iterations/neb1_max2_image03_iter8_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421637913140E+04 0.42164E+04 -0.25370E+05 8984 0.103E+03
DAV: 2 -0.101406703023E+03 -0.43178E+04 -0.39120E+04 11008 0.247E+02
DAV: 3 -0.425116905391E+03 -0.32371E+03 -0.30189E+03 10296 0.656E+01
DAV: 4 -0.433777686226E+03 -0.86608E+01 -0.85499E+01 10728 0.108E+01
DAV: 5 -0.434079005720E+03 -0.30132E+00 -0.30055E+00 11112 0.196E+00 0.967E+01
RMM: 6 -0.395400777875E+03 0.38678E+02 -0.10772E+02 9661 0.144E+01 0.806E+01
RMM: 7 -0.831410041486E+03 -0.43601E+03 -0.41386E+02 11463 0.182E+01 0.150E+02
RMM: 8 -0.476735312109E+03 0.35467E+03 -0.98071E+01 9981 0.108E+01 0.868E+01
RMM: 9 -0.426875920627E+03 0.49859E+02 -0.70051E+01 10274 0.109E+01 0.645E+01
RMM: 10 -0.368761613768E+03 0.58114E+02 -0.31929E+01 10296 0.717E+00 0.282E+01
RMM: 11 -0.365981803255E+03 0.27798E+01 -0.17546E+01 10282 0.511E+00 0.270E+01
RMM: 12 -0.366635220135E+03 -0.65342E+00 -0.54243E+00 10217 0.288E+00 0.221E+01
RMM: 13 -0.369721745099E+03 -0.30865E+01 -0.31685E+00 10260 0.240E+00 0.165E+01
RMM: 14 -0.371047327586E+03 -0.13256E+01 -0.13878E+00 10054 0.158E+00 0.122E+01
RMM: 15 -0.374617964764E+03 -0.35706E+01 -0.98641E-01 10256 0.130E+00 0.106E+01
RMM: 16 -0.385155905508E+03 -0.10538E+02 -0.28941E+00 11933 0.209E+00 0.135E+01
RMM: 17 -0.387619071187E+03 -0.24632E+01 -0.13183E+00 10950 0.139E+00 0.114E+01
RMM: 18 -0.389501210605E+03 -0.18821E+01 -0.69665E-01 10535 0.971E-01 0.746E+00
RMM: 19 -0.391920836526E+03 -0.24196E+01 -0.36771E-01 10630 0.677E-01 0.611E+00
RMM: 20 -0.393546046933E+03 -0.16252E+01 -0.21670E-01 10583 0.550E-01 0.596E+00
RMM: 21 -0.397083204352E+03 -0.35372E+01 -0.10130E+00 12321 0.107E+00 0.695E+00
RMM: 22 -0.400623978828E+03 -0.35408E+01 -0.12487E+00 12665 0.108E+00 0.643E+00
RMM: 23 -0.404580387926E+03 -0.39564E+01 -0.13354E+00 12847 0.104E+00 0.586E+00
RMM: 24 -0.406988611375E+03 -0.24082E+01 -0.60598E-01 11994 0.713E-01 0.593E+00
RMM: 25 -0.408626136163E+03 -0.16375E+01 -0.42900E-01 11774 0.591E-01 0.638E+00
RMM: 26 -0.408581038507E+03 0.45098E-01 -0.26853E-02 10592 0.169E-01 0.639E+00
RMM: 27 -0.407990674433E+03 0.59036E+00 -0.46449E-02 10635 0.253E-01 0.677E+00
RMM: 28 -0.407554351356E+03 0.43632E+00 -0.15048E-02 10307 0.146E-01 0.641E+00
RMM: 29 -0.408023224284E+03 -0.46887E+00 -0.27628E-01 15228 0.619E-01 0.773E+00
RMM: 30 -0.407117730732E+03 0.90549E+00 -0.15923E-01 14411 0.479E-01 0.762E+00
RMM: 31 -0.407697257026E+03 -0.57953E+00 -0.49726E-03 10418 0.104E-01 0.752E+00
RMM: 32 -0.409848604723E+03 -0.21513E+01 -0.68677E-01 16831 0.848E-01 0.666E+00
RMM: 33 -0.410757420278E+03 -0.90882E+00 -0.14435E-01 15272 0.398E-01 0.669E+00
RMM: 34 -0.411667593523E+03 -0.91017E+00 -0.25164E-01 15904 0.498E-01 0.687E+00
RMM: 35 -0.412095884663E+03 -0.42829E+00 -0.57047E-02 13955 0.280E-01 0.608E+00
RMM: 36 -0.412253263611E+03 -0.15738E+00 -0.69783E-03 10665 0.105E-01 0.564E+00
RMM: 37 -0.412331338257E+03 -0.78075E-01 -0.12070E-02 11123 0.139E-01 0.467E+00
