iterations/neb0_image01_iter50_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421548457680E+04 0.42155E+04 -0.25380E+05 9000 0.103E+03
DAV: 2 -0.106065395272E+03 -0.43215E+04 -0.39262E+04 11024 0.248E+02
DAV: 3 -0.427435032245E+03 -0.32137E+03 -0.30026E+03 10184 0.654E+01
DAV: 4 -0.435938932457E+03 -0.85039E+01 -0.84048E+01 10792 0.107E+01
DAV: 5 -0.436229120808E+03 -0.29019E+00 -0.28939E+00 11168 0.192E+00 0.992E+01
RMM: 6 -0.388930196634E+03 0.47299E+02 -0.11061E+02 9712 0.144E+01 0.718E+01
RMM: 7 -0.778660475941E+03 -0.38973E+03 -0.41380E+02 11254 0.189E+01 0.146E+02
RMM: 8 -0.497148301047E+03 0.28151E+03 -0.11171E+02 10062 0.111E+01 0.908E+01
RMM: 9 -0.414381894328E+03 0.82766E+02 -0.66445E+01 10190 0.105E+01 0.555E+01
RMM: 10 -0.397274195207E+03 0.17108E+02 -0.41144E+01 10339 0.840E+00 0.433E+01
RMM: 11 -0.392939771079E+03 0.43344E+01 -0.25031E+01 10340 0.592E+00 0.471E+01
RMM: 12 -0.376527445064E+03 0.16412E+02 -0.77995E+00 9965 0.376E+00 0.301E+01
RMM: 13 -0.375889074689E+03 0.63837E+00 -0.33111E+00 10160 0.245E+00 0.246E+01
RMM: 14 -0.374435029621E+03 0.14540E+01 -0.13534E+00 10136 0.153E+00 0.166E+01
RMM: 15 -0.376983408722E+03 -0.25484E+01 -0.12888E+00 10463 0.144E+00 0.120E+01
RMM: 16 -0.382014685615E+03 -0.50313E+01 -0.10895E+00 10433 0.135E+00 0.131E+01
RMM: 17 -0.387409498020E+03 -0.53948E+01 -0.19584E+00 11273 0.169E+00 0.101E+01
RMM: 18 -0.391046882006E+03 -0.36374E+01 -0.95977E-01 10668 0.118E+00 0.690E+00
RMM: 19 -0.394147859703E+03 -0.31010E+01 -0.48804E-01 10460 0.845E-01 0.655E+00
RMM: 20 -0.397775293209E+03 -0.36274E+01 -0.98269E-01 11481 0.109E+00 0.722E+00
RMM: 21 -0.400815025802E+03 -0.30397E+01 -0.11174E+00 11969 0.111E+00 0.695E+00
RMM: 22 -0.403540635608E+03 -0.27256E+01 -0.87288E-01 11795 0.940E-01 0.594E+00
RMM: 23 -0.407726558575E+03 -0.41859E+01 -0.19854E+00 12957 0.127E+00 0.619E+00
RMM: 24 -0.409720103270E+03 -0.19935E+01 -0.62829E-01 11794 0.719E-01 0.646E+00
RMM: 25 -0.410017967219E+03 -0.29786E+00 -0.73651E-02 10564 0.266E-01 0.603E+00
RMM: 26 -0.410445430106E+03 -0.42746E+00 -0.41765E-02 10740 0.182E-01 0.593E+00
RMM: 27 -0.410805155721E+03 -0.35973E+00 -0.20377E-02 10616 0.128E-01 0.633E+00
RMM: 28 -0.410153479206E+03 0.65168E+00 -0.53442E-02 11467 0.255E-01 0.677E+00
RMM: 29 -0.409511008947E+03 0.64247E+00 -0.16212E-01 13903 0.460E-01 0.875E+00
RMM: 30 -0.408175865892E+03 0.13351E+01 -0.96086E-02 12966 0.387E-01 0.862E+00
RMM: 31 -0.408614941220E+03 -0.43908E+00 -0.47145E-03 10193 0.947E-02 0.884E+00
RMM: 32 -0.410183228530E+03 -0.15683E+01 -0.31250E-01 15769 0.615E-01 0.946E+00
RMM: 33 -0.410381550096E+03 -0.19832E+00 -0.67032E-02 14116 0.299E-01 0.843E+00
RMM: 34 -0.411440249012E+03 -0.10587E+01 -0.10327E+00 17490 0.113E+00 0.675E+00
RMM: 35 -0.413386176350E+03 -0.19459E+01 -0.24889E-01 15806 0.493E-01 0.516E+00
RMM: 36 -0.414554752966E+03 -0.11686E+01 -0.27818E-01 16169 0.637E-01 0.417E+00
