iterations/neb1_max2_image05_iter2_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.423564155132E+04 0.42356E+04 -0.25397E+05 9008 0.103E+03
DAV: 2 -0.102153421971E+03 -0.43378E+04 -0.39349E+04 10992 0.248E+02
DAV: 3 -0.425299516416E+03 -0.32315E+03 -0.30252E+03 10264 0.658E+01
DAV: 4 -0.433712171584E+03 -0.84127E+01 -0.83182E+01 10840 0.107E+01
DAV: 5 -0.434013245436E+03 -0.30107E+00 -0.30010E+00 11496 0.194E+00 0.103E+02
RMM: 6 -0.376321972725E+03 0.57691E+02 -0.11524E+02 9722 0.146E+01 0.700E+01
RMM: 7 -0.562487780964E+03 -0.18617E+03 -0.22187E+02 10273 0.167E+01 0.103E+02
RMM: 8 -0.506674419004E+03 0.55813E+02 -0.10638E+02 10247 0.118E+01 0.865E+01
RMM: 9 -0.404724727971E+03 0.10195E+03 -0.45417E+01 10151 0.806E+00 0.482E+01
RMM: 10 -0.428871769063E+03 -0.24147E+02 -0.58093E+01 10621 0.922E+00 0.596E+01
RMM: 11 -0.383118061240E+03 0.45754E+02 -0.11651E+01 9633 0.474E+00 0.357E+01
RMM: 12 -0.375573469008E+03 0.75446E+01 -0.79977E+00 10238 0.349E+00 0.275E+01
RMM: 13 -0.374941141633E+03 0.63233E+00 -0.44990E+00 10384 0.260E+00 0.187E+01
RMM: 14 -0.376145979005E+03 -0.12048E+01 -0.21834E+00 10318 0.181E+00 0.130E+01
RMM: 15 -0.380001150380E+03 -0.38552E+01 -0.95449E-01 10260 0.127E+00 0.112E+01
RMM: 16 -0.385032718627E+03 -0.50316E+01 -0.20285E+00 11152 0.174E+00 0.111E+01
RMM: 17 -0.388591331894E+03 -0.35586E+01 -0.11898E+00 10731 0.136E+00 0.800E+00
RMM: 18 -0.391259033674E+03 -0.26677E+01 -0.66387E-01 10441 0.973E-01 0.669E+00
RMM: 19 -0.395086078813E+03 -0.38270E+01 -0.10235E+00 11435 0.108E+00 0.612E+00
RMM: 20 -0.396978859507E+03 -0.18928E+01 -0.37071E-01 10792 0.658E-01 0.576E+00
RMM: 21 -0.397531649647E+03 -0.55279E+00 -0.12582E-01 10533 0.387E-01 0.562E+00
RMM: 22 -0.399735884878E+03 -0.22042E+01 -0.63591E-01 12163 0.809E-01 0.537E+00
RMM: 23 -0.404252253332E+03 -0.45164E+01 -0.23520E+00 14113 0.143E+00 0.629E+00
RMM: 24 -0.406942246130E+03 -0.26900E+01 -0.15816E+00 13801 0.111E+00 0.643E+00
RMM: 25 -0.408108804785E+03 -0.11666E+01 -0.43240E-01 12040 0.613E-01 0.580E+00
RMM: 26 -0.409025001188E+03 -0.91620E+00 -0.14091E-01 11048 0.365E-01 0.577E+00
RMM: 27 -0.409515150210E+03 -0.49015E+00 -0.55991E-02 10645 0.238E-01 0.581E+00
RMM: 28 -0.410072143898E+03 -0.55699E+00 -0.23659E-01 12610 0.469E-01 0.500E+00
RMM: 29 -0.410696141223E+03 -0.62400E+00 -0.18906E-01 12573 0.495E-01 0.441E+00
RMM: 30 -0.411248311230E+03 -0.55217E+00 -0.72237E-02 11215 0.348E-01 0.303E+00
RMM: 31 -0.412204968925E+03 -0.95666E+00 -0.54521E-02 10676 0.290E-01 0.273E+00
RMM: 32 -0.413117799408E+03 -0.91283E+00 -0.81078E-02 11283 0.330E-01 0.214E+00
RMM: 33 -0.413687272997E+03 -0.56947E+00 -0.36453E-02 10561 0.233E-01 0.198E+00
RMM: 34 -0.413891658155E+03 -0.20439E+00 -0.15753E-02 10311 0.152E-01 0.158E+00
RMM: 35 -0.414014363700E+03 -0.12271E+00 -0.76543E-03 10308 0.104E-01 0.147E+00
