iterations/neb3_max1_image01_iter12_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422408995015E+04 0.42241E+04 -0.25388E+05 9008 0.103E+03
DAV: 2 -0.104216558977E+03 -0.43283E+04 -0.39311E+04 11008 0.248E+02
DAV: 3 -0.426116574706E+03 -0.32190E+03 -0.30140E+03 10304 0.656E+01
DAV: 4 -0.434569557438E+03 -0.84530E+01 -0.83445E+01 10904 0.107E+01
DAV: 5 -0.434854323978E+03 -0.28477E+00 -0.28403E+00 11200 0.189E+00 0.102E+02
RMM: 6 -0.381066430709E+03 0.53788E+02 -0.10842E+02 9705 0.142E+01 0.696E+01
RMM: 7 -0.687262114840E+03 -0.30620E+03 -0.31599E+02 10801 0.180E+01 0.131E+02
RMM: 8 -0.518073186227E+03 0.16919E+03 -0.12011E+02 10232 0.116E+01 0.925E+01
RMM: 9 -0.392514541024E+03 0.12556E+03 -0.63364E+01 10241 0.101E+01 0.440E+01
RMM: 10 -0.385837549252E+03 0.66770E+01 -0.35212E+01 10171 0.773E+00 0.367E+01
RMM: 11 -0.398824265641E+03 -0.12987E+02 -0.20156E+01 10284 0.562E+00 0.494E+01
RMM: 12 -0.376244189561E+03 0.22580E+02 -0.62189E+00 9772 0.350E+00 0.273E+01
RMM: 13 -0.373847707060E+03 0.23965E+01 -0.25503E+00 10056 0.210E+00 0.205E+01
RMM: 14 -0.375593288703E+03 -0.17456E+01 -0.15827E+00 10333 0.162E+00 0.133E+01
RMM: 15 -0.380897739348E+03 -0.53045E+01 -0.14116E+00 10511 0.152E+00 0.163E+01
RMM: 16 -0.385162147812E+03 -0.42644E+01 -0.12460E+00 10687 0.142E+00 0.192E+01
RMM: 17 -0.386467175645E+03 -0.13050E+01 -0.70583E-01 10299 0.108E+00 0.158E+01
RMM: 18 -0.388350525257E+03 -0.18833E+01 -0.87967E-01 10890 0.113E+00 0.103E+01
RMM: 19 -0.391814019165E+03 -0.34635E+01 -0.86893E-01 11129 0.112E+00 0.650E+00
RMM: 20 -0.395890205378E+03 -0.40762E+01 -0.10718E+00 11465 0.121E+00 0.642E+00
RMM: 21 -0.398620320599E+03 -0.27301E+01 -0.78212E-01 11262 0.987E-01 0.582E+00
RMM: 22 -0.401503937714E+03 -0.28836E+01 -0.73496E-01 11485 0.880E-01 0.550E+00
RMM: 23 -0.405464923088E+03 -0.39610E+01 -0.13720E+00 12369 0.108E+00 0.560E+00
RMM: 24 -0.409391597088E+03 -0.39267E+01 -0.20006E+00 13140 0.124E+00 0.627E+00
RMM: 25 -0.411893845851E+03 -0.25022E+01 -0.13682E+00 12684 0.983E-01 0.591E+00
RMM: 26 -0.412618492966E+03 -0.72465E+00 -0.43719E-02 10577 0.231E-01 0.566E+00
RMM: 27 -0.412666555218E+03 -0.48062E-01 -0.10461E-02 11420 0.945E-02 0.565E+00
RMM: 28 -0.412883281524E+03 -0.21673E+00 -0.10253E-02 10552 0.111E-01 0.565E+00
RMM: 29 -0.413774225499E+03 -0.89094E+00 -0.28425E-01 15328 0.463E-01 0.496E+00
RMM: 30 -0.414125034040E+03 -0.35081E+00 -0.12104E-01 14776 0.373E-01 0.459E+00
RMM: 31 -0.414140745533E+03 -0.15711E-01 -0.89197E-02 14638 0.354E-01 0.494E+00
RMM: 32 -0.414263138004E+03 -0.12239E+00 -0.64500E-02 13779 0.300E-01 0.396E+00
RMM: 33 -0.414958717674E+03 -0.69558E+00 -0.74285E-02 14068 0.314E-01 0.308E+00
RMM: 34 -0.415597765959E+03 -0.63905E+00 -0.48142E-02 13195 0.258E-01 0.241E+00
RMM: 35 -0.416107753626E+03 -0.50999E+00 -0.23995E-02 12074 0.190E-01 0.208E+00
RMM: 36 -0.416295042375E+03 -0.18729E+00 -0.12317E-02 11015 0.142E-01 0.169E+00
