iterations/neb2_max2_image02_iter4_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422476205262E+04 0.42248E+04 -0.25382E+05 8992 0.103E+03
DAV: 2 -0.102811291492E+03 -0.43276E+04 -0.39250E+04 11008 0.248E+02
DAV: 3 -0.425510535152E+03 -0.32270E+03 -0.30214E+03 10232 0.657E+01
DAV: 4 -0.434176325855E+03 -0.86658E+01 -0.85298E+01 10848 0.108E+01
DAV: 5 -0.434478859530E+03 -0.30253E+00 -0.30165E+00 11128 0.196E+00 0.991E+01
RMM: 6 -0.386460832351E+03 0.48018E+02 -0.11034E+02 9686 0.146E+01 0.727E+01
RMM: 7 -0.803644025214E+03 -0.41718E+03 -0.43963E+02 11327 0.194E+01 0.158E+02
RMM: 8 -0.493744471589E+03 0.30990E+03 -0.10195E+02 9952 0.107E+01 0.909E+01
RMM: 9 -0.438577401620E+03 0.55167E+02 -0.66506E+01 10194 0.105E+01 0.665E+01
RMM: 10 -0.372995476441E+03 0.65582E+02 -0.34592E+01 10347 0.756E+00 0.238E+01
RMM: 11 -0.373598021912E+03 -0.60255E+00 -0.17088E+01 10398 0.461E+00 0.325E+01
RMM: 12 -0.372024049827E+03 0.15740E+01 -0.41869E+00 10015 0.276E+00 0.227E+01
RMM: 13 -0.374339847756E+03 -0.23158E+01 -0.28795E+00 10162 0.241E+00 0.145E+01
RMM: 14 -0.379042930478E+03 -0.47031E+01 -0.14659E+00 10187 0.163E+00 0.147E+01
RMM: 15 -0.381357495186E+03 -0.23146E+01 -0.85578E-01 10247 0.121E+00 0.126E+01
RMM: 16 -0.387619298896E+03 -0.62618E+01 -0.19585E+00 11402 0.164E+00 0.125E+01
RMM: 17 -0.391037300794E+03 -0.34180E+01 -0.12697E+00 10994 0.133E+00 0.845E+00
RMM: 18 -0.393627638036E+03 -0.25903E+01 -0.41643E-01 10340 0.780E-01 0.787E+00
RMM: 19 -0.395456910323E+03 -0.18293E+01 -0.29364E-01 10629 0.603E-01 0.739E+00
RMM: 20 -0.398698996209E+03 -0.32421E+01 -0.85503E-01 11926 0.939E-01 0.728E+00
RMM: 21 -0.401809638061E+03 -0.31106E+01 -0.88939E-01 12262 0.936E-01 0.573E+00
RMM: 22 -0.406783699943E+03 -0.49741E+01 -0.16870E+00 13110 0.120E+00 0.488E+00
RMM: 23 -0.410113024768E+03 -0.33293E+01 -0.12226E+00 12677 0.100E+00 0.462E+00
RMM: 24 -0.411154079906E+03 -0.10411E+01 -0.20452E-01 11125 0.436E-01 0.474E+00
RMM: 25 -0.410997634805E+03 0.15645E+00 -0.24553E-02 10303 0.184E-01 0.476E+00
RMM: 26 -0.410518578929E+03 0.47906E+00 -0.83780E-02 11241 0.335E-01 0.460E+00
RMM: 27 -0.410104858873E+03 0.41372E+00 -0.14602E-01 11955 0.489E-01 0.482E+00
RMM: 28 -0.409429320389E+03 0.67554E+00 -0.16965E-01 12261 0.531E-01 0.656E+00
RMM: 29 -0.410890003567E+03 -0.14607E+01 -0.31245E-01 12817 0.702E-01 0.505E+00
RMM: 30 -0.411657368633E+03 -0.76737E+00 -0.11238E+00 15009 0.102E+00 0.617E+00
RMM: 31 -0.412857411505E+03 -0.12000E+01 -0.22996E-01 13213 0.496E-01 0.560E+00
RMM: 32 -0.413365460471E+03 -0.50805E+00 -0.31074E-01 13327 0.580E-01 0.367E+00
RMM: 33 -0.413626721493E+03 -0.26126E+00 -0.91569E-03 10464 0.127E-01 0.350E+00
RMM: 34 -0.414133132464E+03 -0.50641E+00 -0.33394E-02 11331 0.249E-01 0.278E+00
