iterations/neb0_image05_iter27_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.423482205524E+04 0.42348E+04 -0.25396E+05 9000 0.103E+03
DAV: 2 -0.104457105795E+03 -0.43393E+04 -0.39366E+04 11016 0.248E+02
DAV: 3 -0.426655504590E+03 -0.32220E+03 -0.30176E+03 10224 0.657E+01
DAV: 4 -0.435190678209E+03 -0.85352E+01 -0.84297E+01 10952 0.107E+01
DAV: 5 -0.435479352685E+03 -0.28867E+00 -0.28764E+00 11024 0.192E+00 0.997E+01
RMM: 6 -0.379206213666E+03 0.56273E+02 -0.11388E+02 9720 0.146E+01 0.677E+01
RMM: 7 -0.493044983311E+03 -0.11384E+03 -0.15395E+02 9864 0.148E+01 0.889E+01
RMM: 8 -0.384212025906E+03 0.10883E+03 -0.57860E+01 9824 0.105E+01 0.324E+01
RMM: 9 -0.544079478157E+03 -0.15987E+03 -0.50869E+01 10436 0.741E+00 0.952E+01
RMM: 10 -0.380935686332E+03 0.16314E+03 -0.30471E+01 10360 0.626E+00 0.324E+01
RMM: 11 -0.373651926384E+03 0.72838E+01 -0.78170E+00 10002 0.366E+00 0.151E+01
RMM: 12 -0.380246827066E+03 -0.65949E+01 -0.36143E+00 10291 0.237E+00 0.153E+01
RMM: 13 -0.381846732905E+03 -0.15999E+01 -0.12254E+00 10267 0.140E+00 0.118E+01
RMM: 14 -0.383360862890E+03 -0.15141E+01 -0.48010E-01 10102 0.947E-01 0.854E+00
RMM: 15 -0.388211520219E+03 -0.48507E+01 -0.10685E+00 11087 0.133E+00 0.814E+00
RMM: 16 -0.392073187831E+03 -0.38617E+01 -0.12229E+00 11361 0.134E+00 0.688E+00
RMM: 17 -0.398253798019E+03 -0.61806E+01 -0.21672E+00 12057 0.161E+00 0.722E+00
RMM: 18 -0.403558552882E+03 -0.53048E+01 -0.26841E+00 12369 0.165E+00 0.694E+00
RMM: 19 -0.406693089361E+03 -0.31345E+01 -0.12093E+00 11518 0.109E+00 0.609E+00
RMM: 20 -0.409552142627E+03 -0.28591E+01 -0.98107E-01 11506 0.920E-01 0.505E+00
RMM: 21 -0.412471990998E+03 -0.29198E+01 -0.15718E+00 12426 0.111E+00 0.496E+00
RMM: 22 -0.413875818958E+03 -0.14038E+01 -0.49324E-01 11251 0.677E-01 0.532E+00
RMM: 23 -0.414565766810E+03 -0.68995E+00 -0.49493E-02 10405 0.229E-01 0.528E+00
RMM: 24 -0.414593963634E+03 -0.28197E-01 -0.95536E-03 10889 0.929E-02 0.525E+00
RMM: 25 -0.414456549380E+03 0.13741E+00 -0.78745E-03 10346 0.113E-01 0.511E+00
RMM: 26 -0.414339445376E+03 0.11710E+00 -0.18574E-02 11073 0.173E-01 0.484E+00
RMM: 27 -0.414153056348E+03 0.18639E+00 -0.60131E-02 13226 0.309E-01 0.450E+00
RMM: 28 -0.414028147064E+03 0.12491E+00 -0.84851E-02 14200 0.353E-01 0.538E+00
RMM: 29 -0.413750061975E+03 0.27809E+00 -0.40989E-02 12541 0.252E-01 0.640E+00
RMM: 30 -0.414420577129E+03 -0.67052E+00 -0.13124E-01 14544 0.460E-01 0.459E+00
RMM: 31 -0.415095936894E+03 -0.67536E+00 -0.25349E-01 15684 0.581E-01 0.565E+00
RMM: 32 -0.415663901541E+03 -0.56796E+00 -0.29235E-01 15663 0.646E-01 0.306E+00