RMM: 36 -0.414076560070E+03 -0.62196E-01 -0.96657E-03 10923 0.115E-01 0.116E+00
RMM: 37 -0.414162800622E+03 -0.86241E-01 -0.90620E-03 11097 0.105E-01 0.846E-01
RMM: 38 -0.414285095167E+03 -0.12229E+00 -0.34867E-03 10550 0.673E-02 0.722E-01
RMM: 39 -0.414364397439E+03 -0.79302E-01 -0.35022E-03 10943 0.660E-02 0.797E-01
RMM: 40 -0.414410330216E+03 -0.45933E-01 -0.45658E-03 11426 0.719E-02 0.667E-01
RMM: 41 -0.414480111016E+03 -0.69781E-01 -0.68203E-03 12004 0.792E-02 0.458E-01
RMM: 42 -0.414582336018E+03 -0.10223E+00 -0.67941E-03 11861 0.755E-02 0.482E-01
RMM: 43 -0.414632204894E+03 -0.49869E-01 -0.41303E-03 11478 0.589E-02 0.403E-01
RMM: 44 -0.414733202692E+03 -0.10100E+00 -0.53357E-03 11999 0.610E-02 0.324E-01
RMM: 45 -0.414825325928E+03 -0.92123E-01 -0.52833E-03 12131 0.564E-02 0.283E-01
RMM: 46 -0.414872840583E+03 -0.47515E-01 -0.22109E-03 11388 0.383E-02 0.169E-01
RMM: 47 -0.414920047224E+03 -0.47207E-01 -0.17086E-03 11447 0.329E-02 0.106E-01
RMM: 48 -0.414954958230E+03 -0.34911E-01 -0.55772E-04 10834 0.205E-02 0.840E-02
RMM: 49 -0.414971896800E+03 -0.16939E-01 -0.20709E-04 9942 0.132E-02 0.708E-02
RMM: 50 -0.414981008405E+03 -0.91116E-02 -0.14805E-04 9780 0.104E-02 0.549E-02
RMM: 51 -0.414984725135E+03 -0.37167E-02 -0.61381E-05 8782 0.866E-03 0.327E-02
RMM: 52 -0.414986462340E+03 -0.17372E-02 -0.36865E-05 8011 0.564E-03 0.266E-02
RMM: 53 -0.414987527571E+03 -0.10652E-02 -0.22068E-05 7434 0.417E-03 0.246E-02
RMM: 54 -0.414988268862E+03 -0.74129E-03 -0.14622E-05 7049 0.313E-03 0.169E-02
RMM: 55 -0.414988644885E+03 -0.37602E-03 -0.85215E-06 6734 0.257E-03 0.927E-03
RMM: 56 -0.414988875102E+03 -0.23022E-03 -0.38574E-06 5712 0.179E-03 0.668E-03
RMM: 57 -0.414989110521E+03 -0.23542E-03 -0.13027E-06 4363 0.129E-03 0.707E-03
RMM: 58 -0.414989385770E+03 -0.27525E-03 -0.13524E-06 4658 0.127E-03 0.741E-03
RMM: 59 -0.414989669771E+03 -0.28400E-03 -0.19533E-06 4682 0.132E-03 0.512E-03
RMM: 60 -0.414989924535E+03 -0.25476E-03 -0.17885E-06 5048 0.131E-03 0.291E-03
RMM: 61 -0.414990147716E+03 -0.22318E-03 -0.50226E-07 3249 0.932E-04 0.316E-03
RMM: 62 -0.414990427712E+03 -0.28000E-03 -0.11698E-06 4012 0.110E-03 0.589E-03
RMM: 63 -0.414990508733E+03 -0.81021E-04 -0.39154E-07 3120 0.864E-04 0.362E-03
RMM: 64 -0.414990621232E+03 -0.11250E-03 -0.11295E-06 4107 0.109E-03 0.680E-03
RMM: 65 -0.414990631797E+03 -0.10566E-04 -0.44780E-08 2427 0.787E-04 0.448E-03
RMM: 66 -0.414990648457E+03 -0.16660E-04 -0.11341E-07 2549 0.822E-04 0.320E-03
RMM: 67 -0.414990676387E+03 -0.27930E-04 -0.30979E-07 2877 0.856E-04 0.170E-03
RMM: 68 -0.414990693507E+03 -0.17120E-04 -0.27828E-07 2918 0.860E-04 0.750E-04
RMM: 69 -0.414990701939E+03 -0.84315E-05 -0.22867E-07 2708 0.835E-04
1 F= -.45271340E+03 E0= -.45271327E+03 d E =-.400983E-03 mag= -0.0005