8820 16:59:31 -3184.417124 1804906683.359220 BFGS: 8821 16:59:32 -3184.460725 1718207802.375116 BFGS: 8822 16:59:32 -3184.435741 1759346178.766179 BFGS: 8823 16:59:33 -3184.470532 1737922251.239194 BFGS: 8824 16:59:33 -3184.458934 1660213703.618590 BFGS: 8825 16:59:34 -3184.270815 1787289956.867284 BFGS: 8826 16:59:34 -3184.490729 1790745191.298466 BFGS: 8827 16:59:35 -3184.595273 1612276790.987404 BFGS: 8828 16:59:35 -3184.570543 1625975497.838968 BFGS: 8829 16:59:36 -3184.508860 1594294701.504937 BFGS: 8830 16:59:36 -3184.390091 1752659064.138660 BFGS: 8831 16:59:37 -3184.578842 1647511152.004665 BFGS: 8832 16:59:37 -3184.580344 1631235866.725348 BFGS: 8833 16:59:38 -3184.595284 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732539586.931861 BFGS: 9757 17:05:24 -3147.925462 763179540.557223 BFGS: 9758 17:05:25 -3149.109407 761244579.351181 BFGS: 9759 17:05:25 -3152.452734 777062573.331716 BFGS: 9760 17:05:26 -3153.493744 776214927.253298 BFGS: 9761 17:05:26 -3156.990903 798745246.242147 BFGS: 9762 17:05:27 -3159.551054 806726379.432741 BFGS: 9763 17:05:27 -3160.988391 794670959.599402 BFGS: 9764 17:05:28 -3161.672637 784133413.288144 BFGS: 9765 17:05:28 -3162.377259 762731204.300189 BFGS: 9766 17:05:29 -3161.544547 755110288.470001 BFGS: 9767 17:05:29 -3164.591796 752156842.487591 BFGS: 9768 17:05:30 -3165.402429 763621785.981371 BFGS: 9769 17:05:30 -3165.592117 757656378.404144 BFGS: 9770 17:05:31 -3166.209556 772396598.061127 BFGS: 9771 17:05:31 -3166.400993 758345174.717931 BFGS: 9772 17:05:32 -3166.674708 747290031.803809 BFGS: 9773 17:05:32 -3167.634034 734526730.291469 BFGS: 9774 17:05:33 -3168.277570 714807029.602968 BFGS: 9775 17:05:33 -3169.153932 717738184.984140 BFGS: 9776 17:05:33 -3169.575250 731995669.163395 BFGS: 9777 17:05:34 -3169.840366 731446935.610833 BFGS: 9778 17:05:34 -3170.313837 728576164.677575 BFGS: 9779 17:05:35 -3170.230030 752369136.001456 BFGS: 9780 17:05:35 -3170.431759 744176005.663908 BFGS: 9781 17:05:36 -3170.613462 753372993.250343 BFGS: 9782 17:05:36 -3170.650525 745440529.878456 BFGS: 9783 17:05:37 -3170.884519 733955878.986896 BFGS: 9784 17:05:37 -3168.254931 741161523.595905 BFGS: 9785 17:05:38 -3170.077165 750664480.477111 BFGS: 9786 17:05:38 -3171.755870 771353565.468307 BFGS: 9787 17:05:39 -3172.944639 785291515.054952 BFGS: 9788 17:05:39 -3173.803289 807736078.109386 BFGS: 9789 17:05:40 -3174.378516 829569290.434439 BFGS: 9790 17:05:40 -3174.406738 876026371.615612 BFGS: 9791 17:05:40 -3177.103496 923317429.529313 BFGS: 9792 17:05:41 -3177.267779 941210424.258611 BFGS: 9793 17:05:41 -3177.191775 971566836.992936 BFGS: 9794 17:05:42 -3177.671109 939823403.407380 BFGS: 9795 17:05:42 -3178.368683 926443022.139656 BFGS: 9796 17:05:43 -3179.211653 925897065.840623 BFGS: 9797 17:05:43 -3179.613368 933433526.060275 BFGS: 9798 17:05:44 -3179.898825 936557624.094983 BFGS: 9799 17:05:44 -3180.636413 934741391.015424 BFGS: 9800 17:05:45 -3181.298605 