iterations/neb3_max1_image03_iter20_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421779399787E+04 0.42178E+04 -0.25383E+05 9008 0.103E+03
DAV: 2 -0.105590791704E+03 -0.43234E+04 -0.39269E+04 11024 0.248E+02
DAV: 3 -0.427029327866E+03 -0.32144E+03 -0.30075E+03 10248 0.655E+01
DAV: 4 -0.435548996663E+03 -0.85197E+01 -0.84200E+01 10840 0.107E+01
DAV: 5 -0.435834680968E+03 -0.28568E+00 -0.28504E+00 11224 0.190E+00 0.101E+02
RMM: 6 -0.387456772048E+03 0.48378E+02 -0.10918E+02 9701 0.144E+01 0.722E+01
RMM: 7 -0.759575138171E+03 -0.37212E+03 -0.40322E+02 11183 0.187E+01 0.142E+02
RMM: 8 -0.500731910395E+03 0.25884E+03 -0.11676E+02 10116 0.113E+01 0.914E+01
RMM: 9 -0.400623996397E+03 0.10011E+03 -0.69763E+01 10199 0.108E+01 0.511E+01
RMM: 10 -0.399250278280E+03 0.13737E+01 -0.44182E+01 10272 0.860E+00 0.478E+01
RMM: 11 -0.389433215865E+03 0.98171E+01 -0.24022E+01 10254 0.602E+00 0.461E+01
RMM: 12 -0.375112122455E+03 0.14321E+02 -0.79104E+00 9958 0.377E+00 0.274E+01
RMM: 13 -0.375191595917E+03 -0.79473E-01 -0.29070E+00 10137 0.230E+00 0.233E+01
RMM: 14 -0.374465603014E+03 0.72599E+00 -0.12076E+00 10112 0.148E+00 0.152E+01
RMM: 15 -0.377779362177E+03 -0.33138E+01 -0.12400E+00 10462 0.145E+00 0.122E+01
RMM: 16 -0.383749476140E+03 -0.59701E+01 -0.13735E+00 10730 0.152E+00 0.152E+01
RMM: 17 -0.386779510223E+03 -0.30300E+01 -0.13243E+00 10797 0.141E+00 0.107E+01
RMM: 18 -0.390349445976E+03 -0.35699E+01 -0.85886E-01 10632 0.112E+00 0.778E+00
RMM: 19 -0.394366041606E+03 -0.40166E+01 -0.83647E-01 10991 0.106E+00 0.668E+00
RMM: 20 -0.397660528654E+03 -0.32945E+01 -0.95093E-01 11435 0.111E+00 0.698E+00
RMM: 21 -0.400778733922E+03 -0.31182E+01 -0.12216E+00 11872 0.114E+00 0.670E+00
RMM: 22 -0.403286682544E+03 -0.25079E+01 -0.73801E-01 11529 0.867E-01 0.637E+00
RMM: 23 -0.407458180028E+03 -0.41715E+01 -0.18209E+00 12694 0.120E+00 0.703E+00
RMM: 24 -0.409289197030E+03 -0.18310E+01 -0.65124E-01 11812 0.730E-01 0.731E+00
RMM: 25 -0.409662051076E+03 -0.37285E+00 -0.11251E-01 10757 0.317E-01 0.678E+00
RMM: 26 -0.409992831393E+03 -0.33078E+00 -0.28972E-02 10624 0.155E-01 0.663E+00
RMM: 27 -0.410203675751E+03 -0.21084E+00 -0.11167E-02 10727 0.925E-02 0.662E+00
RMM: 28 -0.410079218310E+03 0.12446E+00 -0.31919E-03 10146 0.654E-02 0.637E+00
RMM: 29 -0.409761750800E+03 0.31747E+00 -0.52795E-02 12933 0.244E-01 0.658E+00
RMM: 30 -0.409388927202E+03 0.37282E+00 -0.31942E-01 16756 0.626E-01 0.592E+00
RMM: 31 -0.408951586338E+03 0.43734E+00 -0.15971E-01 15965 0.493E-01 0.692E+00
RMM: 32 -0.411840496565E+03 -0.28889E+01 -0.66324E-01 17264 0.905E-01 0.583E+00
RMM: 33 -0.413424033452E+03 -0.15835E+01 -0.36867E-01 17014 0.624E-01 0.661E+00
RMM: 34 -0.415244684958E+03 -0.18207E+01 -0.36314E-01 16896 0.609E-01 0.514E+00
RMM: 35 -0.415468550195E+03 -0.22387E+00 -0.10071E-01 15353 0.357E-01 0.485E+00
RMM: 36 -0.415402588902E+03 0.65961E-01 -0.20636E-02 12558 0.181E-01 0.356E+00
RMM: 37 -0.416026042528E+03 -0.62345E+00 -0.64732E-02 14954 0.324E-01 0.289E+00
