iterations/neb1_max2_image03_iter20_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422680767085E+04 0.42268E+04 -0.25386E+05 8992 0.103E+03
DAV: 2 -0.102728854870E+03 -0.43295E+04 -0.39296E+04 11000 0.248E+02
DAV: 3 -0.426549832401E+03 -0.32382E+03 -0.30249E+03 10216 0.657E+01
DAV: 4 -0.435106487880E+03 -0.85567E+01 -0.84493E+01 10848 0.107E+01
DAV: 5 -0.435396316697E+03 -0.28983E+00 -0.28909E+00 11048 0.193E+00 0.987E+01
RMM: 6 -0.388676449898E+03 0.46720E+02 -0.11227E+02 9717 0.146E+01 0.734E+01
RMM: 7 -0.821702316817E+03 -0.43303E+03 -0.45435E+02 11362 0.195E+01 0.154E+02
RMM: 8 -0.493528835641E+03 0.32817E+03 -0.10216E+02 9928 0.108E+01 0.908E+01
RMM: 9 -0.440306889088E+03 0.53222E+02 -0.66862E+01 10194 0.105E+01 0.669E+01
RMM: 10 -0.370532065959E+03 0.69775E+02 -0.36815E+01 10296 0.777E+00 0.242E+01
RMM: 11 -0.373226635598E+03 -0.26946E+01 -0.15218E+01 10305 0.443E+00 0.327E+01
RMM: 12 -0.371521266962E+03 0.17054E+01 -0.40998E+00 10058 0.273E+00 0.230E+01
RMM: 13 -0.373153085418E+03 -0.16318E+01 -0.24282E+00 10135 0.220E+00 0.151E+01
RMM: 14 -0.377256581117E+03 -0.41035E+01 -0.15390E+00 10191 0.167E+00 0.141E+01
RMM: 15 -0.379536673890E+03 -0.22801E+01 -0.88645E-01 10205 0.124E+00 0.114E+01
RMM: 16 -0.387150935178E+03 -0.76143E+01 -0.24342E+00 11645 0.185E+00 0.124E+01
RMM: 17 -0.391188964069E+03 -0.40380E+01 -0.17305E+00 11190 0.156E+00 0.893E+00
RMM: 18 -0.393566622493E+03 -0.23777E+01 -0.41328E-01 10246 0.805E-01 0.932E+00
RMM: 19 -0.395367521664E+03 -0.18009E+01 -0.38951E-01 10696 0.684E-01 0.870E+00
RMM: 20 -0.397866878888E+03 -0.24994E+01 -0.66366E-01 11589 0.843E-01 0.750E+00
RMM: 21 -0.400888368687E+03 -0.30215E+01 -0.80803E-01 12017 0.898E-01 0.584E+00
RMM: 22 -0.404592860465E+03 -0.37045E+01 -0.83223E-01 12232 0.876E-01 0.555E+00
RMM: 23 -0.408612837936E+03 -0.40200E+01 -0.14056E+00 13060 0.106E+00 0.513E+00
RMM: 24 -0.410811090798E+03 -0.21983E+01 -0.74572E-01 12276 0.781E-01 0.519E+00
RMM: 25 -0.411352154670E+03 -0.54106E+00 -0.78886E-02 10606 0.287E-01 0.499E+00
RMM: 26 -0.411187986782E+03 0.16417E+00 -0.27144E-02 10243 0.193E-01 0.497E+00
RMM: 27 -0.410672109913E+03 0.51588E+00 -0.10061E-01 11531 0.374E-01 0.453E+00
RMM: 28 -0.410957689197E+03 -0.28558E+00 -0.17171E-01 12802 0.509E-01 0.511E+00
RMM: 29 -0.410827972075E+03 0.12972E+00 -0.77734E-02 11269 0.364E-01 0.630E+00
RMM: 30 -0.412110344145E+03 -0.12824E+01 -0.73846E-01 14675 0.990E-01 0.596E+00
RMM: 31 -0.412606596495E+03 -0.49625E+00 -0.35210E-01 14062 0.632E-01 0.673E+00
RMM: 32 -0.413691301506E+03 -0.10847E+01 -0.33978E-01 13712 0.589E-01 0.415E+00
