iterations/neb2_max1_image04_iter3_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421825705381E+04 0.42183E+04 -0.25383E+05 9008 0.103E+03
DAV: 2 -0.105639616042E+03 -0.43239E+04 -0.39252E+04 11008 0.248E+02
DAV: 3 -0.426926661689E+03 -0.32129E+03 -0.30071E+03 10248 0.655E+01
DAV: 4 -0.435468838309E+03 -0.85422E+01 -0.84408E+01 10872 0.107E+01
DAV: 5 -0.435751922125E+03 -0.28308E+00 -0.28244E+00 11200 0.189E+00 0.101E+02
RMM: 6 -0.387866195958E+03 0.47886E+02 -0.10870E+02 9699 0.143E+01 0.720E+01
RMM: 7 -0.770626649805E+03 -0.38276E+03 -0.41650E+02 11254 0.189E+01 0.145E+02
RMM: 8 -0.498345058428E+03 0.27228E+03 -0.11548E+02 10086 0.113E+01 0.913E+01
RMM: 9 -0.405265293924E+03 0.93080E+02 -0.69008E+01 10195 0.107E+01 0.531E+01
RMM: 10 -0.397532219360E+03 0.77331E+01 -0.43310E+01 10318 0.856E+00 0.459E+01
RMM: 11 -0.390205107310E+03 0.73271E+01 -0.24374E+01 10260 0.598E+00 0.463E+01
RMM: 12 -0.375431739187E+03 0.14773E+02 -0.76947E+00 9939 0.375E+00 0.280E+01
RMM: 13 -0.375503868152E+03 -0.72129E-01 -0.31561E+00 10146 0.239E+00 0.238E+01
RMM: 14 -0.374493388325E+03 0.10105E+01 -0.12739E+00 10116 0.151E+00 0.155E+01
RMM: 15 -0.377641667625E+03 -0.31483E+01 -0.12780E+00 10455 0.146E+00 0.123E+01
RMM: 16 -0.383331058989E+03 -0.56894E+01 -0.13398E+00 10627 0.151E+00 0.143E+01
RMM: 17 -0.387126901044E+03 -0.37958E+01 -0.15581E+00 10914 0.152E+00 0.999E+00
RMM: 18 -0.390364122198E+03 -0.32372E+01 -0.73104E-01 10460 0.105E+00 0.707E+00
RMM: 19 -0.394207568177E+03 -0.38434E+01 -0.74152E-01 10916 0.100E+00 0.672E+00
RMM: 20 -0.397465024184E+03 -0.32575E+01 -0.94586E-01 11467 0.110E+00 0.723E+00
RMM: 21 -0.400391054632E+03 -0.29260E+01 -0.10689E+00 11782 0.108E+00 0.680E+00
RMM: 22 -0.402951553885E+03 -0.25605E+01 -0.73807E-01 11609 0.868E-01 0.619E+00
RMM: 23 -0.407263562770E+03 -0.43120E+01 -0.19131E+00 12833 0.123E+00 0.648E+00
RMM: 24 -0.409317620112E+03 -0.20541E+01 -0.65889E-01 11881 0.738E-01 0.688E+00
RMM: 25 -0.409663170968E+03 -0.34555E+00 -0.10705E-01 10754 0.313E-01 0.634E+00
RMM: 26 -0.409984060922E+03 -0.32089E+00 -0.24745E-02 10675 0.143E-01 0.622E+00
RMM: 27 -0.409966765570E+03 0.17295E-01 -0.37581E-03 10600 0.650E-02 0.606E+00
RMM: 28 -0.409807214433E+03 0.15955E+00 -0.10775E-02 10788 0.113E-01 0.609E+00
RMM: 29 -0.409482144252E+03 0.32507E+00 -0.15611E-01 15759 0.457E-01 0.836E+00
RMM: 30 -0.408133923039E+03 0.13482E+01 -0.20305E-01 16170 0.559E-01 0.854E+00
RMM: 31 -0.408908696715E+03 -0.77477E+00 -0.25748E-02 12327 0.209E-01 0.879E+00
RMM: 32 -0.411295615470E+03 -0.23869E+01 -0.99827E-01 17428 0.103E+00 0.864E+00
RMM: 33 -0.413120278705E+03 -0.18247E+01 -0.59581E-01 17305 0.782E-01 0.506E+00
RMM: 34 -0.415114514924E+03 -0.19942E+01 -0.29965E-01 16383 0.552E-01 0.427E+00
RMM: 35 -0.415351813330E+03 -0.23730E+00 -0.19132E-02 12059 0.187E-01 0.352E+00