919573078.396243 BFGS: 9801 17:05:45 -3181.505106 913841419.094430 BFGS: 9802 17:05:46 -3181.300898 899323021.178978 BFGS: 9803 17:05:46 -3181.586957 900564058.850296 BFGS: 9804 17:05:47 -3176.130110 890026050.427490 BFGS: 9805 17:05:47 -3177.615428 883758694.299018 BFGS: 9806 17:05:48 -3178.997754 884394185.533020 BFGS: 9807 17:05:48 -3179.809142 910760032.202676 BFGS: 9808 17:05:49 -3180.431133 910926214.029423 BFGS: 9809 17:05:49 -3181.309840 908612436.694904 BFGS: 9810 17:05:49 -3181.868177 866950166.724489 BFGS: 9811 17:05:50 -3181.969101 867722579.105212 BFGS: 9812 17:05:50 -3181.419090 811144542.156716 BFGS: 9813 17:05:51 -3181.748055 802075420.177604 BFGS: 9814 17:05:51 -3182.270106 815620843.049565 BFGS: 9815 17:05:52 -3183.126168 832755295.616843 BFGS: 9816 17:05:52 -3183.300523 835502704.143957 BFGS: 9817 17:05:53 -3183.438817 834604154.649844 BFGS: 9818 17:05:53 -3183.602719 826665258.967265 BFGS: 9819 17:05:54 -3183.848830 831559871.643514 BFGS: 9820 17:05:54 -3184.208044 828969046.822809 BFGS: 9821 17:05:55 -3184.347667 833976571.010039 BFGS: 9822 17:05:55 -3184.767546 829480850.493706 BFGS: 9823 17:05:56 -3185.079274 809093464.012027 BFGS: 9824 17:05:56 -3185.337549 813375230.233948 BFGS: 9825 17:05:57 -3185.334633 808296180.932597 BFGS: 9826 17:05:57 -3185.512020 809224586.096216 BFGS: 9827 17:05:58 -3185.564813 795349193.746677 BFGS: 9828 17:05:58 -3185.512169 812235477.836431 BFGS: 9829 17:05:58 -3185.237239 796096572.630686 BFGS: 9830 17:05:59 -3185.515913 799424293.643365 BFGS: 9831 17:05:59 -3185.680230 795246745.365918 BFGS: 9832 17:06:00 -3185.281165 792485411.462510 BFGS: 9833 17:06:00 -3185.529787 798661750.251212 BFGS: 9834 17:06:01 -3185.691527 805149834.991078 BFGS: 9835 17:06:01 -3185.859510 800541105.669031 BFGS: 9836 17:06:02 -3185.422716 793510993.117174 BFGS: 9837 17:06:02 -3185.175007 819096477.833123 BFGS: 9838 17:06:03 -3185.603174 806090041.137008 BFGS: 9839 17:06:03 -3185.846631 801328727.930151 BFGS: 9840 17:06:03 -3185.896092 804020773.441097 BFGS: 9841 17:06:04 -3185.983300 804387192.118254 BFGS: 9842 17:06:04 -3185.660612 777757147.100739 BFGS: 9843 17:06:04 -3185.698369 804665114.923373 BFGS: 9844 17:06:05 -3185.827814 791088359.151891 BFGS: 9845 17:06:05 -3185.970646 792215528.630751 BFGS: 9846 17:06:05 -3185.700688 813182801.846062 BFGS: 9847 17:06:06 -3185.833137 790832855.760854 BFGS: 9848 17:06:06 -3185.786398 802089509.935937 BFGS: 9849 17:06:06 -3185.905285 791412309.126781 BFGS: 9850 17:06:07 -3186.032237 798504012.650944 BFGS: 9851 17:06:07 -3186.218507 804337128.990323 BFGS: 9852 17:06:08 -3186.223675 805069784.988937 BFGS: 9853 17:06:08 -3186.207630 809112315.918018 BFGS: 9854 17:06:08 -3186.222797 806657487.020046 BFGS: 9855 17:06:09 -3186.242506 802429835.345677 BFGS: 9856 17:06:09 -3186.224931 802672025.486261 BFGS: 9857 17:06:09 -3186.216472 793100887.580882 BFGS: 9858 17:06:09 -3186.375190 800669800.412056 BFGS: 9859 