iterations/neb2_max2_image05_iter1_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422467889568E+04 0.42247E+04 -0.25387E+05 9000 0.103E+03
DAV: 2 -0.104372385212E+03 -0.43291E+04 -0.39286E+04 11024 0.248E+02
DAV: 3 -0.426192351841E+03 -0.32182E+03 -0.30152E+03 10208 0.656E+01
DAV: 4 -0.434703980947E+03 -0.85116E+01 -0.84077E+01 10944 0.107E+01
DAV: 5 -0.434994005144E+03 -0.29002E+00 -0.28919E+00 11160 0.192E+00 0.990E+01
RMM: 6 -0.377684947925E+03 0.57309E+02 -0.11504E+02 9691 0.146E+01 0.679E+01
RMM: 7 -0.527998708228E+03 -0.15031E+03 -0.18492E+02 10106 0.156E+01 0.956E+01
RMM: 8 -0.455868159302E+03 0.72131E+02 -0.84866E+01 10150 0.114E+01 0.695E+01
RMM: 9 -0.441361277996E+03 0.14507E+02 -0.42606E+01 10171 0.753E+00 0.650E+01
RMM: 10 -0.397224877766E+03 0.44136E+02 -0.44081E+01 10426 0.800E+00 0.445E+01
RMM: 11 -0.377461769019E+03 0.19763E+02 -0.79010E+00 9620 0.405E+00 0.278E+01
RMM: 12 -0.374765922792E+03 0.26958E+01 -0.52825E+00 10157 0.298E+00 0.216E+01
RMM: 13 -0.374703377813E+03 0.62545E-01 -0.23811E+00 10190 0.195E+00 0.139E+01
RMM: 14 -0.377078515363E+03 -0.23751E+01 -0.10896E+00 10210 0.127E+00 0.117E+01
RMM: 15 -0.381707375708E+03 -0.46289E+01 -0.10727E+00 10468 0.131E+00 0.113E+01
RMM: 16 -0.387755471590E+03 -0.60481E+01 -0.25743E+00 11586 0.186E+00 0.101E+01
RMM: 17 -0.392964279965E+03 -0.52088E+01 -0.15375E+00 11218 0.145E+00 0.871E+00
RMM: 18 -0.394097153652E+03 -0.11329E+01 -0.37026E-01 10241 0.781E-01 0.746E+00
RMM: 19 -0.396990010620E+03 -0.28929E+01 -0.74192E-01 11307 0.932E-01 0.668E+00
RMM: 20 -0.399037403877E+03 -0.20474E+01 -0.39827E-01 11055 0.683E-01 0.601E+00
RMM: 21 -0.399654947225E+03 -0.61754E+00 -0.66973E-02 10437 0.286E-01 0.579E+00
RMM: 22 -0.401693949539E+03 -0.20390E+01 -0.45102E-01 12123 0.680E-01 0.556E+00
RMM: 23 -0.405272163811E+03 -0.35782E+01 -0.13756E+00 13882 0.116E+00 0.526E+00
RMM: 24 -0.408960370718E+03 -0.36882E+01 -0.13557E+00 14185 0.109E+00 0.612E+00
RMM: 25 -0.411080871024E+03 -0.21205E+01 -0.88675E-01 13574 0.864E-01 0.587E+00
RMM: 26 -0.411950736344E+03 -0.86987E+00 -0.99586E-02 10972 0.322E-01 0.591E+00
RMM: 27 -0.411850922999E+03 0.99813E-01 -0.26717E-02 10243 0.191E-01 0.556E+00
RMM: 28 -0.411463500961E+03 0.38742E+00 -0.81717E-02 11376 0.343E-01 0.508E+00
RMM: 29 -0.411434870009E+03 0.28631E-01 -0.50863E-02 10865 0.287E-01 0.495E+00
RMM: 30 -0.411135554873E+03 0.29932E+00 -0.17908E-01 13137 0.517E-01 0.623E+00
RMM: 31 -0.411341643268E+03 -0.20609E+00 -0.53765E-03 10096 0.104E-01 0.604E+00
RMM: 32 -0.412549903850E+03 -0.12083E+01 -0.72501E-01 16413 0.953E-01 0.517E+00
RMM: 33 -0.412512511260E+03 0.37393E-01 -0.33433E-01 15949 0.636E-01 0.488E+00
RMM: 34 -0.413384545696E+03 -0.87203E+00 -0.13276E-01 14572 0.410E-01 0.287E+00
RMM: 35 -0.413629496005E+03 -0.24495E+00 -0.22122E-03 10402 0.662E-02 0.274E+00
RMM: 36 -0.414152710099E+03 -0.52321E+00 -0.19016E-02 12923 0.189E-01 0.256E+00
RMM: 37 -0.414664045188E+03 -0.51134E+00 -0.33634E-02 14253 0.229E-01 0.171E+00
