iterations/neb1_max2_image03_iter1_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.425460155445E+04 0.42546E+04 -0.25418E+05 9032 0.103E+03
DAV: 2 -0.935240810003E+02 -0.43481E+04 -0.39501E+04 10976 0.249E+02
DAV: 3 -0.418528642741E+03 -0.32500E+03 -0.30372E+03 10296 0.659E+01
DAV: 4 -0.426927526276E+03 -0.83989E+01 -0.82853E+01 10712 0.106E+01
DAV: 5 -0.427219398273E+03 -0.29187E+00 -0.29114E+00 11024 0.191E+00 0.109E+02
RMM: 6 -0.372615106459E+03 0.54604E+02 -0.11197E+02 9681 0.146E+01 0.750E+01
RMM: 7 -0.848857977022E+03 -0.47624E+03 -0.55667E+02 11765 0.215E+01 0.147E+02
RMM: 8 -0.510475355976E+03 0.33838E+03 -0.13898E+02 10090 0.124E+01 0.962E+01
RMM: 9 -0.392636102181E+03 0.11784E+03 -0.79965E+01 10167 0.114E+01 0.513E+01
RMM: 10 -0.397439297504E+03 -0.48032E+01 -0.51281E+01 10230 0.914E+00 0.545E+01
RMM: 11 -0.369973335188E+03 0.27466E+02 -0.24726E+01 10173 0.624E+00 0.410E+01
RMM: 12 -0.364544411743E+03 0.54289E+01 -0.91719E+00 10007 0.414E+00 0.271E+01
RMM: 13 -0.361209994812E+03 0.33344E+01 -0.22576E+00 10184 0.197E+00 0.197E+01
RMM: 14 -0.362782260136E+03 -0.15723E+01 -0.12030E+00 10174 0.149E+00 0.135E+01
RMM: 15 -0.368490404155E+03 -0.57081E+01 -0.13168E+00 10523 0.149E+00 0.170E+01
RMM: 16 -0.373434960032E+03 -0.49446E+01 -0.15820E+00 10816 0.160E+00 0.190E+01
RMM: 17 -0.374561289758E+03 -0.11263E+01 -0.97037E-01 10456 0.127E+00 0.140E+01
RMM: 18 -0.378828979988E+03 -0.42677E+01 -0.14320E+00 11210 0.140E+00 0.859E+00
RMM: 19 -0.383037073989E+03 -0.42081E+01 -0.10416E+00 10918 0.125E+00 0.676E+00
RMM: 20 -0.386308746860E+03 -0.32717E+01 -0.86490E-01 11032 0.110E+00 0.708E+00
RMM: 21 -0.387969987812E+03 -0.16612E+01 -0.48693E-01 10759 0.804E-01 0.731E+00
RMM: 22 -0.390074438462E+03 -0.21045E+01 -0.65788E-01 11407 0.827E-01 0.798E+00
RMM: 23 -0.393273406384E+03 -0.31990E+01 -0.14063E+00 12321 0.110E+00 0.791E+00
RMM: 24 -0.397179286185E+03 -0.39059E+01 -0.21384E+00 13178 0.129E+00 0.674E+00
RMM: 25 -0.399218844298E+03 -0.20396E+01 -0.58155E-01 11766 0.702E-01 0.538E+00
RMM: 26 -0.400193156399E+03 -0.97431E+00 -0.11768E-01 10749 0.324E-01 0.518E+00
RMM: 27 -0.400638376766E+03 -0.44522E+00 -0.44564E-02 10538 0.193E-01 0.516E+00
RMM: 28 -0.401254438554E+03 -0.61606E+00 -0.11025E-01 11657 0.295E-01 0.532E+00
RMM: 29 -0.401217393495E+03 0.37045E-01 -0.51739E-03 10406 0.845E-02 0.527E+00
RMM: 30 -0.401170139610E+03 0.47254E-01 -0.32477E-03 10262 0.679E-02 0.524E+00
RMM: 31 -0.401100160065E+03 0.69980E-01 -0.14008E-02 12048 0.148E-01 0.528E+00
RMM: 32 -0.400322961758E+03 0.77720E+00 -0.20434E-01 16449 0.557E-01 0.541E+00
RMM: 33 -0.399998700962E+03 0.32426E+00 -0.56633E-02 14768 0.290E-01 0.606E+00
RMM: 34 -0.401192135698E+03 -0.11934E+01 -0.19899E-01 15997 0.519E-01 0.552E+00
RMM: 35 -0.402322106099E+03 -0.11300E+01 -0.39745E-01 17395 0.712E-01 0.623E+00
RMM: 36 -0.403512827658E+03 -0.11907E+01 -0.41293E-01 17114 0.694E-01 0.500E+00
RMM: 37 -0.403603319754E+03 -0.90492E-01 -0.52120E-02 14681 0.253E-01 0.524E+00
RMM: 38 -0.403634142076E+03 -0.30822E-01 -0.29438E-02 13612 0.220E-01 0.487E+00
RMM: 39 -0.403890663135E+03 -0.25652E+00 -0.75009E-02 15296 0.328E-01 0.465E+00
RMM: 40 -0.403948473608E+03 -0.57810E-01 -0.44680E-02 14442 0.247E-01 0.351E+00