17:06:10 -3186.365275 813065714.144205 BFGS: 9860 17:06:10 -3186.286114 802381957.266213 BFGS: 9861 17:06:11 -3186.118154 808938324.364950 BFGS: 9862 17:06:11 -3186.217081 811159329.624275 BFGS: 9863 17:06:11 -3186.317448 810352797.147674 BFGS: 9864 17:06:12 -3186.376388 817136236.907377 BFGS: 9865 17:06:12 -3186.172789 824813513.577809 BFGS: 9866 17:06:13 -3186.373833 818578636.389333 BFGS: 9867 17:06:13 -3186.461801 817918296.195955 BFGS: 9868 17:06:13 -3186.507064 823534097.331458 BFGS: 9869 17:06:14 -3186.213771 795350043.665126 BFGS: 9870 17:06:14 -3186.073282 816150812.709122 BFGS: 9871 17:06:15 -3186.359302 822593947.390823 BFGS: 9872 17:06:15 -3186.470597 825957403.918669 BFGS: 9873 17:06:15 -3186.559030 822778907.095281 BFGS: 9874 17:06:16 -3186.558618 815731861.791291 BFGS: 9875 17:06:16 -3186.607960 809133359.713145 BFGS: 9876 17:06:17 -3186.736619 813665571.781777 BFGS: 9877 17:06:17 -3186.669087 810327100.375162 BFGS: 9878 17:06:17 -3186.689910 802119150.611597 BFGS: 9879 17:06:18 -3186.660357 793147250.147036 BFGS: 9880 17:06:18 -3186.724338 789623962.127368 BFGS: 9881 17:06:19 -3186.737837 794312217.205313 BFGS: 9882 17:06:19 -3186.842611 800682821.850649 BFGS: 9883 17:06:19 -3186.676485 824944284.355921 BFGS: 9884 17:06:20 -3186.750206 824494676.556690 BFGS: 9885 17:06:20 -3186.776579 828956963.804960 BFGS: 9886 17:06:20 -3186.884197 819427514.100436 BFGS: 9887 17:06:21 -3186.921645 811782721.009998 BFGS: 9888 17:06:21 -3186.949409 815635301.639146 BFGS: 9889 17:06:21 -3186.965605 821246276.191314 BFGS: 9890 17:06:22 -3186.963605 822710319.035416 BFGS: 9891 17:06:22 -3186.979672 823282337.497445 BFGS: 9892 17:06:22 -3186.947930 812490264.114286 BFGS: 9893 17:06:23 -3186.693625 803052566.755950 BFGS: 9894 17:06:23 -3186.780662 808483523.977546 BFGS: 9895 17:06:23 -3186.878918 805104982.134794 BFGS: 9896 17:06:24 -3186.946345 812577098.863610 BFGS: 9897 17:06:24 -3186.856575 792669626.238937 BFGS: 9898 17:06:24 -3186.844006 788154393.499969 BFGS: 9899 17:06:25 -3186.783438 790119676.536705 BFGS: 9900 17:06:25 -3186.844375 806359941.125934 BFGS: 9901 17:06:25 -3186.932224 803317953.876797 BFGS: 9902 17:06:26 -3187.008280 806885906.140758 BFGS: 9903 17:06:26 -3187.062890 808873296.246647 BFGS: 9904 17:06:26 -3187.092991 817351457.431826 BFGS: 9905 17:06:27 -3186.992502 806198445.994462 BFGS: 9906 17:06:27 -3186.817363 824481751.644856 BFGS: 9907 17:06:27 -3186.928706 820094322.741200 BFGS: 9908 17:06:28 -3186.932026 806809213.065583 BFGS: 9909 17:06:28 -3187.007858 825812482.656362 BFGS: 9910 17:06:28 -3187.054974 823067790.518416 BFGS: 9911 17:06:29 -3187.110209 820323931.671986 BFGS: 9912 17:06:29 -3187.109417 810300855.133489 BFGS: 9913 17:06:29 -3187.193391 811381985.844734 BFGS: 9914 17:06:30 -3187.215868 809580380.168292 BFGS: 9915 17:06:30 -3187.195749 814374318.583775 BFGS: 9916 17:06:30 -3187.244453 811358167.761314 BFGS: 9917 17:06:31 -3187.246406 811559599.304685 