iterations/neb0_image01_iter1_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.425624887197E+04 0.42562E+04 -0.25415E+05 9032 0.103E+03
DAV: 2 -0.954338225370E+02 -0.43517E+04 -0.39557E+04 10992 0.249E+02
DAV: 3 -0.420387406195E+03 -0.32495E+03 -0.30377E+03 10240 0.658E+01
DAV: 4 -0.428872608975E+03 -0.84852E+01 -0.83860E+01 11000 0.106E+01
DAV: 5 -0.429167692715E+03 -0.29508E+00 -0.29401E+00 11320 0.189E+00 0.112E+02
RMM: 6 -0.375806680403E+03 0.53361E+02 -0.10733E+02 9699 0.142E+01 0.742E+01
RMM: 7 -0.881798228410E+03 -0.50599E+03 -0.60989E+02 11785 0.223E+01 0.159E+02
RMM: 8 -0.513439113189E+03 0.36836E+03 -0.13922E+02 10061 0.124E+01 0.979E+01
RMM: 9 -0.403647370472E+03 0.10979E+03 -0.76801E+01 10179 0.112E+01 0.555E+01
RMM: 10 -0.397184617141E+03 0.64628E+01 -0.49593E+01 10279 0.906E+00 0.511E+01
RMM: 11 -0.368421514017E+03 0.28763E+02 -0.23620E+01 10255 0.602E+00 0.357E+01
RMM: 12 -0.367530556497E+03 0.89096E+00 -0.75316E+00 10072 0.367E+00 0.274E+01
RMM: 13 -0.365001736867E+03 0.25288E+01 -0.46963E+00 10304 0.252E+00 0.208E+01
RMM: 14 -0.364934144480E+03 0.67592E-01 -0.12630E+00 10209 0.149E+00 0.139E+01
RMM: 15 -0.369469567736E+03 -0.45354E+01 -0.83201E-01 10259 0.119E+00 0.110E+01
RMM: 16 -0.375046731827E+03 -0.55772E+01 -0.14481E+00 11028 0.159E+00 0.109E+01
RMM: 17 -0.380986571629E+03 -0.59398E+01 -0.19951E+00 11495 0.170E+00 0.841E+00
RMM: 18 -0.383163721062E+03 -0.21771E+01 -0.56331E-01 10411 0.942E-01 0.691E+00
RMM: 19 -0.385889698784E+03 -0.27260E+01 -0.55795E-01 10842 0.855E-01 0.749E+00
RMM: 20 -0.389463217712E+03 -0.35735E+01 -0.94243E-01 11585 0.990E-01 0.926E+00
RMM: 21 -0.391122751206E+03 -0.16595E+01 -0.69748E-01 11644 0.838E-01 0.877E+00
RMM: 22 -0.395052536385E+03 -0.39298E+01 -0.15559E+00 12896 0.121E+00 0.758E+00
RMM: 23 -0.399052564429E+03 -0.40000E+01 -0.26335E+00 13708 0.145E+00 0.550E+00
RMM: 24 -0.400817634612E+03 -0.17651E+01 -0.36815E-01 11503 0.586E-01 0.541E+00
RMM: 25 -0.400633757453E+03 0.18388E+00 -0.26530E-02 10627 0.180E-01 0.537E+00
RMM: 26 -0.400220329996E+03 0.41343E+00 -0.16053E-02 10231 0.150E-01 0.540E+00
RMM: 27 -0.399713368817E+03 0.50696E+00 -0.41238E-02 11221 0.204E-01 0.543E+00
RMM: 28 -0.399517078836E+03 0.19629E+00 -0.11606E-02 10628 0.114E-01 0.526E+00
RMM: 29 -0.399067374280E+03 0.44970E+00 -0.74280E-02 13298 0.304E-01 0.592E+00
RMM: 30 -0.398784865327E+03 0.28251E+00 -0.62635E-02 13192 0.285E-01 0.649E+00
RMM: 31 -0.399560809990E+03 -0.77594E+00 -0.13382E-01 13675 0.414E-01 0.679E+00
RMM: 32 -0.402387778716E+03 -0.28270E+01 -0.10940E+00 16854 0.102E+00 0.823E+00
RMM: 33 -0.403355452964E+03 -0.96767E+00 -0.26109E-01 15272 0.506E-01 0.736E+00
RMM: 34 -0.404586904114E+03 -0.12315E+01 -0.22894E-01 15138 0.499E-01 0.737E+00
RMM: 35 -0.405588036187E+03 -0.10011E+01 -0.24452E-01 15438 0.485E-01 0.690E+00
RMM: 36 -0.405980357775E+03 -0.39232E+00 -0.23421E-01 15446 0.486E-01 0.582E+00
RMM: 37 -0.406244842718E+03 -0.26448E+00 -0.13319E-01 14899 0.373E-01 0.491E+00
RMM: 38 -0.406435324944E+03 -0.19048E+00 -0.10180E-01 14030 0.329E-01 0.437E+00
RMM: 39 -0.406727879255E+03 -0.29255E+00 -0.38450E-02 12344 0.214E-01 0.411E+00
RMM: 40 -0.407143024624E+03 -0.41515E+00 -0.15858E-02 11138 0.137E-01 0.500E+00