RMM: 41 -0.404632896513E+03 -0.68442E+00 -0.40816E-02 14303 0.236E-01 0.257E+00
RMM: 42 -0.404777655416E+03 -0.14476E+00 -0.67171E-03 11157 0.103E-01 0.229E+00
RMM: 43 -0.404930963560E+03 -0.15331E+00 -0.73456E-03 11259 0.997E-02 0.210E+00
RMM: 44 -0.405048944231E+03 -0.11798E+00 -0.10754E-02 11822 0.114E-01 0.177E+00
RMM: 45 -0.405143295984E+03 -0.94352E-01 -0.71289E-03 11363 0.922E-02 0.139E+00
RMM: 46 -0.405246560016E+03 -0.10326E+00 -0.57925E-03 11240 0.803E-02 0.120E+00
RMM: 47 -0.405386230892E+03 -0.13967E+00 -0.19715E-02 13223 0.134E-01 0.817E-01
RMM: 48 -0.405491206600E+03 -0.10498E+00 -0.17849E-02 13166 0.130E-01 0.777E-01
RMM: 49 -0.405580400079E+03 -0.89193E-01 -0.16994E-02 12905 0.122E-01 0.118E+00
RMM: 50 -0.405639442522E+03 -0.59042E-01 -0.53532E-03 11318 0.781E-02 0.103E+00
RMM: 51 -0.405675094857E+03 -0.35652E-01 -0.16781E-02 12678 0.142E-01 0.470E-01
RMM: 52 -0.405765184096E+03 -0.90089E-01 -0.35899E-03 10985 0.666E-02 0.255E-01
RMM: 53 -0.405852750366E+03 -0.87566E-01 -0.37488E-03 11327 0.540E-02 0.205E-01
RMM: 54 -0.405886157805E+03 -0.33407E-01 -0.17129E-03 10962 0.448E-02 0.271E-01
RMM: 55 -0.405924386236E+03 -0.38228E-01 -0.19282E-03 11481 0.367E-02 0.228E-01
RMM: 56 -0.405948253360E+03 -0.23867E-01 -0.89959E-04 11077 0.281E-02 0.171E-01
RMM: 57 -0.405988323926E+03 -0.40071E-01 -0.10399E-03 11598 0.267E-02 0.104E-01
RMM: 58 -0.406018181622E+03 -0.29858E-01 -0.28715E-04 10492 0.169E-02 0.102E-01
RMM: 59 -0.406044105398E+03 -0.25924E-01 -0.16719E-04 10345 0.130E-02 0.128E-01
RMM: 60 -0.406061683342E+03 -0.17578E-01 -0.18919E-04 11181 0.137E-02 0.827E-02
RMM: 61 -0.406073224433E+03 -0.11541E-01 -0.11691E-04 10030 0.106E-02 0.364E-02
RMM: 62 -0.406077888430E+03 -0.46640E-02 -0.75966E-05 8874 0.787E-03 0.256E-02
RMM: 63 -0.406080537671E+03 -0.26492E-02 -0.25551E-05 7501 0.447E-03 0.182E-02
RMM: 64 -0.406081692299E+03 -0.11546E-02 -0.13145E-05 6868 0.325E-03 0.110E-02
RMM: 65 -0.406082442391E+03 -0.75009E-03 -0.90032E-06 6623 0.244E-03 0.190E-02
RMM: 66 -0.406082876711E+03 -0.43432E-03 -0.36955E-06 6097 0.176E-03 0.110E-02
RMM: 67 -0.406083166998E+03 -0.29029E-03 -0.41619E-06 6261 0.186E-03 0.201E-02
RMM: 68 -0.406083262201E+03 -0.95203E-04 -0.81439E-07 3769 0.107E-03 0.150E-02
RMM: 69 -0.406083308849E+03 -0.46648E-04 -0.82876E-07 4253 0.114E-03 0.562E-03
RMM: 70 -0.406083422062E+03 -0.11321E-03 -0.15370E-06 5097 0.132E-03 0.157E-02
RMM: 71 -0.406083468171E+03 -0.46109E-04 -0.10997E-06 4335 0.110E-03 0.189E-02
RMM: 72 -0.406083541179E+03 -0.73008E-04 -0.34460E-07 3045 0.838E-04 0.203E-02
RMM: 73 -0.406083564685E+03 -0.23506E-04 -0.28340E-07 2961 0.817E-04 0.162E-02
RMM: 74 -0.406083605310E+03 -0.40625E-04 -0.61652E-07 3524 0.975E-04 0.105E-02
RMM: 75 -0.406083664236E+03 -0.58926E-04 -0.63417E-07 3491 0.991E-04 0.793E-03
RMM: 76 -0.406083725420E+03 -0.61184E-04 -0.55663E-07 3365 0.936E-04 0.389E-03
RMM: 77 -0.406083735875E+03 -0.10455E-04 -0.11315E-07 2537 0.808E-04 0.325E-03
RMM: 78 -0.406083747611E+03 -0.11736E-04 -0.23371E-07 2874 0.856E-04 0.129E-03
RMM: 79 -0.406083757964E+03 -0.10353E-04 -0.26544E-07 2913 0.858E-04 0.110E-03
RMM: 80 -0.406083760305E+03 -0.23408E-05 -0.80333E-08 2374 0.804E-04
1 F= -.44385025E+03 E0= -.44384948E+03 d E =-.230185E-02 mag= 0.0001