iterations/neb2_max1_image01_iter5_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422271625610E+04 0.42227E+04 -0.25387E+05 9008 0.103E+03
DAV: 2 -0.104388632602E+03 -0.43271E+04 -0.39300E+04 11008 0.248E+02
DAV: 3 -0.426187274740E+03 -0.32180E+03 -0.30130E+03 10312 0.655E+01
DAV: 4 -0.434657172418E+03 -0.84699E+01 -0.83409E+01 10912 0.107E+01
DAV: 5 -0.434941772502E+03 -0.28460E+00 -0.28388E+00 11224 0.190E+00 0.101E+02
RMM: 6 -0.384994585987E+03 0.49947E+02 -0.10805E+02 9691 0.142E+01 0.714E+01
RMM: 7 -0.796122719456E+03 -0.41113E+03 -0.44337E+02 11329 0.194E+01 0.148E+02
RMM: 8 -0.500074643439E+03 0.29605E+03 -0.11907E+02 10072 0.115E+01 0.919E+01
RMM: 9 -0.406515663706E+03 0.93559E+02 -0.67547E+01 10183 0.106E+01 0.536E+01
RMM: 10 -0.397836437209E+03 0.86792E+01 -0.43276E+01 10274 0.856E+00 0.471E+01
RMM: 11 -0.385254382516E+03 0.12582E+02 -0.23697E+01 10238 0.593E+00 0.438E+01
RMM: 12 -0.374592495779E+03 0.10662E+02 -0.69878E+00 9941 0.358E+00 0.270E+01
RMM: 13 -0.374408361769E+03 0.18413E+00 -0.32705E+00 10155 0.242E+00 0.224E+01
RMM: 14 -0.373908533205E+03 0.49983E+00 -0.12320E+00 10119 0.148E+00 0.141E+01
RMM: 15 -0.377993766167E+03 -0.40852E+01 -0.12644E+00 10449 0.145E+00 0.128E+01
RMM: 16 -0.383891196819E+03 -0.58974E+01 -0.14005E+00 10721 0.155E+00 0.151E+01
RMM: 17 -0.387209358248E+03 -0.33182E+01 -0.14805E+00 10908 0.148E+00 0.991E+00
RMM: 18 -0.390112016342E+03 -0.29027E+01 -0.67186E-01 10427 0.101E+00 0.691E+00
RMM: 19 -0.393710429190E+03 -0.35984E+01 -0.67988E-01 10853 0.973E-01 0.707E+00
RMM: 20 -0.396068980606E+03 -0.23586E+01 -0.60811E-01 11165 0.907E-01 0.700E+00
RMM: 21 -0.400113890465E+03 -0.40449E+01 -0.14569E+00 12260 0.122E+00 0.689E+00
RMM: 22 -0.403409846708E+03 -0.32960E+01 -0.11846E+00 12186 0.106E+00 0.646E+00
RMM: 23 -0.407342547326E+03 -0.39327E+01 -0.16740E+00 12719 0.115E+00 0.740E+00
RMM: 24 -0.409149719963E+03 -0.18072E+01 -0.71776E-01 11873 0.759E-01 0.760E+00
RMM: 25 -0.409444668254E+03 -0.29495E+00 -0.93813E-02 10676 0.295E-01 0.706E+00
RMM: 26 -0.409793038569E+03 -0.34837E+00 -0.29191E-02 10719 0.152E-01 0.690E+00
RMM: 27 -0.410231638548E+03 -0.43860E+00 -0.27920E-02 10923 0.146E-01 0.738E+00
RMM: 28 -0.411391915103E+03 -0.11603E+01 -0.43348E-01 14774 0.602E-01 0.676E+00
RMM: 29 -0.412981086072E+03 -0.15892E+01 -0.36765E-01 15008 0.559E-01 0.451E+00
RMM: 30 -0.414445034378E+03 -0.14639E+01 -0.18951E-01 14149 0.453E-01 0.355E+00
RMM: 31 -0.415133274874E+03 -0.68824E+00 -0.63373E-02 12347 0.300E-01 0.317E+00
RMM: 32 -0.415637684573E+03 -0.50441E+00 -0.73752E-02 12353 0.324E-01 0.273E+00
RMM: 33 -0.416076803702E+03 -0.43912E+00 -0.84722E-02 12665 0.346E-01 0.263E+00
RMM: 34 -0.416177575137E+03 -0.10077E+00 -0.37216E-02 11508 0.234E-01 0.247E+00
RMM: 35 -0.416123975005E+03 0.53600E-01 -0.16920E-02 10764 0.157E-01 0.226E+00