RMM: 35 -0.414579653816E+03 -0.44652E+00 -0.32480E-02 11540 0.233E-01 0.248E+00
RMM: 36 -0.414623837960E+03 -0.44184E-01 -0.76100E-03 10338 0.112E-01 0.203E+00
RMM: 37 -0.414808197895E+03 -0.18436E+00 -0.10644E-02 10820 0.117E-01 0.191E+00
RMM: 38 -0.414916841767E+03 -0.10864E+00 -0.12198E-02 11203 0.125E-01 0.135E+00
RMM: 39 -0.415106054817E+03 -0.18921E+00 -0.46585E-03 10514 0.766E-02 0.103E+00
RMM: 40 -0.415305142615E+03 -0.19909E+00 -0.54650E-03 11053 0.754E-02 0.919E-01
RMM: 41 -0.415440107849E+03 -0.13497E+00 -0.80588E-03 11950 0.885E-02 0.878E-01
RMM: 42 -0.415485252449E+03 -0.45145E-01 -0.70044E-03 11891 0.844E-02 0.635E-01
RMM: 43 -0.415537371257E+03 -0.52119E-01 -0.86598E-03 12197 0.891E-02 0.440E-01
RMM: 44 -0.415612059642E+03 -0.74688E-01 -0.72003E-03 11893 0.807E-02 0.380E-01
RMM: 45 -0.415690186267E+03 -0.78127E-01 -0.94982E-03 12320 0.842E-02 0.326E-01
RMM: 46 -0.415729553413E+03 -0.39367E-01 -0.37017E-03 11345 0.561E-02 0.283E-01
RMM: 47 -0.415778707866E+03 -0.49154E-01 -0.26929E-03 11295 0.452E-02 0.337E-01
RMM: 48 -0.415816554568E+03 -0.37847E-01 -0.12555E-03 10976 0.320E-02 0.176E-01
RMM: 49 -0.415874166551E+03 -0.57612E-01 -0.20792E-03 11914 0.375E-02 0.170E-01
RMM: 50 -0.415913711818E+03 -0.39545E-01 -0.68061E-04 11061 0.233E-02 0.146E-01
RMM: 51 -0.415953369246E+03 -0.39657E-01 -0.79835E-04 11581 0.233E-02 0.104E-01
RMM: 52 -0.415966661513E+03 -0.13292E-01 -0.19864E-04 10594 0.138E-02 0.589E-02
RMM: 53 -0.415971918641E+03 -0.52571E-02 -0.91414E-05 9148 0.888E-03 0.559E-02
RMM: 54 -0.415975067983E+03 -0.31493E-02 -0.63756E-05 8740 0.728E-03 0.473E-02
RMM: 55 -0.415977119821E+03 -0.20518E-02 -0.63578E-05 8507 0.696E-03 0.272E-02
RMM: 56 -0.415976574285E+03 0.54554E-03 -0.13390E-05 6624 0.400E-03 0.201E-02
RMM: 57 -0.415977025769E+03 -0.45148E-03 -0.86347E-06 6645 0.290E-03 0.181E-02
RMM: 58 -0.415977402494E+03 -0.37673E-03 -0.69801E-06 6588 0.229E-03 0.157E-02
RMM: 59 -0.415977723122E+03 -0.32063E-03 -0.71815E-06 6055 0.206E-03 0.762E-03
RMM: 60 -0.415977854698E+03 -0.13158E-03 -0.41118E-06 5403 0.169E-03 0.393E-03
RMM: 61 -0.415977933857E+03 -0.79159E-04 -0.14200E-06 3950 0.117E-03 0.268E-03
RMM: 62 -0.415978017016E+03 -0.83159E-04 -0.10976E-06 3901 0.111E-03 0.264E-03
RMM: 63 -0.415978105990E+03 -0.88974E-04 -0.10267E-06 4202 0.108E-03 0.928E-03
RMM: 64 -0.415978141250E+03 -0.35260E-04 -0.11928E-07 2554 0.812E-04 0.641E-03
RMM: 65 -0.415978186309E+03 -0.45059E-04 -0.32645E-07 2974 0.893E-04 0.520E-03
RMM: 66 -0.415978207949E+03 -0.21641E-04 -0.35918E-07 2993 0.907E-04 0.499E-03
RMM: 67 -0.415978230453E+03 -0.22504E-04 -0.35628E-07 3060 0.920E-04 0.726E-03
RMM: 68 -0.415978239694E+03 -0.92409E-05 -0.11463E-07 2470 0.827E-04
1 F= -.45370856E+03 E0= -.45370810E+03 d E =-.136575E-02 mag= -0.0007