RMM: 38 -0.416272876021E+03 -0.24683E+00 -0.48457E-02 14306 0.256E-01 0.314E+00
RMM: 39 -0.416294216678E+03 -0.21341E-01 -0.21833E-02 12810 0.173E-01 0.293E+00
RMM: 40 -0.416432504768E+03 -0.13829E+00 -0.16839E-02 12266 0.149E-01 0.209E+00
RMM: 41 -0.416700434661E+03 -0.26793E+00 -0.10783E-02 11603 0.120E-01 0.166E+00
RMM: 42 -0.416835108746E+03 -0.13467E+00 -0.48941E-03 10820 0.814E-02 0.158E+00
RMM: 43 -0.416915946212E+03 -0.80837E-01 -0.80087E-03 11578 0.987E-02 0.139E+00
RMM: 44 -0.417027835205E+03 -0.11189E+00 -0.78130E-03 11732 0.920E-02 0.120E+00
RMM: 45 -0.417119477361E+03 -0.91642E-01 -0.47863E-03 11115 0.727E-02 0.919E-01
RMM: 46 -0.417220940293E+03 -0.10146E+00 -0.81703E-03 12058 0.885E-02 0.698E-01
RMM: 47 -0.417285982725E+03 -0.65042E-01 -0.10109E-02 12355 0.933E-02 0.467E-01
RMM: 48 -0.417371580239E+03 -0.85598E-01 -0.69765E-03 11759 0.818E-02 0.339E-01
RMM: 49 -0.417435665691E+03 -0.64085E-01 -0.61661E-03 11597 0.690E-02 0.318E-01
RMM: 50 -0.417495293678E+03 -0.59628E-01 -0.23585E-03 10996 0.449E-02 0.316E-01
RMM: 51 -0.417530260229E+03 -0.34967E-01 -0.45168E-03 11946 0.662E-02 0.265E-01
RMM: 52 -0.417577834423E+03 -0.47574E-01 -0.14954E-03 10996 0.375E-02 0.181E-01
RMM: 53 -0.417602224058E+03 -0.24390E-01 -0.77868E-04 10828 0.255E-02 0.139E-01
RMM: 54 -0.417632823304E+03 -0.30599E-01 -0.88502E-04 11281 0.257E-02 0.135E-01
RMM: 55 -0.417669743979E+03 -0.36921E-01 -0.46329E-04 11086 0.196E-02 0.138E-01
RMM: 56 -0.417685363682E+03 -0.15620E-01 -0.16539E-04 10393 0.138E-02 0.111E-01
RMM: 57 -0.417715696278E+03 -0.30333E-01 -0.28288E-04 11531 0.154E-02 0.713E-02
RMM: 58 -0.417735882459E+03 -0.20186E-01 -0.20987E-04 11094 0.132E-02 0.575E-02
RMM: 59 -0.417741316552E+03 -0.54341E-02 -0.90453E-05 9481 0.923E-03 0.493E-02
RMM: 60 -0.417743241096E+03 -0.19245E-02 -0.51087E-05 8380 0.691E-03 0.307E-02
RMM: 61 -0.417744124013E+03 -0.88292E-03 -0.23308E-05 7363 0.453E-03 0.207E-02
RMM: 62 -0.417744903950E+03 -0.77994E-03 -0.13393E-05 6762 0.392E-03 0.168E-02
RMM: 63 -0.417745659947E+03 -0.75600E-03 -0.15112E-05 7028 0.308E-03 0.117E-02
RMM: 64 -0.417746060750E+03 -0.40080E-03 -0.60328E-06 5874 0.199E-03 0.615E-03
RMM: 65 -0.417746304675E+03 -0.24393E-03 -0.25964E-06 4313 0.136E-03 0.543E-03
RMM: 66 -0.417746430038E+03 -0.12536E-03 -0.14510E-06 4106 0.123E-03 0.447E-03
RMM: 67 -0.417746564249E+03 -0.13421E-03 -0.16153E-06 4454 0.124E-03 0.341E-03
RMM: 68 -0.417746688962E+03 -0.12471E-03 -0.11202E-06 3732 0.107E-03 0.365E-03
RMM: 69 -0.417746746300E+03 -0.57338E-04 -0.50647E-07 3213 0.938E-04 0.352E-03
RMM: 70 -0.417746773556E+03 -0.27256E-04 -0.29865E-07 2910 0.878E-04 0.224E-03
RMM: 71 -0.417746790129E+03 -0.16573E-04 -0.25376E-07 2871 0.884E-04 0.143E-03
RMM: 72 -0.417746801188E+03 -0.11059E-04 -0.41022E-07 3217 0.927E-04 0.649E-03
RMM: 73 -0.417746799829E+03 0.13586E-05 -0.13963E-08 2160 0.791E-04
1 F= -.45539043E+03 E0= -.45539097E+03 d E =0.162426E-02 mag= 0.0010