RMM: 36 -0.415981997906E+03 -0.63018E+00 -0.10621E-01 15282 0.400E-01 0.365E+00
RMM: 37 -0.416239862642E+03 -0.25786E+00 -0.85630E-02 15066 0.329E-01 0.278E+00
RMM: 38 -0.416443155597E+03 -0.20329E+00 -0.37636E-02 13509 0.239E-01 0.272E+00
RMM: 39 -0.416555479496E+03 -0.11232E+00 -0.24317E-02 12597 0.185E-01 0.239E+00
RMM: 40 -0.416704762496E+03 -0.14928E+00 -0.10930E-02 11453 0.127E-01 0.211E+00
RMM: 41 -0.416772878210E+03 -0.68116E-01 -0.78306E-03 11112 0.102E-01 0.185E+00
RMM: 42 -0.416835976856E+03 -0.63099E-01 -0.64033E-03 11045 0.881E-02 0.151E+00
RMM: 43 -0.416957343712E+03 -0.12137E+00 -0.68223E-03 11352 0.867E-02 0.113E+00
RMM: 44 -0.417099508347E+03 -0.14216E+00 -0.45718E-03 10954 0.728E-02 0.902E-01
RMM: 45 -0.417226842491E+03 -0.12733E+00 -0.69154E-03 11705 0.848E-02 0.644E-01
RMM: 46 -0.417325210802E+03 -0.98368E-01 -0.51457E-03 11365 0.751E-02 0.496E-01
RMM: 47 -0.417362763828E+03 -0.37553E-01 -0.80752E-03 12150 0.859E-02 0.383E-01
RMM: 48 -0.417417509596E+03 -0.54746E-01 -0.11774E-02 12609 0.972E-02 0.307E-01
RMM: 49 -0.417474848856E+03 -0.57339E-01 -0.58388E-03 11644 0.681E-02 0.310E-01
RMM: 50 -0.417557510225E+03 -0.82661E-01 -0.36891E-03 11270 0.541E-02 0.278E-01
RMM: 51 -0.417605780883E+03 -0.48271E-01 -0.35882E-03 11550 0.590E-02 0.312E-01
RMM: 52 -0.417639971954E+03 -0.34191E-01 -0.26835E-03 11415 0.449E-02 0.149E-01
RMM: 53 -0.417656558345E+03 -0.16586E-01 -0.59651E-04 10672 0.243E-02 0.143E-01
RMM: 54 -0.417673570301E+03 -0.17012E-01 -0.25652E-04 10442 0.164E-02 0.136E-01
RMM: 55 -0.417719750184E+03 -0.46180E-01 -0.50003E-04 11332 0.208E-02 0.137E-01
RMM: 56 -0.417714974656E+03 0.47755E-02 -0.18065E-04 10542 0.161E-02 0.137E-01
RMM: 57 -0.417751190326E+03 -0.36216E-01 -0.33320E-04 11474 0.172E-02 0.835E-02
RMM: 58 -0.417777201788E+03 -0.26011E-01 -0.32277E-04 11514 0.162E-02 0.408E-02
RMM: 59 -0.417784414095E+03 -0.72123E-02 -0.82472E-05 9193 0.830E-03 0.329E-02
RMM: 60 -0.417786745977E+03 -0.23319E-02 -0.55661E-05 8433 0.657E-03 0.183E-02
RMM: 61 -0.417787921407E+03 -0.11754E-02 -0.28981E-05 7615 0.473E-03 0.156E-02
RMM: 62 -0.417788720986E+03 -0.79958E-03 -0.12676E-05 6798 0.326E-03 0.115E-02
RMM: 63 -0.417789205262E+03 -0.48428E-03 -0.75183E-06 6565 0.240E-03 0.917E-03
RMM: 64 -0.417789430734E+03 -0.22547E-03 -0.34242E-06 5057 0.159E-03 0.633E-03
RMM: 65 -0.417789531502E+03 -0.10077E-03 -0.17497E-06 4053 0.126E-03 0.508E-03
RMM: 66 -0.417789586360E+03 -0.54858E-04 -0.78226E-07 3414 0.108E-03 0.555E-03
RMM: 67 -0.417789648612E+03 -0.62253E-04 -0.12544E-06 4132 0.118E-03 0.549E-03
RMM: 68 -0.417789722881E+03 -0.74269E-04 -0.69648E-07 3495 0.999E-04 0.383E-03
RMM: 69 -0.417789751110E+03 -0.28230E-04 -0.39217E-07 3070 0.929E-04 0.240E-03
RMM: 70 -0.417789760362E+03 -0.92520E-05 -0.27692E-07 2849 0.897E-04
1 F= -.45543107E+03 E0= -.45543158E+03 d E =0.154691E-02 mag= 0.0005