BFGS: 9918 17:06:31 -3187.270947 814935705.029374 BFGS: 9919 17:06:31 -3187.238517 816531753.708243 BFGS: 9920 17:06:31 -3187.188669 824287177.027672 BFGS: 9921 17:06:32 -3187.252072 815199488.908840 BFGS: 9922 17:06:32 -3187.164934 814305608.531568 BFGS: 9923 17:06:32 -3187.181323 813620237.574238 BFGS: 9924 17:06:33 -3187.207426 806166997.101892 BFGS: 9925 17:06:33 -3187.252783 811270446.752479 BFGS: 9926 17:06:33 -3187.077186 823053297.910013 BFGS: 9927 17:06:34 -3186.715342 808795856.201204 BFGS: 9928 17:06:34 -3186.784506 804951663.791727 BFGS: 9929 17:06:34 -3186.818471 802654138.731141 BFGS: 9930 17:06:35 -3186.974719 805890758.315118 BFGS: 9931 17:06:35 -3187.049098 796069727.902414 BFGS: 9932 17:06:35 -3187.123947 810690444.287105 BFGS: 9933 17:06:36 -3187.217246 807974667.081051 BFGS: 9934 17:06:36 -3187.376291 802400979.658862 BFGS: 9935 17:06:36 -3187.351564 789507899.225289 BFGS: 9936 17:06:37 -3187.358578 786650025.309269 BFGS: 9937 17:06:37 -3187.209101 801933244.808495 BFGS: 9938 17:06:37 -3187.391083 790063257.308687 BFGS: 9939 17:06:38 -3187.302153 817003436.294099 BFGS: 9940 17:06:38 -3187.050718 803858906.769688 BFGS: 9941 17:06:38 -3187.243042 794962717.986719 BFGS: 9942 17:06:39 -3187.242181 790453091.260833 BFGS: 9943 17:06:39 -3187.142062 795864117.189911 BFGS: 9944 17:06:39 -3187.359981 799683941.172592 BFGS: 9945 17:06:40 -3187.385593 803025985.617697 BFGS: 9946 17:06:40 -3185.993497 829731563.115335 BFGS: 9947 17:06:40 -3186.632186 822242696.404117 BFGS: 9948 17:06:41 -3186.772988 791737298.707742 BFGS: 9949 17:06:41 -3186.995812 791951152.050063 BFGS: 9950 17:06:41 -3187.215753 789932592.963239 BFGS: 9951 17:06:42 -3187.290807 802243156.680495 BFGS: 9952 17:06:42 -3187.310077 790506719.176314 BFGS: 9953 17:06:42 -3187.496983 794529857.559658 BFGS: 9954 17:06:43 -3187.481682 796431178.133810 BFGS: 9955 17:06:43 -3187.511391 784451139.837443 BFGS: 9956 17:06:43 -3187.459266 786300122.053406 BFGS: 9957 17:06:44 -3187.530947 784330738.339365 BFGS: 9958 17:06:44 -3187.486187 795920593.629497 BFGS: 9959 17:06:44 -3187.245194 766758035.364066 BFGS: 9960 17:06:44 -3187.558686 784908593.078416 BFGS: 9961 17:06:45 -3187.640374 796043050.562060 BFGS: 9962 17:06:45 -3187.601819 819071556.951664 BFGS: 9963 17:06:45 -3187.665835 809267487.594233 BFGS: 9964 17:06:46 -3187.666559 788750341.420320 BFGS: 9965 17:06:46 -3187.699695 805707377.800498 BFGS: 9966 17:06:46 -3187.676099 782255492.365429 BFGS: 9967 17:06:47 -3187.423503 787050642.342437 BFGS: 9968 17:06:47 -3180.791148 825902747.747999 BFGS: 9969 17:06:47 -3182.041375 817009633.612819 BFGS: 9970 17:06:48 -3183.161006 818280785.258848 BFGS: 9971 17:06:48 -3184.216060 808390604.662963 BFGS: 9972 17:06:48 -3185.449286 797631499.270302 BFGS: 9973 17:06:49 -3181.593742 765946955.269333 BFGS: 9974 17:06:49 -3182.418470 767034447.628574 BFGS: 9975 17:06:49 -3183.459619 768175277.201232 BFGS: 9976 17:06:50 -3185.475324 