RMM: 41 -0.407436224713E+03 -0.29320E+00 -0.80556E-03 10724 0.113E-01 0.367E+00
RMM: 42 -0.407900538478E+03 -0.46431E+00 -0.42336E-02 12494 0.184E-01 0.503E+00
RMM: 43 -0.408311811849E+03 -0.41127E+00 -0.49303E-02 12315 0.180E-01 0.430E+00
RMM: 44 -0.408461035401E+03 -0.14922E+00 -0.32918E-02 11988 0.148E-01 0.358E+00
RMM: 45 -0.408505300832E+03 -0.44265E-01 -0.12568E-02 11377 0.103E-01 0.312E+00
RMM: 46 -0.408545983505E+03 -0.40683E-01 -0.11259E-02 11718 0.107E-01 0.269E+00
RMM: 47 -0.408584707737E+03 -0.38724E-01 -0.20219E-02 12204 0.119E-01 0.203E+00
RMM: 48 -0.408624120370E+03 -0.39413E-01 -0.11779E-02 11635 0.983E-02 0.166E+00
RMM: 49 -0.408696769531E+03 -0.72649E-01 -0.86715E-03 11878 0.782E-02 0.135E+00
RMM: 50 -0.408760991103E+03 -0.64222E-01 -0.90112E-03 12216 0.787E-02 0.939E-01
RMM: 51 -0.408893820458E+03 -0.13283E+00 -0.30941E-02 14569 0.143E-01 0.331E+00
RMM: 52 -0.408847950619E+03 0.45870E-01 -0.61679E-03 11912 0.864E-02 0.203E+00
RMM: 53 -0.408872547967E+03 -0.24597E-01 -0.57031E-03 11752 0.676E-02 0.413E+00
RMM: 54 -0.408835344127E+03 0.37204E-01 -0.85730E-04 10543 0.473E-02 0.395E+00
RMM: 55 -0.408851552298E+03 -0.16208E-01 -0.76261E-04 10920 0.307E-02 0.408E+00
RMM: 56 -0.408879614473E+03 -0.28062E-01 -0.82337E-03 13835 0.819E-02 0.517E+00
RMM: 57 -0.408844071046E+03 0.35543E-01 -0.36432E-03 12394 0.692E-02 0.206E+00
RMM: 58 -0.408989776740E+03 -0.14571E+00 -0.43451E-03 13527 0.718E-02 0.255E+00
RMM: 59 -0.409011610872E+03 -0.21834E-01 -0.17947E-03 11843 0.389E-02 0.145E+00
RMM: 60 -0.409072851897E+03 -0.61241E-01 -0.15504E-03 12191 0.411E-02 0.857E-01
RMM: 61 -0.409119559801E+03 -0.46708E-01 -0.29011E-03 12721 0.490E-02 0.224E-01
RMM: 62 -0.409174444614E+03 -0.54885E-01 -0.98416E-04 11755 0.345E-02 0.265E-01
RMM: 63 -0.409219356867E+03 -0.44912E-01 -0.85390E-04 11791 0.285E-02 0.373E-01
RMM: 64 -0.409236811308E+03 -0.17454E-01 -0.46717E-04 11327 0.180E-02 0.471E-01
RMM: 65 -0.409238733636E+03 -0.19223E-02 -0.85130E-05 8964 0.102E-02 0.388E-01
RMM: 66 -0.409240594866E+03 -0.18612E-02 -0.12707E-04 9867 0.103E-02 0.266E-01
RMM: 67 -0.409241841855E+03 -0.12470E-02 -0.48705E-05 8246 0.783E-03 0.266E-01
RMM: 68 -0.409241397989E+03 0.44387E-03 -0.15641E-05 6903 0.408E-03 0.214E-01
RMM: 69 -0.409241254603E+03 0.14339E-03 -0.22890E-05 6995 0.448E-03 0.126E-01
RMM: 70 -0.409241637673E+03 -0.38307E-03 -0.34534E-05 7615 0.604E-03 0.682E-02
RMM: 71 -0.409242297004E+03 -0.65933E-03 -0.22153E-05 7122 0.507E-03 0.321E-02
RMM: 72 -0.409242685994E+03 -0.38899E-03 -0.13270E-05 6953 0.367E-03 0.389E-02
RMM: 73 -0.409243011583E+03 -0.32559E-03 -0.82054E-06 6688 0.239E-03 0.284E-02
RMM: 74 -0.409243488747E+03 -0.47716E-03 -0.10210E-05 5968 0.242E-03 0.331E-02
RMM: 75 -0.409243654839E+03 -0.16609E-03 -0.37963E-06 4766 0.164E-03 0.250E-02
RMM: 76 -0.409243684677E+03 -0.29838E-04 -0.19590E-06 4312 0.139E-03 0.246E-02
RMM: 77 -0.409243758269E+03 -0.73592E-04 -0.13458E-06 4056 0.118E-03 0.237E-02
RMM: 78 -0.409243789543E+03 -0.31274E-04 -0.86634E-07 3591 0.106E-03 0.237E-02
RMM: 79 -0.409243807902E+03 -0.18359E-04 -0.97692E-07 3648 0.110E-03 0.246E-02
RMM: 80 -0.409243815543E+03 -0.76407E-05 -0.84087E-07 3469 0.109E-03
1 F= -.44699192E+03 E0= -.44699255E+03 d E =0.187083E-02 mag= -0.0818