RMM: 38 -0.415124372204E+03 -0.46033E+00 -0.27272E-02 13771 0.197E-01 0.106E+00
RMM: 39 -0.415665233914E+03 -0.54086E+00 -0.20977E-02 12901 0.152E-01 0.812E-01
RMM: 40 -0.416014692919E+03 -0.34946E+00 -0.24459E-02 12832 0.155E-01 0.753E-01
RMM: 41 -0.415915999746E+03 0.98693E-01 -0.22819E-02 12739 0.146E-01 0.797E-01
RMM: 42 -0.415975893150E+03 -0.59893E-01 -0.36295E-03 11019 0.648E-02 0.698E-01
RMM: 43 -0.416095634100E+03 -0.11974E+00 -0.47902E-03 11384 0.711E-02 0.576E-01
RMM: 44 -0.416222234718E+03 -0.12660E+00 -0.93728E-03 12200 0.899E-02 0.509E-01
RMM: 45 -0.416308309090E+03 -0.86074E-01 -0.97175E-03 12359 0.862E-02 0.394E-01
RMM: 46 -0.416414564380E+03 -0.10626E+00 -0.64132E-03 11986 0.724E-02 0.300E-01
RMM: 47 -0.416493321198E+03 -0.78757E-01 -0.22299E-03 11128 0.433E-02 0.204E-01
RMM: 48 -0.416566436660E+03 -0.73115E-01 -0.10159E-03 10781 0.320E-02 0.188E-01
RMM: 49 -0.416638706866E+03 -0.72270E-01 -0.76233E-04 10919 0.269E-02 0.121E-01
RMM: 50 -0.416667044714E+03 -0.28338E-01 -0.37910E-04 10719 0.183E-02 0.989E-02
RMM: 51 -0.416672174447E+03 -0.51297E-02 -0.11227E-04 9509 0.112E-02 0.823E-02
RMM: 52 -0.416673951617E+03 -0.17772E-02 -0.69338E-05 8688 0.828E-03 0.536E-02
RMM: 53 -0.416676145462E+03 -0.21938E-02 -0.64317E-05 8718 0.805E-03 0.364E-02
RMM: 54 -0.416677732831E+03 -0.15874E-02 -0.27661E-05 7650 0.540E-03 0.271E-02
RMM: 55 -0.416679269084E+03 -0.15363E-02 -0.24422E-05 7447 0.451E-03 0.195E-02
RMM: 56 -0.416680031972E+03 -0.76289E-03 -0.10146E-05 6546 0.337E-03 0.164E-02
RMM: 57 -0.416680760069E+03 -0.72810E-03 -0.81446E-06 6724 0.259E-03 0.942E-03
RMM: 58 -0.416681263729E+03 -0.50366E-03 -0.42628E-06 6393 0.196E-03 0.201E-02
RMM: 59 -0.416681622210E+03 -0.35848E-03 -0.25050E-06 4762 0.136E-03 0.190E-02
RMM: 60 -0.416681789116E+03 -0.16691E-03 -0.14981E-06 4260 0.120E-03 0.103E-02
RMM: 61 -0.416681824464E+03 -0.35348E-04 -0.18332E-06 5542 0.142E-03 0.645E-03
RMM: 62 -0.416681864205E+03 -0.39742E-04 -0.36595E-07 3190 0.915E-04 0.610E-03
RMM: 63 -0.416681938989E+03 -0.74784E-04 -0.29338E-07 3049 0.866E-04 0.762E-03
RMM: 64 -0.416681987889E+03 -0.48900E-04 -0.29221E-07 2941 0.843E-04 0.504E-03
RMM: 65 -0.416682070910E+03 -0.83021E-04 -0.65793E-07 3606 0.982E-04 0.310E-03
RMM: 66 -0.416682169543E+03 -0.98634E-04 -0.45743E-07 3360 0.938E-04 0.281E-03
RMM: 67 -0.416682241553E+03 -0.72009E-04 -0.47198E-07 3370 0.958E-04 0.345E-03
RMM: 68 -0.416682278743E+03 -0.37190E-04 -0.25508E-07 2999 0.902E-04 0.240E-03
RMM: 69 -0.416682309376E+03 -0.30633E-04 -0.17871E-07 2685 0.814E-04 0.189E-03
RMM: 70 -0.416682333207E+03 -0.23831E-04 -0.21190E-07 2729 0.836E-04 0.128E-03
RMM: 71 -0.416682345515E+03 -0.12308E-04 -0.14716E-07 2568 0.830E-04 0.147E-03
RMM: 72 -0.416682357941E+03 -0.12426E-04 -0.17318E-07 2650 0.828E-04 0.209E-03
RMM: 73 -0.416682366972E+03 -0.90313E-05 -0.11445E-07 2487 0.812E-04
1 F= -.45440231E+03 E0= -.45440192E+03 d E =-.115718E-02 mag= -0.0008