iterations/neb1_max2_image01_iter8_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422006296706E+04 0.42201E+04 -0.25380E+05 8992 0.103E+03
DAV: 2 -0.103360597928E+03 -0.43234E+04 -0.39213E+04 10976 0.248E+02
DAV: 3 -0.426881483349E+03 -0.32352E+03 -0.30193E+03 10224 0.656E+01
DAV: 4 -0.435485992362E+03 -0.86045E+01 -0.84993E+01 10792 0.108E+01
DAV: 5 -0.435780133079E+03 -0.29414E+00 -0.29336E+00 11096 0.193E+00 0.984E+01
RMM: 6 -0.390347338985E+03 0.45433E+02 -0.11127E+02 9686 0.146E+01 0.738E+01
RMM: 7 -0.816703351439E+03 -0.42636E+03 -0.43972E+02 11365 0.192E+01 0.151E+02
RMM: 8 -0.490698436940E+03 0.32600E+03 -0.10497E+02 9945 0.109E+01 0.902E+01
RMM: 9 -0.425517131991E+03 0.65181E+02 -0.68575E+01 10200 0.107E+01 0.619E+01
RMM: 10 -0.369535905137E+03 0.55981E+02 -0.36117E+01 10269 0.774E+00 0.273E+01
RMM: 11 -0.382410723625E+03 -0.12875E+02 -0.15341E+01 10387 0.437E+00 0.383E+01
RMM: 12 -0.372278062979E+03 0.10133E+02 -0.44340E+00 9936 0.296E+00 0.207E+01
RMM: 13 -0.371222961473E+03 0.10551E+01 -0.13347E+00 10099 0.160E+00 0.143E+01
RMM: 14 -0.373646506619E+03 -0.24235E+01 -0.87630E-01 10181 0.123E+00 0.122E+01
RMM: 15 -0.382510960123E+03 -0.88645E+01 -0.24728E+00 11763 0.198E+00 0.144E+01
RMM: 16 -0.388410245376E+03 -0.58993E+01 -0.20421E+00 11388 0.173E+00 0.146E+01
RMM: 17 -0.388998587725E+03 -0.58834E+00 -0.98299E-01 10652 0.120E+00 0.876E+00
RMM: 18 -0.392824557922E+03 -0.38260E+01 -0.97836E-01 11067 0.114E+00 0.745E+00
RMM: 19 -0.394801344696E+03 -0.19768E+01 -0.39791E-01 10416 0.802E-01 0.719E+00
RMM: 20 -0.396814013756E+03 -0.20127E+01 -0.40198E-01 10965 0.708E-01 0.727E+00
RMM: 21 -0.399179568107E+03 -0.23656E+01 -0.65691E-01 11732 0.844E-01 0.677E+00
RMM: 22 -0.402871451019E+03 -0.36919E+01 -0.12466E+00 12542 0.105E+00 0.600E+00
RMM: 23 -0.406570901273E+03 -0.36995E+01 -0.12611E+00 12762 0.104E+00 0.532E+00
RMM: 24 -0.409338812831E+03 -0.27679E+01 -0.74347E-01 12140 0.779E-01 0.488E+00
RMM: 25 -0.410750396378E+03 -0.14116E+01 -0.22450E-01 11258 0.447E-01 0.486E+00
RMM: 26 -0.411238762528E+03 -0.48837E+00 -0.39380E-02 10503 0.195E-01 0.486E+00
RMM: 27 -0.411044216812E+03 0.19455E+00 -0.15006E-02 10212 0.146E-01 0.541E+00
RMM: 28 -0.411261686382E+03 -0.21747E+00 -0.62610E-02 11700 0.251E-01 0.924E+00
RMM: 29 -0.410942203272E+03 0.31948E+00 -0.75610E-02 11788 0.263E-01 0.962E+00
RMM: 30 -0.411073800710E+03 -0.13160E+00 -0.11269E-02 10638 0.107E-01 0.971E+00
RMM: 31 -0.411795907711E+03 -0.72211E+00 -0.65268E-02 13197 0.235E-01 0.995E+00
RMM: 32 -0.415498071585E+03 -0.37022E+01 -0.87411E-01 17355 0.797E-01 0.112E+01
RMM: 33 -0.417584482398E+03 -0.20864E+01 -0.53492E-01 16860 0.660E-01 0.118E+01
RMM: 34 -0.417990615995E+03 -0.40613E+00 -0.43388E-01 15606 0.527E-01 0.187E+01
RMM: 35 -0.417897510773E+03 0.93105E-01 -0.12548E-02 11213 0.137E-01 0.184E+01
RMM: 36 -0.417884537937E+03 0.12973E-01 -0.12889E-02 10847 0.107E-01 0.184E+01
RMM: 37 -0.417017657966E+03 0.86688E+00 -0.19246E+00 17786 0.110E+00 0.106E+01
RMM: 38 -0.417368859787E+03 -0.35120E+00 -0.13596E-01 16257 0.374E-01 0.109E+01
RMM: 39 -0.417858882608E+03 -0.49002E+00 -0.35877E-02 13752 0.204E-01 0.112E+01
RMM: 40 -0.418093626562E+03 -0.23474E+00 -0.19464E-02 12216 0.149E-01 0.116E+01
RMM: 41 -0.418086834870E+03 0.67917E-02 -0.51786E-02 13559 0.227E-01 0.123E+01
RMM: 42 -0.417799751302E+03 0.28708E+00 -0.29632E-02 12555 0.169E-01 0.127E+01
RMM: 43 -0.417360796556E+03 0.43895E+00 -0.24803E-02 12395 0.151E-01 0.126E+01
RMM: 44 -0.416902768904E+03 0.45803E+00 -0.20115E-02 11996 0.123E-01 0.122E+01