RMM: 37 -0.416396370187E+03 -0.10133E+00 -0.92850E-03 10792 0.116E-01 0.163E+00
RMM: 38 -0.416411176384E+03 -0.14806E-01 -0.66616E-03 10719 0.919E-02 0.144E+00
RMM: 39 -0.416480831218E+03 -0.69655E-01 -0.74478E-03 11236 0.898E-02 0.110E+00
RMM: 40 -0.416577728720E+03 -0.96898E-01 -0.67722E-03 11331 0.841E-02 0.873E-01
RMM: 41 -0.416627805417E+03 -0.50077E-01 -0.46262E-03 10999 0.698E-02 0.654E-01
RMM: 42 -0.416712233079E+03 -0.84428E-01 -0.65760E-03 11720 0.792E-02 0.497E-01
RMM: 43 -0.416791526645E+03 -0.79294E-01 -0.57913E-03 11697 0.748E-02 0.442E-01
RMM: 44 -0.416864557073E+03 -0.73030E-01 -0.69224E-03 11951 0.789E-02 0.473E-01
RMM: 45 -0.416948520916E+03 -0.83964E-01 -0.70780E-03 11872 0.740E-02 0.421E-01
RMM: 46 -0.417015687439E+03 -0.67167E-01 -0.37001E-03 11351 0.540E-02 0.342E-01
RMM: 47 -0.417066750723E+03 -0.51063E-01 -0.22775E-03 11179 0.424E-02 0.306E-01
RMM: 48 -0.417109481704E+03 -0.42731E-01 -0.20443E-03 11482 0.394E-02 0.269E-01
RMM: 49 -0.417144347053E+03 -0.34865E-01 -0.18742E-03 11597 0.377E-02 0.165E-01
RMM: 50 -0.417179632886E+03 -0.35286E-01 -0.13734E-03 11459 0.319E-02 0.131E-01
RMM: 51 -0.417182264089E+03 -0.26312E-02 -0.34662E-04 10664 0.191E-02 0.999E-02
RMM: 52 -0.417207401823E+03 -0.25138E-01 -0.44798E-04 11188 0.196E-02 0.672E-02
RMM: 53 -0.417232901308E+03 -0.25499E-01 -0.35892E-04 11138 0.165E-02 0.697E-02
RMM: 54 -0.417246518534E+03 -0.13617E-01 -0.14716E-04 9659 0.112E-02 0.607E-02
RMM: 55 -0.417252534331E+03 -0.60158E-02 -0.13475E-04 9617 0.960E-03 0.451E-02
RMM: 56 -0.417252315280E+03 0.21905E-03 -0.28627E-05 7570 0.620E-03 0.299E-02
RMM: 57 -0.417252816643E+03 -0.50136E-03 -0.14454E-05 6761 0.433E-03 0.142E-02
RMM: 58 -0.417253694658E+03 -0.87801E-03 -0.19761E-05 7154 0.390E-03 0.141E-02
RMM: 59 -0.417254096188E+03 -0.40153E-03 -0.91296E-06 6643 0.260E-03 0.989E-03
RMM: 60 -0.417254380450E+03 -0.28426E-03 -0.65467E-06 5668 0.192E-03 0.776E-03
RMM: 61 -0.417254471451E+03 -0.91001E-04 -0.25623E-06 5174 0.150E-03 0.758E-03
RMM: 62 -0.417254727580E+03 -0.25613E-03 -0.39782E-06 5095 0.153E-03 0.364E-03
RMM: 63 -0.417254848508E+03 -0.12093E-03 -0.13136E-06 3753 0.109E-03 0.364E-03
RMM: 64 -0.417254939429E+03 -0.90921E-04 -0.86291E-07 3404 0.101E-03 0.325E-03
RMM: 65 -0.417255022668E+03 -0.83239E-04 -0.72670E-07 3423 0.988E-04 0.206E-03
RMM: 66 -0.417255114734E+03 -0.92066E-04 -0.10067E-06 3804 0.105E-03 0.137E-03
RMM: 67 -0.417255181685E+03 -0.66951E-04 -0.42231E-07 3004 0.907E-04 0.132E-03
RMM: 68 -0.417255223031E+03 -0.41346E-04 -0.21762E-07 2603 0.851E-04 0.127E-03
RMM: 69 -0.417255249189E+03 -0.26157E-04 -0.18522E-07 2549 0.839E-04 0.827E-04
RMM: 70 -0.417255276061E+03 -0.26872E-04 -0.19135E-07 2591 0.867E-04 0.242E-03
RMM: 71 -0.417255276494E+03 -0.43330E-06 -0.17090E-08 2189 0.804E-04
1 F= -.45492679E+03 E0= -.45492760E+03 d E =0.243433E-02 mag= 0.0003