iterations/neb1_max1_image01_iter1_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422732954011E+04 0.42273E+04 -0.25391E+05 9008 0.103E+03
DAV: 2 -0.104397438522E+03 -0.43317E+04 -0.39344E+04 11024 0.248E+02
DAV: 3 -0.426139411113E+03 -0.32174E+03 -0.30130E+03 10336 0.656E+01
DAV: 4 -0.434514709884E+03 -0.83753E+01 -0.82743E+01 10832 0.106E+01
DAV: 5 -0.434803686448E+03 -0.28898E+00 -0.28825E+00 11272 0.192E+00 0.103E+02
RMM: 6 -0.378882108814E+03 0.55922E+02 -0.11014E+02 9707 0.142E+01 0.695E+01
RMM: 7 -0.579595021328E+03 -0.20071E+03 -0.23029E+02 10352 0.165E+01 0.107E+02
RMM: 8 -0.523240465095E+03 0.56355E+02 -0.11401E+02 10306 0.117E+01 0.901E+01
RMM: 9 -0.394279663782E+03 0.12896E+03 -0.46140E+01 10179 0.829E+00 0.408E+01
RMM: 10 -0.422369879878E+03 -0.28090E+02 -0.45325E+01 10446 0.840E+00 0.566E+01
RMM: 11 -0.379394123978E+03 0.42976E+02 -0.10918E+01 9670 0.453E+00 0.268E+01
RMM: 12 -0.375797034019E+03 0.35971E+01 -0.60579E+00 10221 0.298E+00 0.211E+01
RMM: 13 -0.378558184838E+03 -0.27612E+01 -0.27239E+00 10305 0.210E+00 0.156E+01
RMM: 14 -0.380504277053E+03 -0.19461E+01 -0.12124E+00 10202 0.144E+00 0.109E+01
RMM: 15 -0.384313966305E+03 -0.38097E+01 -0.87527E-01 10303 0.124E+00 0.111E+01
RMM: 16 -0.387295464500E+03 -0.29815E+01 -0.10826E+00 10758 0.132E+00 0.969E+00
RMM: 17 -0.391095621713E+03 -0.38002E+01 -0.10189E+00 10888 0.118E+00 0.694E+00
RMM: 18 -0.394004989246E+03 -0.29094E+01 -0.56866E-01 10750 0.871E-01 0.598E+00
RMM: 19 -0.397739494550E+03 -0.37345E+01 -0.90066E-01 11605 0.980E-01 0.606E+00
RMM: 20 -0.399330897248E+03 -0.15914E+01 -0.33887E-01 10931 0.629E-01 0.539E+00
RMM: 21 -0.401876519209E+03 -0.25456E+01 -0.69130E-01 11824 0.832E-01 0.492E+00
RMM: 22 -0.407754065639E+03 -0.58775E+01 -0.48395E+00 14475 0.184E+00 0.652E+00
RMM: 23 -0.409293574876E+03 -0.15395E+01 -0.14660E+00 13347 0.103E+00 0.647E+00
RMM: 24 -0.410501833226E+03 -0.12083E+01 -0.18769E-01 11045 0.439E-01 0.591E+00
RMM: 25 -0.411379940440E+03 -0.87811E+00 -0.41223E-02 10375 0.215E-01 0.576E+00
RMM: 26 -0.412169310760E+03 -0.78937E+00 -0.22981E-01 12449 0.447E-01 0.557E+00
RMM: 27 -0.412576604015E+03 -0.40729E+00 -0.18355E-01 12403 0.498E-01 0.456E+00
RMM: 28 -0.413359224302E+03 -0.78262E+00 -0.55868E-02 10666 0.308E-01 0.395E+00
RMM: 29 -0.414230920712E+03 -0.87170E+00 -0.50359E-02 10742 0.281E-01 0.386E+00
RMM: 30 -0.414964627785E+03 -0.73371E+00 -0.76692E-02 11181 0.321E-01 0.258E+00
RMM: 31 -0.415545720253E+03 -0.58109E+00 -0.45469E-02 10804 0.242E-01 0.172E+00
RMM: 32 -0.415944676166E+03 -0.39896E+00 -0.95808E-03 10139 0.116E-01 0.159E+00
RMM: 33 -0.416158112808E+03 -0.21344E+00 -0.82932E-03 10523 0.105E-01 0.147E+00