RMM: 33 -0.414187699801E+03 -0.49640E+00 -0.15389E-02 10440 0.163E-01 0.365E+00
RMM: 34 -0.414583491699E+03 -0.39579E+00 -0.49138E-02 11830 0.265E-01 0.367E+00
RMM: 35 -0.414678665123E+03 -0.95173E-01 -0.44809E-02 11706 0.263E-01 0.277E+00
RMM: 36 -0.414972502134E+03 -0.29384E+00 -0.20842E-02 10721 0.181E-01 0.227E+00
RMM: 37 -0.415203214292E+03 -0.23071E+00 -0.12404E-02 10521 0.138E-01 0.184E+00
RMM: 38 -0.415355739662E+03 -0.15253E+00 -0.65759E-03 10345 0.100E-01 0.176E+00
RMM: 39 -0.415419854052E+03 -0.64114E-01 -0.80348E-03 10790 0.101E-01 0.128E+00
RMM: 40 -0.415577110371E+03 -0.15726E+00 -0.49607E-03 10643 0.777E-02 0.102E+00
RMM: 41 -0.415674459743E+03 -0.97349E-01 -0.44674E-03 10964 0.720E-02 0.881E-01
RMM: 42 -0.415751146865E+03 -0.76687E-01 -0.69062E-03 11796 0.865E-02 0.671E-01
RMM: 43 -0.415813517318E+03 -0.62370E-01 -0.83766E-03 12205 0.917E-02 0.531E-01
RMM: 44 -0.415890278750E+03 -0.76761E-01 -0.11065E-02 12608 0.975E-02 0.587E-01
RMM: 45 -0.415976583141E+03 -0.86304E-01 -0.69269E-03 11870 0.768E-02 0.545E-01
RMM: 46 -0.416055941890E+03 -0.79359E-01 -0.40370E-03 11243 0.619E-02 0.411E-01
RMM: 47 -0.416099923734E+03 -0.43982E-01 -0.33922E-03 11282 0.547E-02 0.273E-01
RMM: 48 -0.416154987394E+03 -0.55064E-01 -0.45246E-03 11754 0.556E-02 0.180E-01
RMM: 49 -0.416201975153E+03 -0.46988E-01 -0.21433E-03 11313 0.373E-02 0.143E-01
RMM: 50 -0.416240655236E+03 -0.38680E-01 -0.94023E-04 10965 0.257E-02 0.150E-01
RMM: 51 -0.416265305490E+03 -0.24650E-01 -0.68689E-04 11132 0.238E-02 0.129E-01
RMM: 52 -0.416301970122E+03 -0.36665E-01 -0.45765E-04 11117 0.196E-02 0.798E-02
RMM: 53 -0.416329100673E+03 -0.27131E-01 -0.38494E-04 11412 0.171E-02 0.592E-02
RMM: 54 -0.416338077117E+03 -0.89764E-02 -0.11029E-04 9573 0.100E-02 0.453E-02
RMM: 55 -0.416341661730E+03 -0.35846E-02 -0.82307E-05 9102 0.808E-03 0.333E-02
RMM: 56 -0.416340890215E+03 0.77152E-03 -0.25581E-05 7071 0.608E-03 0.214E-02
RMM: 57 -0.416341902942E+03 -0.10127E-02 -0.22933E-05 7332 0.472E-03 0.159E-02
RMM: 58 -0.416342704288E+03 -0.80135E-03 -0.17909E-05 7148 0.334E-03 0.151E-02
RMM: 59 -0.416343117197E+03 -0.41291E-03 -0.10780E-05 6769 0.273E-03 0.793E-03
RMM: 60 -0.416343345143E+03 -0.22795E-03 -0.55916E-06 5750 0.191E-03 0.580E-03
RMM: 61 -0.416343508303E+03 -0.16316E-03 -0.24934E-06 4496 0.139E-03 0.335E-03
RMM: 62 -0.416343638866E+03 -0.13056E-03 -0.16535E-06 4498 0.127E-03 0.340E-03
RMM: 63 -0.416343713526E+03 -0.74660E-04 -0.19777E-06 5390 0.139E-03 0.145E-02
RMM: 64 -0.416343710214E+03 0.33116E-05 -0.33712E-07 3228 0.919E-04
1 F= -.45405502E+03 E0= -.45405436E+03 d E =-.197112E-02 mag= 0.0014