RMM: 33 -0.416100522206E+03 -0.43662E+00 -0.23422E-02 11545 0.198E-01 0.238E+00
RMM: 34 -0.416154530007E+03 -0.54008E-01 -0.28657E-03 10244 0.731E-02 0.228E+00
RMM: 35 -0.416461697935E+03 -0.30717E+00 -0.33259E-02 13965 0.240E-01 0.196E+00
RMM: 36 -0.416829106930E+03 -0.36741E+00 -0.49730E-02 14506 0.272E-01 0.141E+00
RMM: 37 -0.417076986327E+03 -0.24788E+00 -0.33073E-02 14003 0.230E-01 0.149E+00
RMM: 38 -0.417060150036E+03 0.16836E-01 -0.12898E-02 12267 0.141E-01 0.150E+00
RMM: 39 -0.417119654869E+03 -0.59505E-01 -0.38628E-03 10859 0.788E-02 0.121E+00
RMM: 40 -0.417272539571E+03 -0.15288E+00 -0.60321E-03 11280 0.998E-02 0.757E-01
RMM: 41 -0.417367878931E+03 -0.95339E-01 -0.13937E-02 12424 0.134E-01 0.718E-01
RMM: 42 -0.417337009928E+03 0.30869E-01 -0.53359E-03 11376 0.787E-02 0.671E-01
RMM: 43 -0.417375869057E+03 -0.38859E-01 -0.21706E-03 10843 0.552E-02 0.487E-01
RMM: 44 -0.417457187701E+03 -0.81319E-01 -0.61945E-03 12012 0.780E-02 0.432E-01
RMM: 45 -0.417542988628E+03 -0.85801E-01 -0.96759E-03 12421 0.772E-02 0.278E-01
RMM: 46 -0.417685907609E+03 -0.14292E+00 -0.41903E-03 11602 0.513E-02 0.245E-01
RMM: 47 -0.417787940177E+03 -0.10203E+00 -0.11846E-03 10914 0.326E-02 0.206E-01
RMM: 48 -0.417836627987E+03 -0.48688E-01 -0.53318E-04 10673 0.227E-02 0.149E-01
RMM: 49 -0.417847924853E+03 -0.11297E-01 -0.20572E-04 10452 0.148E-02 0.961E-02
RMM: 50 -0.417852394906E+03 -0.44701E-02 -0.14474E-04 10211 0.112E-02 0.596E-02
RMM: 51 -0.417852701342E+03 -0.30644E-03 -0.12137E-04 10483 0.116E-02 0.470E-02
RMM: 52 -0.417853906148E+03 -0.12048E-02 -0.36954E-05 8043 0.618E-03 0.444E-02
RMM: 53 -0.417854650460E+03 -0.74431E-03 -0.20585E-05 7259 0.479E-03 0.178E-02
RMM: 54 -0.417854999154E+03 -0.34869E-03 -0.11422E-05 6758 0.367E-03 0.185E-02
RMM: 55 -0.417855120082E+03 -0.12093E-03 -0.44335E-06 6432 0.219E-03 0.168E-02
RMM: 56 -0.417855330055E+03 -0.20997E-03 -0.27152E-06 6230 0.172E-03 0.123E-02
RMM: 57 -0.417855505829E+03 -0.17577E-03 -0.28545E-06 6386 0.170E-03 0.978E-03
RMM: 58 -0.417855685498E+03 -0.17967E-03 -0.17011E-06 4368 0.123E-03 0.602E-03
RMM: 59 -0.417855847277E+03 -0.16178E-03 -0.13779E-06 4267 0.120E-03 0.600E-03
RMM: 60 -0.417855937205E+03 -0.89927E-04 -0.38310E-06 6299 0.177E-03 0.276E-02
RMM: 61 -0.417855957164E+03 -0.19959E-04 -0.15100E-06 4554 0.126E-03 0.432E-02
RMM: 62 -0.417855993495E+03 -0.36331E-04 -0.21040E-06 5651 0.143E-03 0.597E-02
RMM: 63 -0.417856023952E+03 -0.30457E-04 -0.90499E-07 3864 0.110E-03 0.711E-02
RMM: 64 -0.417856025817E+03 -0.18654E-05 -0.12894E-07 2592 0.908E-04
1 F= -.45569542E+03 E0= -.45569536E+03 d E =-.172633E-03 mag= 0.0006