iterations/neb3_max1_image05_iter12_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422014410300E+04 0.42201E+04 -0.25385E+05 9008 0.103E+03
DAV: 2 -0.104902587827E+03 -0.43250E+04 -0.39298E+04 11024 0.248E+02
DAV: 3 -0.426285323923E+03 -0.32138E+03 -0.30088E+03 10328 0.655E+01
DAV: 4 -0.434792396612E+03 -0.85071E+01 -0.83639E+01 10800 0.107E+01
DAV: 5 -0.435086631313E+03 -0.29423E+00 -0.29352E+00 11232 0.193E+00 0.100E+02
RMM: 6 -0.389910693014E+03 0.45176E+02 -0.10636E+02 9685 0.142E+01 0.755E+01
RMM: 7 -0.845496646678E+03 -0.45559E+03 -0.47290E+02 11491 0.196E+01 0.152E+02
RMM: 8 -0.494645230282E+03 0.35085E+03 -0.11358E+02 9980 0.113E+01 0.900E+01
RMM: 9 -0.413154194339E+03 0.81491E+02 -0.73308E+01 10216 0.111E+01 0.578E+01
RMM: 10 -0.379079398647E+03 0.34075E+02 -0.34546E+01 10196 0.770E+00 0.352E+01
RMM: 11 -0.381161581423E+03 -0.20822E+01 -0.18218E+01 10298 0.509E+00 0.376E+01
RMM: 12 -0.375313468459E+03 0.58481E+01 -0.56538E+00 10011 0.330E+00 0.261E+01
RMM: 13 -0.372592801449E+03 0.27207E+01 -0.28104E+00 10153 0.222E+00 0.188E+01
RMM: 14 -0.373775804653E+03 -0.11830E+01 -0.13711E+00 10269 0.155E+00 0.126E+01
RMM: 15 -0.380669861321E+03 -0.68941E+01 -0.15326E+00 10499 0.164E+00 0.158E+01
RMM: 16 -0.383872041640E+03 -0.32022E+01 -0.18680E+00 10731 0.177E+00 0.103E+01
RMM: 17 -0.389593118546E+03 -0.57211E+01 -0.18942E+00 11119 0.165E+00 0.883E+00
RMM: 18 -0.392049592383E+03 -0.24565E+01 -0.59313E-01 10256 0.995E-01 0.622E+00
RMM: 19 -0.394255205923E+03 -0.22056E+01 -0.40471E-01 10512 0.798E-01 0.632E+00
RMM: 20 -0.397077983199E+03 -0.28228E+01 -0.69034E-01 11366 0.952E-01 0.627E+00
RMM: 21 -0.399328655748E+03 -0.22507E+01 -0.51359E-01 11253 0.753E-01 0.600E+00
RMM: 22 -0.403070175675E+03 -0.37415E+01 -0.11206E+00 12303 0.103E+00 0.643E+00
RMM: 23 -0.407231457280E+03 -0.41613E+01 -0.16380E+00 13012 0.119E+00 0.700E+00
RMM: 24 -0.409707692500E+03 -0.24762E+01 -0.97557E-01 12438 0.893E-01 0.577E+00
RMM: 25 -0.410351096582E+03 -0.64340E+00 -0.43443E-02 10570 0.225E-01 0.558E+00
RMM: 26 -0.409718004038E+03 0.63309E+00 -0.49291E-02 10466 0.262E-01 0.505E+00
RMM: 27 -0.408912681596E+03 0.80532E+00 -0.16028E-01 12019 0.445E-01 0.477E+00
RMM: 28 -0.408042352820E+03 0.87033E+00 -0.17984E-01 12408 0.508E-01 0.550E+00
RMM: 29 -0.407023363347E+03 0.10190E+01 -0.14349E-01 12055 0.475E-01 0.708E+00
RMM: 30 -0.409252934988E+03 -0.22296E+01 -0.28897E-01 12485 0.642E-01 0.556E+00
RMM: 31 -0.412967187146E+03 -0.37143E+01 -0.19895E+00 15293 0.124E+00 0.573E+00
RMM: 32 -0.413793376144E+03 -0.82619E+00 -0.31788E-01 13373 0.558E-01 0.597E+00
RMM: 33 -0.414516695817E+03 -0.72332E+00 -0.16099E-01 12203 0.423E-01 0.449E+00
RMM: 34 -0.415087714676E+03 -0.57102E+00 -0.10881E-01 11519 0.358E-01 0.316E+00
RMM: 35 -0.415327614132E+03 -0.23990E+00 -0.24557E-02 10550 0.187E-01 0.300E+00