RMM: 34 -0.416261398455E+03 -0.10329E+00 -0.75198E-03 10720 0.966E-02 0.119E+00
RMM: 35 -0.416351448445E+03 -0.90050E-01 -0.54481E-03 10723 0.838E-02 0.918E-01
RMM: 36 -0.416456289660E+03 -0.10484E+00 -0.47215E-03 10904 0.765E-02 0.686E-01
RMM: 37 -0.416543141126E+03 -0.86851E-01 -0.37074E-03 10881 0.695E-02 0.557E-01
RMM: 38 -0.416637814325E+03 -0.94673E-01 -0.44076E-03 11319 0.761E-02 0.558E-01
RMM: 39 -0.416663418775E+03 -0.25604E-01 -0.38239E-03 11299 0.673E-02 0.567E-01
RMM: 40 -0.416685581948E+03 -0.22163E-01 -0.57582E-03 11732 0.742E-02 0.414E-01
RMM: 41 -0.416782282721E+03 -0.96701E-01 -0.86370E-03 12354 0.801E-02 0.290E-01
RMM: 42 -0.416845525350E+03 -0.63243E-01 -0.49760E-03 11822 0.598E-02 0.298E-01
RMM: 43 -0.416907096568E+03 -0.61571E-01 -0.41878E-03 11664 0.521E-02 0.245E-01
RMM: 44 -0.416984822478E+03 -0.77726E-01 -0.50612E-03 12118 0.538E-02 0.178E-01
RMM: 45 -0.417051884198E+03 -0.67062E-01 -0.20932E-03 11585 0.361E-02 0.143E-01
RMM: 46 -0.417096017197E+03 -0.44133E-01 -0.73741E-04 10971 0.229E-02 0.127E-01
RMM: 47 -0.417141004588E+03 -0.44987E-01 -0.70154E-04 11284 0.217E-02 0.784E-02
RMM: 48 -0.417159492682E+03 -0.18488E-01 -0.22556E-04 10234 0.138E-02 0.486E-02
RMM: 49 -0.417166370825E+03 -0.68781E-02 -0.10733E-04 9169 0.966E-03 0.330E-02
RMM: 50 -0.417169424180E+03 -0.30534E-02 -0.57635E-05 8366 0.637E-03 0.289E-02
RMM: 51 -0.417170726925E+03 -0.13027E-02 -0.33102E-05 7701 0.514E-03 0.165E-02
RMM: 52 -0.417171652251E+03 -0.92533E-03 -0.22376E-05 7385 0.362E-03 0.141E-02
RMM: 53 -0.417171877729E+03 -0.22548E-03 -0.91522E-06 6355 0.236E-03 0.925E-03
RMM: 54 -0.417171897546E+03 -0.19817E-04 -0.35454E-06 5029 0.161E-03 0.605E-03
RMM: 55 -0.417172015231E+03 -0.11768E-03 -0.18157E-06 4131 0.127E-03 0.548E-03
RMM: 56 -0.417172124903E+03 -0.10967E-03 -0.17164E-06 4425 0.124E-03 0.437E-03
RMM: 57 -0.417172227785E+03 -0.10288E-03 -0.96574E-07 3619 0.102E-03 0.351E-03
RMM: 58 -0.417172371861E+03 -0.14408E-03 -0.82550E-07 3711 0.101E-03 0.256E-03
RMM: 59 -0.417172533769E+03 -0.16191E-03 -0.59604E-07 3392 0.955E-04 0.201E-03
RMM: 60 -0.417172700084E+03 -0.16632E-03 -0.89197E-07 3620 0.100E-03 0.208E-03
RMM: 61 -0.417172798849E+03 -0.98764E-04 -0.58405E-07 3315 0.955E-04 0.303E-03
RMM: 62 -0.417172859396E+03 -0.60547E-04 -0.44487E-07 2994 0.903E-04 0.135E-03
RMM: 63 -0.417172904242E+03 -0.44846E-04 -0.43514E-07 3012 0.914E-04 0.270E-03
RMM: 64 -0.417172917523E+03 -0.13281E-04 -0.10149E-07 2370 0.809E-04 0.185E-03
RMM: 65 -0.417172932098E+03 -0.14576E-04 -0.13303E-07 2456 0.832E-04 0.114E-03
RMM: 66 -0.417172941704E+03 -0.96060E-05 -0.17965E-07 2507 0.834E-04
1 F= -.45484198E+03 E0= -.45484271E+03 d E =0.220229E-02 mag= -0.0003