N E dE d eps ncg rms rms(c) DAV: 1 0.163115099488E+04 0.16312E+04 -0.42246E+04 312 0.681E+02 DAV: 2 0.296729797432E+03 -0.13344E+04 -0.12476E+04 432 0.165E+02 DAV: 3 -0.352102874609E+03 -0.64883E+03 -0.64262E+03 368 0.121E+02 DAV: 4 -0.429848320039E+03 -0.77745E+02 -0.77341E+02 328 0.524E+01 DAV: 5 -0.431745382335E+03 -0.18971E+01 -0.18937E+01 352 0.815E+00 0.427E+01 DAV: 6 -0.385498771641E+03 0.46247E+02 -0.14769E+02 320 0.281E+01 0.209E+01 DAV: 7 -0.381944189234E+03 0.35546E+01 -0.12991E+01 352 0.772E+00 0.104E+01 DAV: 8 -0.380456180488E+03 0.14880E+01 -0.18120E+00 336 0.367E+00 0.421E+00 DAV: 9 -0.379866982108E+03 0.58920E+00 -0.61438E-01 336 0.192E+00 0.887E-01 DAV: 10 -0.379818368025E+03 0.48614E-01 -0.10380E-01 352 0.877E-01 0.653E-01 DAV: 11 -0.379791351808E+03 0.27016E-01 -0.16479E-02 320 0.395E-01 0.350E-01 DAV: 12 -0.379773010030E+03 0.18342E-01 -0.18054E-02 320 0.386E-01 0.205E-01 DAV: 13 -0.379774124842E+03 -0.11148E-02 -0.13541E-02 328 0.389E-01 0.150E-01 DAV: 14 -0.379789431376E+03 -0.15307E-01 -0.89919E-03 304 0.312E-01 0.125E-01 DAV: 15 -0.379801141652E+03 -0.11710E-01 -0.33548E-03 344 0.175E-01 0.608E-02 DAV: 16 -0.379809924348E+03 -0.87827E-02 -0.13079E-03 288 0.104E-01 0.546E-02 DAV: 17 -0.379817012499E+03 -0.70882E-02 -0.95730E-04 392 0.921E-02 0.408E-02 DAV: 18 -0.379824493261E+03 -0.74808E-02 -0.49309E-04 304 0.474E-02 0.295E-02 DAV: 19 -0.379830158745E+03 -0.56655E-02 -0.45585E-04 320 0.373E-02 0.170E-02 DAV: 20 -0.379831646815E+03 -0.14881E-02 -0.12501E-04 336 0.257E-02 0.114E-02 DAV: 21 -0.379832554624E+03 -0.90781E-03 -0.24876E-05 240 0.106E-02 0.777E-03 DAV: 22 -0.379833353364E+03 -0.79874E-03 -0.46755E-05 288 0.128E-02 0.370E-03 DAV: 23 -0.379833628483E+03 -0.27512E-03 -0.81210E-06 232 0.616E-03 0.205E-03 DAV: 24 -0.379833788795E+03 -0.16031E-03 -0.65904E-06 200 0.472E-03 0.207E-03 DAV: 25 -0.379833883315E+03 -0.94521E-04 -0.26238E-06 224 0.313E-03 0.156E-03 DAV: 26 -0.379833939482E+03 -0.56167E-04 -0.23957E-06 200 0.360E-03 0.707E-04 DAV: 27 -0.379833963403E+03 -0.23921E-04 -0.16165E-06 232 0.291E-03 0.155E-03 DAV: 28 -0.379833972314E+03 -0.89108E-05 -0.46936E-07 224 0.145E-03 1 F= -.37983397E+03 E0= -.37983784E+03 d E =-.379834E+03 N E dE d eps ncg rms rms(c) DAV: 1 -0.380428606665E+03 -0.59464E+00 -0.41919E+02 272 0.404E+01 0.740E+00 DAV: 2 -0.381993221251E+03 -0.15646E+01 -0.17381E+01 300 0.708E+00 0.410E+00 DAV: 3 -0.381805105847E+03 0.18812E+00 -0.52140E-01 344 0.170E+00 0.325E+00 DAV: 4 -0.381734188808E+03 0.70917E-01 -0.35291E-01 312 0.142E+00 0.149E+00 DAV: 5 -0.381721484751E+03 0.12704E-01 -0.46595E-02 344 0.597E-01 0.647E-01 DAV: 6 -0.381712160788E+03 0.93240E-02 -0.22396E-02 360 0.534E-01 0.165E-01 DAV: 7 -0.381712038506E+03 0.12228E-03 -0.13487E-02 336 0.296E-01 0.180E-01 DAV: 8 -0.381711236484E+03 0.80202E-03 -0.12380E-03 312 0.102E-01 0.101E-01 DAV: 9 -0.381710971031E+03 0.26545E-03 -0.96329E-04 304 0.119E-01 0.397E-02 DAV: 10 -0.381711334256E+03 -0.36322E-03 -0.67791E-04 336 0.973E-02 0.504E-02 DAV: 11 -0.381712078109E+03 -0.74385E-03 -0.50011E-04 352 0.920E-02 0.206E-02 DAV: 12 -0.381712510622E+03 -0.43251E-03 -0.22400E-04 328 0.501E-02 0.201E-02 DAV: 13 -0.381712810143E+03 -0.29952E-03 -0.40879E-05 296 0.213E-02 0.134E-02 DAV: 14 -0.381713109206E+03 -0.29906E-03 -0.17004E-05 240 0.184E-02 0.729E-03 DAV: 15 -0.381713406305E+03 -0.29710E-03 -0.30760E-05 256 0.179E-02 0.438E-03 DAV: 16 -0.381713575567E+03 -0.16926E-03 -0.13641E-05 240 0.109E-02 0.380E-03 DAV: 17 -0.381713660528E+03 -0.84961E-04 -0.48575E-06 216 0.620E-03 0.353E-03 DAV: 18 -0.381713734569E+03 -0.74041E-04 -0.30701E-06 216 0.417E-03 0.180E-03 DAV: 19 -0.381713780205E+03 -0.45637E-04 -0.22104E-06 232 0.302E-03 0.121E-03 DAV: 20 -0.381713803464E+03 -0.23259E-04 -0.95832E-07 216 0.223E-03 0.896E-04 DAV: 21 -0.381713819191E+03 -0.15727E-04 -0.86121E-07 232 0.204E-03 0.940E-04 DAV: 22 -0.381713823666E+03 -0.44745E-05 -0.28741E-07 240 0.130E-03 2 F= -.38171382E+03 E0= -.38171769E+03 d E =-.187985E+01 N E dE d eps ncg rms rms(c) DAV: 1 -0.381727061734E+03 -0.13243E-01 -0.77206E+00 264 0.555E+00 0.555E-01 DAV: 2 -0.381733698596E+03 -0.66369E-02 -0.99812E-02 312 0.594E-01 0.340E-01 DAV: 3 -0.381732388044E+03 0.13106E-02 -0.38387E-03 336 0.140E-01 0.237E-01 DAV: 4 -0.381732026691E+03 0.36135E-03 -0.24514E-03 304 0.122E-01 0.888E-02 DAV: 5 -0.381732066850E+03 -0.40159E-04 -0.79097E-04 360 0.708E-02 0.419E-02 DAV: 6 -0.381732052404E+03 0.14446E-04 -0.14235E-04 312 0.329E-02 0.226E-02 DAV: 7 -0.381732044424E+03 0.79798E-05 -0.23114E-05 288 0.160E-02 3 F= -.38173204E+03 E0= -.38173591E+03 d E =-.189807E+01 N E dE d eps ncg rms rms(c) DAV: 1 -0.380301806284E+03 0.14302E+01 -0.42186E+02 264 0.473E+01 0.143E+01 DAV: 2 -0.382056516508E+03 -0.17547E+01 -0.21418E+01 328 0.833E+00 0.573E+00 DAV: 3 -0.381819801411E+03 0.23672E+00 -0.71422E-01 336 0.205E+00 0.467E+00 DAV: 4 -0.381747725538E+03 0.72076E-01 -0.56343E-01 320 0.167E+00 0.217E+00 DAV: 5 -0.381741748854E+03 0.59767E-02 -0.64607E-02 352 0.699E-01 0.113E+00 DAV: 6 -0.381734687179E+03 0.70617E-02 -0.32405E-02 328 0.554E-01 0.171E-01 DAV: 7 -0.381734924734E+03 -0.23755E-03 -0.98291E-03 328 0.258E-01 0.157E-01 DAV: 8 -0.381734631266E+03 0.29347E-03 -0.90189E-04 320 0.950E-02 0.113E-01 DAV: 9 -0.381734431563E+03 0.19970E-03 -0.40014E-04 336 0.110E-01 0.492E-02 DAV: 10 -0.381734465783E+03 -0.34220E-04 -0.61172E-04 352 0.107E-01 0.393E-02 DAV: 11 -0.381734535294E+03 -0.69511E-04 -0.44495E-04 336 0.547E-02 0.423E-02 DAV: 12 -0.381734529177E+03 0.61173E-05 -0.31921E-05 312 0.137E-02 4 F= -.38173453E+03 E0= -.38174057E+03 d E =-.248475E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.382148201483E+03 -0.41367E+00 -0.11843E+02 264 0.257E+01 0.324E+00 DAV: 2 -0.382335295631E+03 -0.18709E+00 -0.25600E+00 312 0.332E+00 0.152E+00 DAV: 3 -0.382297933835E+03 0.37362E-01 -0.92053E-02 336 0.829E-01 0.946E-01 DAV: 4 -0.382287599556E+03 0.10334E-01 -0.93411E-02 320 0.783E-01 0.301E-01 DAV: 5 -0.382287765485E+03 -0.16593E-03 -0.16970E-02 328 0.334E-01 0.237E-01 DAV: 6 -0.382287694875E+03 0.70610E-04 -0.32147E-03 312 0.147E-01 0.115E-01 DAV: 7 -0.382287573028E+03 0.12185E-03 -0.43517E-04 320 0.622E-02 0.778E-02 DAV: 8 -0.382287482766E+03 0.90262E-04 -0.18335E-04 304 0.506E-02 0.283E-02