767482087.103590 BFGS: 9977 17:06:50 -3186.023250 756757143.220760 BFGS: 9978 17:06:50 -3186.450385 762665315.050376 BFGS: 9979 17:06:51 -3186.644576 748149879.616121 BFGS: 9980 17:06:51 -3187.014508 768871635.420256 BFGS: 9981 17:06:51 -3187.180834 769652397.627577 BFGS: 9982 17:06:52 -3187.231050 756496062.734192 BFGS: 9983 17:06:52 -3187.019558 748632711.130100 BFGS: 9984 17:06:52 -3187.266219 746732921.093180 BFGS: 9985 17:06:53 -3187.404302 763977032.972842 BFGS: 9986 17:06:53 -3187.565525 764746455.050096 BFGS: 9987 17:06:53 -3187.496118 754042654.699479 BFGS: 9988 17:06:54 -3187.523085 769433644.794963 BFGS: 9989 17:06:54 -3187.582484 773313130.475765 BFGS: 9990 17:06:54 -3187.563339 774144881.869121 BFGS: 9991 17:06:54 -3187.629333 763597435.409295 BFGS: 9992 17:06:55 -3187.631536 768522999.945961 BFGS: 9993 17:06:55 -3187.616506 763520844.477019 BFGS: 9994 17:06:55 -3187.693925 763628620.532776 BFGS: 9995 17:06:56 -3187.606224 767210685.035783 BFGS: 9996 17:06:56 -3187.786351 767253081.071811 BFGS: 9997 17:06:56 -3187.329784 742529930.277388 BFGS: 9998 17:06:57 -3187.621737 766542478.862341 BFGS: 9999 17:06:57 -3187.160203 758349577.929408 BFGS: 10000 17:06:57 -3187.726249 754744724.581707 Minimization converged after hitting the maximum of 10000 steps. Maximum force component: 868883860.0207996 eV/Angstrom Maximum stress component: 0.7591333187573224 eV/Angstrom^3 ==== Minimized structure obtained from ASE ==== symbols = ['O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti', 'Ti'] basis = [[4.09389583e-01 9.55324081e-01 6.47501736e-01] [5.90610417e-01 4.46759191e-02 3.52498264e-01] [7.18837480e-01 6.74650763e-01 4.69326096e-01] [2.81162520e-01 3.25349237e-01 5.30673904e-01] [5.12910040e-01 5.35057202e-01 9.62942566e-02] [4.87089960e-01 4.64942798e-01 9.03705743e-01] [5.01914526e-01 1.60821210e-01 8.05031716e-01] [4.98085474e-01 8.39178790e-01 1.94968284e-01] [7.03693934e-01 4.18018172e-01 8.96667004e-01] [2.96306066e-01 5.81981828e-01 1.03332996e-01] [6.13005721e-01 1.33965236e-01 9.29271725e-01] [3.86994279e-01 8.66034764e-01 7.07282751e-02] [2.92379778e-01 1.91447883e-01 8.14273918e-01] [7.07620222e-01 8.08552117e-01 1.85726082e-01] [7.90997778e-01 3.00271597e-01 3.06161138e-01] [2.09002222e-01 6.99728403e-01 6.93838862e-01] [9.92633914e-01 3.90081156e-03 2.60551782e-01] [7.36608600e-03 9.96099188e-01 7.39448218e-01] [2.71163205e-01 7.78075611e-01 8.65305264e-01] [7.28836795e-01 2.21924389e-01 1.34694736e-01] [1.58924866e-01 7.10362186e-01 4.21418328e-01] [8.41075134e-01 2.89637814e-01 5.78581672e-01] [4.21832768e-01 6.27090047e-01 6.46763808e-01] [5.78167232e-01 3.72909953e-01 3.53236192e-01] [8.25368273e-01 5.93947999e-01 4.49912135e-01] [1.74631727e-01 4.06052001e-01 5.50087865e-01] [2.50832163e-01 5.01044241e-02 2.70510676e-01] [7.49167837e-01 9.49895576e-01 7.29489324e-01] [7.46812767e-01 8.97998317e-01 3.90609836e-01] [2.53187233e-01 1.02001683e-01 6.09390164e-01] [3.44687978e-01 