iterations/neb2_max1_image03_iter3_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421984525700E+04 0.42198E+04 -0.25385E+05 9008 0.103E+03
DAV: 2 -0.105051669938E+03 -0.43249E+04 -0.39264E+04 11000 0.248E+02
DAV: 3 -0.426681268567E+03 -0.32163E+03 -0.30108E+03 10272 0.655E+01
DAV: 4 -0.435226244062E+03 -0.85450E+01 -0.84273E+01 10896 0.107E+01
DAV: 5 -0.435511824660E+03 -0.28558E+00 -0.28493E+00 11280 0.189E+00 0.101E+02
RMM: 6 -0.388430484954E+03 0.47081E+02 -0.10773E+02 9697 0.143E+01 0.725E+01
RMM: 7 -0.802034379642E+03 -0.41360E+03 -0.45037E+02 11372 0.194E+01 0.149E+02
RMM: 8 -0.499172285286E+03 0.30286E+03 -0.11909E+02 10048 0.115E+01 0.918E+01
RMM: 9 -0.409931975320E+03 0.89240E+02 -0.68132E+01 10165 0.107E+01 0.548E+01
RMM: 10 -0.400498054879E+03 0.94339E+01 -0.44626E+01 10354 0.871E+00 0.476E+01
RMM: 11 -0.385904630093E+03 0.14593E+02 -0.24100E+01 10258 0.594E+00 0.437E+01
RMM: 12 -0.374171781055E+03 0.11733E+02 -0.76882E+00 9983 0.373E+00 0.273E+01
RMM: 13 -0.374600907098E+03 -0.42913E+00 -0.34600E+00 10153 0.249E+00 0.227E+01
RMM: 14 -0.373867970281E+03 0.73294E+00 -0.12884E+00 10119 0.152E+00 0.145E+01
RMM: 15 -0.377806144290E+03 -0.39382E+01 -0.13601E+00 10440 0.151E+00 0.122E+01
RMM: 16 -0.383256481897E+03 -0.54503E+01 -0.13266E+00 10535 0.152E+00 0.134E+01
RMM: 17 -0.388092461238E+03 -0.48360E+01 -0.19854E+00 11156 0.168E+00 0.984E+00
RMM: 18 -0.390930712222E+03 -0.28383E+01 -0.68332E-01 10392 0.102E+00 0.666E+00
RMM: 19 -0.394225339927E+03 -0.32946E+01 -0.58052E-01 10729 0.901E-01 0.719E+00
RMM: 20 -0.396707720081E+03 -0.24824E+01 -0.63648E-01 11196 0.928E-01 0.744E+00
RMM: 21 -0.400066325993E+03 -0.33586E+01 -0.10905E+00 11957 0.108E+00 0.694E+00
RMM: 22 -0.403265140407E+03 -0.31988E+01 -0.10431E+00 12171 0.101E+00 0.605E+00
RMM: 23 -0.407872125147E+03 -0.46070E+01 -0.19744E+00 12983 0.125E+00 0.641E+00
RMM: 24 -0.409872836957E+03 -0.20007E+01 -0.74977E-01 11984 0.785E-01 0.641E+00
RMM: 25 -0.410494842581E+03 -0.62201E+00 -0.11841E-01 10789 0.327E-01 0.601E+00
RMM: 26 -0.410179578749E+03 0.31526E+00 -0.33749E-02 10229 0.208E-01 0.577E+00
RMM: 27 -0.409802543827E+03 0.37703E+00 -0.52761E-02 10754 0.236E-01 0.545E+00
RMM: 28 -0.409484925514E+03 0.31762E+00 -0.10647E-01 12037 0.381E-01 0.618E+00
RMM: 29 -0.408811333496E+03 0.67359E+00 -0.15258E-01 12602 0.492E-01 0.672E+00
RMM: 30 -0.410047180116E+03 -0.12358E+01 -0.20796E-01 12533 0.558E-01 0.674E+00
RMM: 31 -0.412329154496E+03 -0.22820E+01 -0.12439E+00 15638 0.107E+00 0.808E+00
RMM: 32 -0.413574622652E+03 -0.12455E+01 -0.46016E-01 14771 0.669E-01 0.519E+00
RMM: 33 -0.414956805461E+03 -0.13822E+01 -0.25028E-01 13587 0.504E-01 0.372E+00
RMM: 34 -0.415257031946E+03 -0.30023E+00 -0.22616E-02 10593 0.208E-01 0.311E+00
RMM: 35 -0.415705187807E+03 -0.44816E+00 -0.67066E-02 11711 0.327E-01 0.275E+00