RMM: 36 -0.415734512259E+03 -0.40690E+00 -0.29749E-02 10847 0.232E-01 0.253E+00
RMM: 37 -0.415987935288E+03 -0.25342E+00 -0.27968E-02 10897 0.213E-01 0.187E+00
RMM: 38 -0.416116637316E+03 -0.12870E+00 -0.12621E-02 10482 0.139E-01 0.181E+00
RMM: 39 -0.416147241043E+03 -0.30604E-01 -0.58360E-03 10266 0.905E-02 0.171E+00
RMM: 40 -0.416242183485E+03 -0.94942E-01 -0.39347E-03 10476 0.745E-02 0.142E+00
RMM: 41 -0.416413194136E+03 -0.17101E+00 -0.52509E-03 11084 0.813E-02 0.113E+00
RMM: 42 -0.416618271533E+03 -0.20508E+00 -0.74509E-03 11722 0.911E-02 0.802E-01
RMM: 43 -0.416770728104E+03 -0.15246E+00 -0.57237E-03 11493 0.790E-02 0.629E-01
RMM: 44 -0.416887363195E+03 -0.11664E+00 -0.12420E-02 12665 0.108E-01 0.526E-01
RMM: 45 -0.416950742380E+03 -0.63379E-01 -0.85353E-03 12132 0.869E-02 0.587E-01
RMM: 46 -0.417004718463E+03 -0.53976E-01 -0.86139E-03 11970 0.840E-02 0.436E-01
RMM: 47 -0.417068271261E+03 -0.63553E-01 -0.28465E-03 11054 0.514E-02 0.345E-01
RMM: 48 -0.417089362424E+03 -0.21091E-01 -0.12493E-03 10729 0.348E-02 0.252E-01
RMM: 49 -0.417136612478E+03 -0.47250E-01 -0.51149E-03 12545 0.674E-02 0.244E-01
RMM: 50 -0.417174876374E+03 -0.38264E-01 -0.21407E-03 11546 0.422E-02 0.188E-01
RMM: 51 -0.417208755920E+03 -0.33880E-01 -0.89824E-04 11018 0.287E-02 0.119E-01
RMM: 52 -0.417239495847E+03 -0.30740E-01 -0.47255E-04 10920 0.199E-02 0.106E-01
RMM: 53 -0.417270843156E+03 -0.31347E-01 -0.39192E-04 11120 0.173E-02 0.969E-02
RMM: 54 -0.417293053196E+03 -0.22210E-01 -0.19540E-04 10162 0.129E-02 0.897E-02
RMM: 55 -0.417303480468E+03 -0.10427E-01 -0.12847E-04 10041 0.109E-02 0.813E-02
RMM: 56 -0.417307357648E+03 -0.38772E-02 -0.11543E-04 10214 0.111E-02 0.451E-02
RMM: 57 -0.417309875478E+03 -0.25178E-02 -0.55324E-05 8421 0.723E-03 0.464E-02
RMM: 58 -0.417310859562E+03 -0.98408E-03 -0.24795E-05 7452 0.512E-03 0.302E-02
RMM: 59 -0.417311932655E+03 -0.10731E-02 -0.30250E-05 7579 0.470E-03 0.128E-02
RMM: 60 -0.417312511916E+03 -0.57926E-03 -0.13479E-05 6923 0.319E-03 0.884E-03
RMM: 61 -0.417312966374E+03 -0.45446E-03 -0.95584E-06 6506 0.243E-03 0.717E-03
RMM: 62 -0.417313276860E+03 -0.31049E-03 -0.65009E-06 5293 0.186E-03 0.650E-03
RMM: 63 -0.417313527269E+03 -0.25041E-03 -0.48849E-06 5187 0.168E-03 0.395E-03
RMM: 64 -0.417313652965E+03 -0.12570E-03 -0.29374E-06 4740 0.138E-03 0.334E-03
RMM: 65 -0.417313716890E+03 -0.63925E-04 -0.14667E-06 3794 0.109E-03 0.218E-03
RMM: 66 -0.417313761590E+03 -0.44700E-04 -0.10207E-06 3620 0.101E-03 0.177E-03
RMM: 67 -0.417313783785E+03 -0.22196E-04 -0.52202E-07 3083 0.906E-04 0.158E-03
RMM: 68 -0.417313801403E+03 -0.17617E-04 -0.45670E-07 3166 0.899E-04 0.100E-03
RMM: 69 -0.417313809849E+03 -0.84463E-05 -0.20741E-07 2677 0.841E-04
1 F= -.45498920E+03 E0= -.45499003E+03 d E =0.248771E-02 mag= 0.0003