6.38106866e-02 4.21435244e-01] [6.55312022e-01 9.36189313e-01 5.78564756e-01] [2.94144970e-01 5.00558358e-01 2.42548511e-01] [7.05855030e-01 4.99441642e-01 7.57451489e-01] [5.08121947e-01 7.37160026e-02 1.02294013e-01] [4.91878053e-01 9.26283997e-01 8.97705987e-01] [4.82139901e-01 3.51215056e-01 2.03039966e-01] [5.17860099e-01 6.48784944e-01 7.96960034e-01] [6.69323126e-02 7.79816176e-01 2.44788013e-01] [9.33067687e-01 2.20183824e-01 7.55211987e-01] [1.57195259e-01 4.04413555e-01 9.85026779e-01] [8.42804741e-01 5.95586445e-01 1.49732207e-02] [8.48094392e-01 2.76440541e-01 9.63272933e-01] [1.51905608e-01 7.23559459e-01 3.67270669e-02] [1.80387552e-02 1.22374491e-01 9.49903110e-01] [9.81961245e-01 8.77625509e-01 5.00968897e-02] [8.95472776e-01 1.06075640e-01 1.42260043e-01] [1.04527224e-01 8.93924360e-01 8.57739957e-01] [6.72145575e-02 3.83708048e-01 1.92421283e-01] [9.32785443e-01 6.16291952e-01 8.07578717e-01] [8.75803592e-01 3.29933096e-01 6.31100272e-01] [1.24196408e-01 6.70066904e-01 3.68899728e-01] [9.41091109e-01 4.81160170e-01 1.16186418e-01] [5.89088908e-02 5.18839830e-01 8.83813582e-01] [8.95759849e-01 7.55707323e-01 6.80472971e-01] [1.04240151e-01 2.44292677e-01 3.19527029e-01] [1.40598999e-01 8.02875883e-01 5.71935422e-01] [8.59401001e-01 1.97124117e-01 4.28064578e-01] [5.25340456e-01 6.77293942e-01 3.30742962e-01] [4.74659544e-01 3.22706058e-01 6.69257038e-01] [7.17198473e-01 7.40357392e-01 6.31494678e-01] [2.82801527e-01 2.59642608e-01 3.68505322e-01] [2.91481216e-01 4.65975488e-01 8.00145910e-01] [7.08518784e-01 5.34024512e-01 1.99854090e-01] [3.68487636e-01 6.86068881e-01 5.12031770e-01] [6.31512364e-01 3.13931119e-01 4.87968230e-01] [4.08993470e-08 3.63820272e-08 4.99999994e-01] [9.99999959e-01 9.99999964e-01 5.00000006e-01] [9.99996592e-01 3.12589305e-06 4.99999163e-01] [3.40846469e-06 9.99996874e-01 5.00000837e-01] [7.23274128e-01 8.42911710e-01 9.49833631e-01] [2.76725872e-01 1.57088290e-01 5.01663693e-02] [1.19304646e-07 1.03912597e-07 4.99999981e-01] [9.99999881e-01 9.99999896e-01 5.00000019e-01] [9.98276547e-01 9.98489416e-01 5.00434542e-01] [1.72345250e-03 1.51058432e-03 4.99565458e-01] [2.42574057e-06 9.99997822e-01 5.00000569e-01] [9.99997574e-01 2.17824172e-06 4.99999431e-01] [9.98247456e-01 9.98466816e-01 5.00317541e-01] [1.75254358e-03 1.53318449e-03 4.99682459e-01] [9.99997575e-01 2.17814840e-06 4.99999431e-01] [2.42544051e-06 9.99997822e-01 5.00000569e-01] [4.36482983e-01 6.72547358e-01 4.11529923e-01] [5.63517017e-01 3.27452642e-01 5.88470077e-01] [2.76011146e-01 1.55969384e-01 4.98505773e-02] [7.23988854e-01 8.44030616e-01 9.50149423e-01] [5.63521712e-01 3.27454948e-01 5.88469600e-01] [4.36478288e-01 6.72545052e-01 4.11530400e-01] [5.63745842e-01 3.26602736e-01 5.88041468e-01] [4.36254158e-01 6.73397264e-01 4.11958532e-01] [2.76725455e-01 1.57088851e-01 5.01656333e-02] [7.23274545e-01 8.42911149e-01 9.49834367e-01] [7.20851785e-01 8.39483611e-01 