RMM: 36 -0.416115961280E+03 -0.41077E+00 -0.61746E-02 11820 0.288E-01 0.222E+00
RMM: 37 -0.416363331591E+03 -0.24737E+00 -0.24390E-02 10834 0.190E-01 0.209E+00
RMM: 38 -0.416564694181E+03 -0.20136E+00 -0.18661E-02 10649 0.165E-01 0.196E+00
RMM: 39 -0.416639703551E+03 -0.75009E-01 -0.11289E-02 10521 0.120E-01 0.166E+00
RMM: 40 -0.416778798460E+03 -0.13909E+00 -0.13943E-02 11146 0.127E-01 0.118E+00
RMM: 41 -0.416925051858E+03 -0.14625E+00 -0.13672E-02 11415 0.124E-01 0.899E-01
RMM: 42 -0.417041600165E+03 -0.11655E+00 -0.71142E-03 10903 0.877E-02 0.838E-01
RMM: 43 -0.417122081666E+03 -0.80482E-01 -0.47875E-03 10791 0.723E-02 0.772E-01
RMM: 44 -0.417201309135E+03 -0.79227E-01 -0.65128E-03 11488 0.831E-02 0.562E-01
RMM: 45 -0.417243983299E+03 -0.42674E-01 -0.65413E-03 11649 0.808E-02 0.492E-01
RMM: 46 -0.417209721396E+03 0.34262E-01 -0.14258E-02 12785 0.106E-01 0.772E-01
RMM: 47 -0.417241030652E+03 -0.31309E-01 -0.32762E-03 11014 0.621E-02 0.508E-01
RMM: 48 -0.417343748029E+03 -0.10272E+00 -0.26185E-03 10977 0.539E-02 0.271E-01
RMM: 49 -0.417445826974E+03 -0.10208E+00 -0.34821E-03 11400 0.542E-02 0.235E-01
RMM: 50 -0.417505552738E+03 -0.59726E-01 -0.28047E-03 11406 0.451E-02 0.190E-01
RMM: 51 -0.417526183786E+03 -0.20631E-01 -0.20402E-03 11470 0.404E-02 0.127E-01
RMM: 52 -0.417549741437E+03 -0.23558E-01 -0.62796E-04 10773 0.244E-02 0.129E-01
RMM: 53 -0.417589352074E+03 -0.39611E-01 -0.68565E-04 11166 0.230E-02 0.165E-01
RMM: 54 -0.417626202341E+03 -0.36850E-01 -0.28070E-04 10673 0.160E-02 0.133E-01
RMM: 55 -0.417657557152E+03 -0.31355E-01 -0.22408E-04 10702 0.134E-02 0.922E-02
RMM: 56 -0.417660893715E+03 -0.33366E-02 -0.91434E-05 10004 0.108E-02 0.510E-02
RMM: 57 -0.417673947700E+03 -0.13054E-01 -0.10647E-04 9663 0.991E-03 0.373E-02
RMM: 58 -0.417679426382E+03 -0.54787E-02 -0.79685E-05 9027 0.788E-03 0.244E-02
RMM: 59 -0.417681197746E+03 -0.17714E-02 -0.38696E-05 8017 0.572E-03 0.185E-02
RMM: 60 -0.417682153918E+03 -0.95617E-03 -0.25525E-05 7479 0.424E-03 0.115E-02
RMM: 61 -0.417682588885E+03 -0.43497E-03 -0.12284E-05 6852 0.308E-03 0.120E-02
RMM: 62 -0.417682988661E+03 -0.39978E-03 -0.63509E-06 6219 0.215E-03 0.715E-03
RMM: 63 -0.417683287202E+03 -0.29854E-03 -0.71835E-06 6238 0.203E-03 0.586E-03
RMM: 64 -0.417683396140E+03 -0.10894E-03 -0.19318E-06 4263 0.132E-03 0.277E-03
RMM: 65 -0.417683484869E+03 -0.88729E-04 -0.12542E-06 3697 0.113E-03 0.404E-03
RMM: 66 -0.417683543716E+03 -0.58847E-04 -0.12072E-06 3811 0.110E-03 0.322E-03
RMM: 67 -0.417683565580E+03 -0.21864E-04 -0.52931E-07 3143 0.965E-04 0.238E-03
RMM: 68 -0.417683576768E+03 -0.11187E-04 -0.42587E-07 3189 0.950E-04 0.177E-03
RMM: 69 -0.417683580240E+03 -0.34725E-05 -0.41755E-07 3234 0.941E-04
1 F= -.45533437E+03 E0= -.45533497E+03 d E =0.180140E-02 mag= 0.0008