RMM: 38 -0.412534694729E+03 -0.20336E+00 -0.22251E-02 12240 0.184E-01 0.291E+00
RMM: 39 -0.412721087692E+03 -0.18639E+00 -0.18674E-02 11843 0.160E-01 0.256E+00
RMM: 40 -0.412762275215E+03 -0.41188E-01 -0.19705E-02 11589 0.145E-01 0.210E+00
RMM: 41 -0.412826737761E+03 -0.64463E-01 -0.33402E-02 12783 0.189E-01 0.162E+00
RMM: 42 -0.412924444451E+03 -0.97707E-01 -0.66585E-03 10746 0.106E-01 0.143E+00
RMM: 43 -0.413018444987E+03 -0.94001E-01 -0.44861E-03 10444 0.863E-02 0.113E+00
RMM: 44 -0.413178580991E+03 -0.16014E+00 -0.90167E-03 11105 0.113E-01 0.748E-01
RMM: 45 -0.413327673997E+03 -0.14909E+00 -0.59517E-03 10810 0.838E-02 0.700E-01
RMM: 46 -0.413467980754E+03 -0.14031E+00 -0.37496E-03 10845 0.675E-02 0.634E-01
RMM: 47 -0.413554328284E+03 -0.86348E-01 -0.71500E-03 11844 0.840E-02 0.446E-01
RMM: 48 -0.413613623415E+03 -0.59295E-01 -0.43044E-03 11386 0.636E-02 0.390E-01
RMM: 49 -0.413672774340E+03 -0.59151E-01 -0.57041E-03 11862 0.692E-02 0.381E-01
RMM: 50 -0.413751399222E+03 -0.78625E-01 -0.97934E-03 12650 0.861E-02 0.493E-01
RMM: 51 -0.413801500521E+03 -0.50101E-01 -0.27693E-03 11389 0.547E-02 0.386E-01
RMM: 52 -0.413838464394E+03 -0.36964E-01 -0.17218E-03 10973 0.392E-02 0.386E-01
RMM: 53 -0.413874773851E+03 -0.36309E-01 -0.12860E-03 11089 0.326E-02 0.335E-01
RMM: 54 -0.413914896330E+03 -0.40122E-01 -0.90116E-04 11185 0.277E-02 0.274E-01
RMM: 55 -0.413942668017E+03 -0.27772E-01 -0.51401E-04 10959 0.237E-02 0.229E-01
RMM: 56 -0.413982658201E+03 -0.39990E-01 -0.58901E-04 11439 0.241E-02 0.187E-01
RMM: 57 -0.414010224774E+03 -0.27567E-01 -0.33884E-04 10745 0.173E-02 0.146E-01
RMM: 58 -0.414024841529E+03 -0.14617E-01 -0.20357E-04 10207 0.136E-02 0.981E-02
RMM: 59 -0.414034309646E+03 -0.94681E-02 -0.21086E-04 10581 0.128E-02 0.575E-02
RMM: 60 -0.414039079688E+03 -0.47700E-02 -0.10434E-04 9688 0.985E-03 0.354E-02
RMM: 61 -0.414041700321E+03 -0.26206E-02 -0.61754E-05 8905 0.785E-03 0.264E-02
RMM: 62 -0.414043888154E+03 -0.21878E-02 -0.49886E-05 8449 0.646E-03 0.188E-02
RMM: 63 -0.414044949934E+03 -0.10618E-02 -0.21557E-05 7297 0.421E-03 0.153E-02
RMM: 64 -0.414045779695E+03 -0.82976E-03 -0.16218E-05 7039 0.345E-03 0.105E-02
RMM: 65 -0.414046358689E+03 -0.57899E-03 -0.87060E-06 6471 0.251E-03 0.719E-03
RMM: 66 -0.414046639227E+03 -0.28054E-03 -0.52563E-06 5775 0.191E-03 0.846E-03
RMM: 67 -0.414046764372E+03 -0.12514E-03 -0.26464E-06 4777 0.141E-03 0.672E-03
RMM: 68 -0.414046827967E+03 -0.63595E-04 -0.17218E-06 4608 0.125E-03 0.949E-03
RMM: 69 -0.414046844263E+03 -0.16296E-04 -0.42647E-07 3021 0.904E-04 0.797E-03
RMM: 70 -0.414046861278E+03 -0.17015E-04 -0.61737E-07 3456 0.996E-04 0.400E-03
RMM: 71 -0.414046898234E+03 -0.36956E-04 -0.90251E-07 3909 0.107E-03 0.190E-03
RMM: 72 -0.414046923048E+03 -0.24814E-04 -0.72943E-07 3696 0.999E-04 0.239E-03
RMM: 73 -0.414046934347E+03 -0.11298E-04 -0.29762E-07 2967 0.880E-04 0.197E-03
RMM: 74 -0.414046942151E+03 -0.78040E-05 -0.34630E-07 3055 0.907E-04
1 F= -.45179069E+03 E0= -.45179014E+03 d E =-.163327E-02 mag= -0.0003