9.48951280e-01] [2.79148215e-01 1.60516389e-01 5.10487196e-02] [4.61658579e-02 5.39632712e-01 9.55537463e-01] [9.53834142e-01 4.60367288e-01 4.44625365e-02] [9.98250006e-01 9.98466288e-01 5.00316956e-01] [1.74999398e-03 1.53371162e-03 4.99683044e-01] [9.99766644e-01 9.99791856e-01 5.00042508e-01] [2.33355514e-04 2.08144465e-04 4.99957492e-01] [2.79152674e-01 1.60504940e-01 5.10870859e-02] [7.20847326e-01 8.39495060e-01 9.48912914e-01]] cellpar = Cell([[8.257103977548656, -0.9784716002473802, -0.03348902074531559], [-1.83796833944269, 6.323942533760375, -0.8032903697354425], [4.02123915103397, -1.3410140290704688, 9.483510706492197]]) forces = [[ 1.60467212e+00 6.14723013e+00 6.17801983e+00] [-1.60467212e+00 -6.14723013e+00 -6.17801983e+00] [ 7.43698357e+00 4.65902737e+00 2.62474750e+00] [-7.43698357e+00 -4.65902737e+00 -2.62474750e+00] [ 5.25178379e+00 4.23883081e+00 -4.18991708e+00] [-5.25178379e+00 -4.23883081e+00 4.18991708e+00] [-2.09478125e-01 3.66294768e+00 -7.07474292e+00] [ 2.09478125e-01 -3.66294768e+00 7.07474292e+00] [ 9.16757098e-01 -1.21674906e+00 6.09421402e+00] [-9.16757098e-01 1.21674906e+00 -6.09421402e+00] [ 4.65023469e+00 7.85659891e-02 -9.10419324e-01] [-4.65023469e+00 -7.85659891e-02 9.10419324e-01] [-1.05189706e+00 -2.35157870e+00 -3.67902589e+00] [ 1.05189706e+00 2.35157870e+00 3.67902589e+00] [-1.74504464e+00 2.42983555e+00 3.03551255e+00] [ 1.74504464e+00 -2.42983555e+00 -3.03551255e+00] [-1.84996984e+00 -8.69217954e+00 4.40875156e+00] [ 1.84996984e+00 8.69217954e+00 -4.40875156e+00] [ 1.51708422e+00 2.53976982e+00 -3.93494481e+00] [-1.51708422e+00 -2.53976982e+00 3.93494481e+00] [-2.92989288e+00 -5.08695927e+00 8.21273320e+00] [ 2.92989288e+00 5.08695927e+00 -8.21273320e+00] [-3.33789774e+00 7.82612184e-02 3.31412488e+00] [ 3.33789774e+00 -7.82612184e-02 -3.31412488e+00] [-1.15262184e+00 1.98262771e+00 -9.17406837e-01] [ 1.15262184e+00 -1.98262771e+00 9.17406837e-01] [-1.45892413e+00 1.10913234e+01 -2.36594022e+01] [ 1.45892413e+00 -1.10913234e+01 2.36594022e+01] [ 6.68119814e+00 1.17699983e+01 -4.97684133e+00] [-6.68119814e+00 -1.17699983e+01 4.97684133e+00] [-9.88668897e+00 3.24846888e+00 2.22907658e+00] [ 9.88668897e+00 -3.24846888e+00 -2.22907658e+00] [-1.34148460e+00 -6.31018704e-01 -2.90124638e+00] [ 1.34148460e+00 6.31018704e-01 2.90124638e+00] [-4.30355439e+00 -9.54629818e+00 1.28853117e+01] [ 4.30355439e+00 9.54629818e+00 -1.28853117e+01] [ 9.83507340e-01 4.64639453e+00 -6.51151891e-01] [-9.83507340e-01 -4.64639453e+00 6.51151891e-01] [-3.03634891e+00 -1.61698269e+00 2.73609590e+00] [ 3.03634891e+00 1.61698269e+00 -2.73609590e+00] [ 4.66450332e+00 3.16396969e+00 -1.35133966e+00] [-4.66450332e+00 -3.16396969e+00 1.35133966e+00] [ 4.92733438e+00 -5.17993469e-02 -9.50844548e-01] [-4.92733438e+00 5.17993469e-02 9.50844548e-01] [ 9.51671487e-01 1.95226054e+00 -2.16462609e+00] [-9.51671487e-01 -1.95226054e+00 2.16462609e+00] [ 5.21089604e+00 -3.68944337e+00 -3.64095270e+00] [-5.21089604e+00 3.68944337e+00 3.64095270e+00] [ 3.84310813e+00 -9.38081030e+00 2.73179185e-01] [-3.84310813e+00 9.38081030e+00 -2.73179185e-01] [ 4.76455307e-02 -5.21239968e+00 -1.77829135e+00] [-4.76455307e-02 5.21239968e+00 1.77829135e+00] [-5.06705514e+00 8.05457765e-01 -1.38002907e+00] [ 5.06705514e+00 -8.05457765e-01 1.38002907e+00] [-7.91864771e+00 -9.51051242e+00 -2.98701808e+00] [ 7.91864771e+00 9.51051242e+00 2.98701808e+00] [ 1.72034750e+01 -1.86969523e+01 -8.24446711e+00] [-1.72034750e+01 1.86969523e+01 8.24446711e+00] [ 4.22011005e+00 3.51887547e+00 -5.95044684e-03] [-4.22011005e+00 -3.51887547e+00 5.95044684e-03] [-3.76906929e+00 3.75565928e+00 -1.71461197e+00] [ 3.76906929e+00 -3.75565928e+00 1.71461197e+00] [-1.52646808e-01 6.38265259e-01 -2.02533094e-01] [ 1.52646808e-01 -6.38265259e-01 2.02533094e-01] [-7.78837534e+00 -2.66883702e+00 6.20336007e+00] [ 7.78837534e+00 2.66883702e+00 -6.20336007e+00] [-3.31697723e+04 -4.82427673e+05 -1.07905076e+06] [ 3.31697723e+04 4.82427673e+05 1.07905076e+06] [ 4.29894866e+03 -4.51303876e+03 -2.60433969e+04] [-4.29894866e+03 4.51303876e+03 2.60433969e+04] [ 3.52066242e+03 -2.09737381e+04 -1.74377881e+04] [-3.52066242e+03 2.09737381e+04 1.74377881e+04] [-1.44431196e+06 1.40608339e+06 -6.97792270e+05] [ 1.44431196e+06 -1.40608339e+06 6.97792270e+05] [-2.56730398e+03 -3.48766640e+03 6.34100750e+01] [ 2.56730398e+03 3.48766640e+03 -6.34100750e+01] [-3.34546447e+08 -8.68883860e+08 2.12119191e+08] [ 3.34546447e+08 8.68883860e+08 -2.12119191e+08] [ 1.60113258e+04 6.70981952e+04 -9.87559202e+03] [-1.60113258e+04 -6.70981952e+04 9.87559202e+03] [-3.34480934e+08 -8.68830824e+08 2.11999721e+08] [ 3.34480934e+08 8.68830824e+08 -2.11999721e+08] [ 3.75229146e+03 -2.39505602e+04 -2.01404575e+04] [-3.75229146e+03 2.39505602e+04 2.01404575e+04] [ 6.60211635e+01 -1.32058656e+02 2.76230996e+02] [-6.60211635e+01 1.32058656e+02 -2.76230996e+02] [ 3.81556802e+03 -2.39922114e+04 -2.00499334e+04] [-3.81556802e+03 2.39922114e+04 2.00499334e+04] [-7.27121755e+01 5.23063989e+01 -9.16585722e+01] [ 7.27121755e+01 -5.23063989e+01 9.16585722e+01] [ 3.54424918e+03 -2.09463151e+04 -1.75576670e+04] [-3.54424918e+03 2.09463151e+04 1.75576670e+04] [-1.30719431e+03 1.42172575e+02 9.14192261e+02] [ 1.30719431e+03 -1.42172575e+02 -9.14192261e+02] [ 3.01749892e+00 -1.36708072e+01 -2.05964509e+00] [-3.01749892e+00 1.36708072e+01 2.05964509e+00] [-1.30421812e+04 -6.46443582e+04 8.20885708e+03] [ 1.30421812e+04 6.46443582e+04 -8.20885708e+03] [ 3.28343463e+02 -5.20448223e+02 -3.90897805e+02] [-3.28343463e+02 5.20448223e+02 3.90897805e+02] [-1.41078690e+03 2.46595394e+02 7.53043923e+02] [ 1.41078690e+03 -2.46595394e+02 -7.53043923e+02]] stress = [ 0.07477768 -0.32185406 0.41749535 -0.75913332 -0.25021365 0.3153162 ] energy per atom = -31.252218123217393 =============================================== Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.