RMM: 37 -0.415564108707E+03 -0.10094E+01 -0.13307E-01 15338 0.378E-01 0.351E+00
RMM: 38 -0.416011919085E+03 -0.44781E+00 -0.10930E-01 14984 0.372E-01 0.325E+00
RMM: 39 -0.416286321141E+03 -0.27440E+00 -0.31511E-02 12511 0.192E-01 0.291E+00
RMM: 40 -0.416500861423E+03 -0.21454E+00 -0.39243E-02 12817 0.219E-01 0.272E+00
RMM: 41 -0.416585863285E+03 -0.85002E-01 -0.15882E-02 11645 0.148E-01 0.235E+00
RMM: 42 -0.416681116330E+03 -0.95253E-01 -0.15530E-02 11709 0.145E-01 0.190E+00
RMM: 43 -0.416816040438E+03 -0.13492E+00 -0.52088E-03 10649 0.896E-02 0.164E+00
RMM: 44 -0.416902085840E+03 -0.86045E-01 -0.49884E-03 10614 0.849E-02 0.144E+00
RMM: 45 -0.416968170704E+03 -0.66085E-01 -0.49239E-03 10882 0.787E-02 0.101E+00
RMM: 46 -0.417138482817E+03 -0.17031E+00 -0.50290E-03 11079 0.792E-02 0.812E-01
RMM: 47 -0.417237566858E+03 -0.99084E-01 -0.53161E-03 11367 0.779E-02 0.681E-01
RMM: 48 -0.417361438813E+03 -0.12387E+00 -0.67658E-03 11808 0.865E-02 0.470E-01
RMM: 49 -0.417382017868E+03 -0.20579E-01 -0.79306E-03 12087 0.866E-02 0.385E-01
RMM: 50 -0.417392820534E+03 -0.10803E-01 -0.42932E-03 11362 0.635E-02 0.422E-01
RMM: 51 -0.417515556388E+03 -0.12274E+00 -0.76533E-03 11946 0.882E-02 0.287E-01
RMM: 52 -0.417580495539E+03 -0.64939E-01 -0.44767E-03 11352 0.597E-02 0.218E-01
RMM: 53 -0.417635865971E+03 -0.55370E-01 -0.29104E-03 11351 0.460E-02 0.197E-01
RMM: 54 -0.417671250309E+03 -0.35384E-01 -0.12255E-03 11001 0.306E-02 0.156E-01
RMM: 55 -0.417709105600E+03 -0.37855E-01 -0.75649E-04 11048 0.249E-02 0.141E-01
RMM: 56 -0.417730706268E+03 -0.21601E-01 -0.26788E-04 10516 0.163E-02 0.144E-01
RMM: 57 -0.417764835689E+03 -0.34129E-01 -0.40019E-04 11358 0.191E-02 0.823E-02
RMM: 58 -0.417803529904E+03 -0.38694E-01 -0.25893E-04 11098 0.148E-02 0.607E-02
RMM: 59 -0.417815625382E+03 -0.12095E-01 -0.12854E-04 9562 0.978E-03 0.365E-02
RMM: 60 -0.417817572729E+03 -0.19473E-02 -0.40404E-05 8174 0.584E-03 0.329E-02
RMM: 61 -0.417818508228E+03 -0.93550E-03 -0.25211E-05 7378 0.473E-03 0.211E-02
RMM: 62 -0.417819420013E+03 -0.91179E-03 -0.16888E-05 7108 0.361E-03 0.175E-02
RMM: 63 -0.417820059310E+03 -0.63930E-03 -0.14523E-05 6901 0.354E-03 0.821E-03
RMM: 64 -0.417820395750E+03 -0.33644E-03 -0.92959E-06 6671 0.257E-03 0.924E-03
RMM: 65 -0.417820567249E+03 -0.17150E-03 -0.39825E-06 5094 0.167E-03 0.712E-03
RMM: 66 -0.417820684053E+03 -0.11680E-03 -0.23274E-06 4509 0.138E-03 0.441E-03
RMM: 67 -0.417820749020E+03 -0.64967E-04 -0.13325E-06 4145 0.119E-03 0.333E-03
RMM: 68 -0.417820833701E+03 -0.84681E-04 -0.19153E-06 5090 0.130E-03 0.361E-03
RMM: 69 -0.417820867358E+03 -0.33657E-04 -0.52209E-07 3041 0.875E-04 0.250E-03
RMM: 70 -0.417820901291E+03 -0.33934E-04 -0.75518E-07 3476 0.942E-04 0.225E-03
RMM: 71 -0.417820910849E+03 -0.95572E-05 -0.37927E-07 3009 0.864E-04
1 F= -.45543853E+03 E0= -.45543891E+03 d E =0.112190E-02 mag= -0.0001