RMM: 45 -0.416424326384E+03 0.47844E+00 -0.29121E-02 12539 0.140E-01 0.116E+01
RMM: 46 -0.415601539219E+03 0.82279E+00 -0.72109E-02 14376 0.222E-01 0.105E+01
RMM: 47 -0.414693702102E+03 0.90784E+00 -0.11100E-01 15621 0.290E-01 0.661E+00
RMM: 48 -0.415329946156E+03 -0.63624E+00 -0.27415E-02 13256 0.184E-01 0.650E+00
RMM: 49 -0.415293153556E+03 0.36793E-01 -0.68271E-03 11041 0.843E-02 0.592E+00
RMM: 50 -0.415422622211E+03 -0.12947E+00 -0.28623E-02 12803 0.144E-01 0.448E+00
RMM: 51 -0.415488250071E+03 -0.65628E-01 -0.43333E-02 15086 0.225E-01 0.453E+00
RMM: 52 -0.415614902112E+03 -0.12665E+00 -0.19995E-02 12992 0.135E-01 0.343E+00
RMM: 53 -0.415765278804E+03 -0.15038E+00 -0.35295E-02 13824 0.164E-01 0.199E+00
RMM: 54 -0.415961999445E+03 -0.19672E+00 -0.28171E-02 13489 0.150E-01 0.119E+00
RMM: 55 -0.416143893083E+03 -0.18189E+00 -0.91494E-03 12109 0.985E-02 0.149E+00
RMM: 56 -0.416269378291E+03 -0.12549E+00 -0.97167E-03 11995 0.102E-01 0.157E+00
RMM: 57 -0.416269213157E+03 0.16513E-03 -0.43360E-03 11136 0.646E-02 0.131E+00
RMM: 58 -0.416301793310E+03 -0.32580E-01 -0.47141E-03 11397 0.604E-02 0.105E+00
RMM: 59 -0.416325203711E+03 -0.23410E-01 -0.38161E-03 11597 0.570E-02 0.817E-01
RMM: 60 -0.416351042915E+03 -0.25839E-01 -0.90704E-03 12887 0.773E-02 0.629E-01
RMM: 61 -0.416380503585E+03 -0.29461E-01 -0.83242E-03 13136 0.780E-02 0.562E-01
RMM: 62 -0.416442401211E+03 -0.61898E-01 -0.20085E-02 14635 0.119E-01 0.404E-01
RMM: 63 -0.416495314522E+03 -0.52913E-01 -0.16049E-03 11242 0.417E-02 0.291E-01
RMM: 64 -0.416534766085E+03 -0.39452E-01 -0.14439E-03 11225 0.375E-02 0.302E-01
RMM: 65 -0.416561057939E+03 -0.26292E-01 -0.92078E-04 11200 0.297E-02 0.312E-01
RMM: 66 -0.416578278131E+03 -0.17220E-01 -0.40543E-04 10750 0.205E-02 0.260E-01
RMM: 67 -0.416592711478E+03 -0.14433E-01 -0.38536E-04 11009 0.162E-02 0.244E-01
RMM: 68 -0.416597770422E+03 -0.50589E-02 -0.20167E-04 10186 0.122E-02 0.227E-01
RMM: 69 -0.416601469796E+03 -0.36994E-02 -0.23613E-04 10686 0.124E-02 0.217E-01
RMM: 70 -0.416602957455E+03 -0.14877E-02 -0.12457E-04 9770 0.916E-03 0.208E-01
RMM: 71 -0.416601128281E+03 0.18292E-02 -0.72157E-04 12912 0.235E-02 0.202E-01
RMM: 72 -0.416600827236E+03 0.30105E-03 -0.20250E-05 7077 0.487E-03 0.190E-01
RMM: 73 -0.416600703067E+03 0.12417E-03 -0.83295E-06 6408 0.291E-03 0.180E-01
RMM: 74 -0.416600219958E+03 0.48311E-03 -0.23360E-05 6995 0.413E-03 0.165E-01
RMM: 75 -0.416599818847E+03 0.40111E-03 -0.31471E-05 7337 0.505E-03 0.149E-01
RMM: 76 -0.416599322040E+03 0.49681E-03 -0.62252E-05 8785 0.810E-03 0.139E-01
RMM: 77 -0.416599192554E+03 0.12949E-03 -0.18457E-05 6831 0.441E-03 0.130E-01
RMM: 78 -0.416598940593E+03 0.25196E-03 -0.29441E-05 7067 0.466E-03 0.122E-01
RMM: 79 -0.416598688797E+03 0.25180E-03 -0.46557E-05 7858 0.509E-03 0.111E-01
RMM: 80 -0.416598566335E+03 0.12246E-03 -0.37511E-05 7519 0.468E-03 0.995E-02
RMM: 81 -0.416598262852E+03 0.30348E-03 -0.33320E-05 7381 0.445E-03 0.903E-02
RMM: 82 -0.416598196593E+03 0.66259E-04 -0.11065E-05 6172 0.283E-03 0.860E-02
RMM: 83 -0.416598139895E+03 0.56698E-04 -0.22530E-05 7093 0.363E-03 0.797E-02
RMM: 84 -0.416598084081E+03 0.55814E-04 -0.66391E-06 5549 0.221E-03 0.748E-02
RMM: 85 -0.416597991717E+03 0.92364E-04 -0.12317E-05 6364 0.275E-03 0.676E-02
RMM: 86 -0.416597914442E+03 0.77275E-04 -0.32594E-05 7246 0.416E-03 0.572E-02
RMM: 87 -0.416597914643E+03 -0.20098E-06 -0.18050E-05 6712 0.337E-03
1 F= -.45430032E+03 E0= -.45430011E+03 d E =-.642821E-03 mag= -0.0180