RMM: 36 -0.416232174551E+03 -0.10820E+00 -0.10290E-02 10619 0.113E-01 0.192E+00
RMM: 37 -0.416428307467E+03 -0.19613E+00 -0.10711E-02 11051 0.113E-01 0.149E+00
RMM: 38 -0.416574652352E+03 -0.14634E+00 -0.96758E-03 11103 0.104E-01 0.116E+00
RMM: 39 -0.416655745533E+03 -0.81093E-01 -0.33763E-03 10518 0.650E-02 0.113E+00
RMM: 40 -0.416696052133E+03 -0.40307E-01 -0.57122E-03 11385 0.802E-02 0.104E+00
RMM: 41 -0.416751239914E+03 -0.55188E-01 -0.56745E-03 11613 0.762E-02 0.809E-01
RMM: 42 -0.416854488657E+03 -0.10325E+00 -0.12855E-02 12777 0.106E-01 0.452E-01
RMM: 43 -0.416845099516E+03 0.93891E-02 -0.12886E-02 12795 0.104E-01 0.618E-01
RMM: 44 -0.416858897986E+03 -0.13798E-01 -0.35266E-03 11165 0.619E-02 0.493E-01
RMM: 45 -0.416933049523E+03 -0.74152E-01 -0.25577E-03 11011 0.520E-02 0.358E-01
RMM: 46 -0.417067211797E+03 -0.13416E+00 -0.57485E-03 12039 0.649E-02 0.295E-01
RMM: 47 -0.417157579943E+03 -0.90368E-01 -0.42151E-03 11663 0.551E-02 0.263E-01
RMM: 48 -0.417197686505E+03 -0.40107E-01 -0.23187E-03 11299 0.414E-02 0.231E-01
RMM: 49 -0.417212675209E+03 -0.14989E-01 -0.56978E-04 10618 0.219E-02 0.199E-01
RMM: 50 -0.417231979622E+03 -0.19304E-01 -0.44411E-04 10830 0.187E-02 0.161E-01
RMM: 51 -0.417236609390E+03 -0.46298E-02 -0.89249E-04 11849 0.269E-02 0.118E-01
RMM: 52 -0.417271253498E+03 -0.34644E-01 -0.31241E-04 10980 0.172E-02 0.103E-01
RMM: 53 -0.417302261565E+03 -0.31008E-01 -0.25958E-04 10499 0.134E-02 0.814E-02
RMM: 54 -0.417312350494E+03 -0.10089E-01 -0.16579E-04 10121 0.109E-02 0.572E-02
RMM: 55 -0.417314868845E+03 -0.25184E-02 -0.10893E-04 9546 0.887E-03 0.301E-02
RMM: 56 -0.417314310909E+03 0.55794E-03 -0.36587E-05 8048 0.664E-03 0.368E-02
RMM: 57 -0.417314990660E+03 -0.67975E-03 -0.15014E-05 6842 0.425E-03 0.227E-02
RMM: 58 -0.417315458784E+03 -0.46812E-03 -0.15335E-05 7019 0.339E-03 0.136E-02
RMM: 59 -0.417316061821E+03 -0.60304E-03 -0.81698E-06 6577 0.244E-03 0.932E-03
RMM: 60 -0.417316638851E+03 -0.57703E-03 -0.46058E-06 5808 0.180E-03 0.836E-03
RMM: 61 -0.417316884240E+03 -0.24539E-03 -0.20136E-06 4353 0.129E-03 0.852E-03
RMM: 62 -0.417317168891E+03 -0.28465E-03 -0.31551E-06 5407 0.151E-03 0.708E-03
RMM: 63 -0.417317226490E+03 -0.57599E-04 -0.94123E-07 3372 0.101E-03 0.556E-03
RMM: 64 -0.417317271201E+03 -0.44711E-04 -0.88125E-07 3584 0.105E-03 0.248E-03
RMM: 65 -0.417317328964E+03 -0.57763E-04 -0.56281E-07 3277 0.967E-04 0.160E-03
RMM: 66 -0.417317384530E+03 -0.55567E-04 -0.45410E-07 3056 0.926E-04 0.114E-03
RMM: 67 -0.417317425295E+03 -0.40765E-04 -0.40703E-07 2964 0.899E-04 0.873E-04
RMM: 68 -0.417317445226E+03 -0.19930E-04 -0.17266E-07 2490 0.829E-04 0.889E-04
RMM: 69 -0.417317453958E+03 -0.87326E-05 -0.11661E-07 2448 0.825E-04
1 F= -.45498782E+03 E0= -.45498862E+03 d E =0.239464E-02 mag= -0.0005