iterations/neb1_max2_image04_iter17_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421960160066E+04 0.42196E+04 -0.25378E+05 8992 0.103E+03
DAV: 2 -0.102637951234E+03 -0.43222E+04 -0.39194E+04 10984 0.248E+02
DAV: 3 -0.425785107057E+03 -0.32315E+03 -0.30205E+03 10224 0.656E+01
DAV: 4 -0.434502042037E+03 -0.87169E+01 -0.86028E+01 10832 0.108E+01
DAV: 5 -0.434795465916E+03 -0.29342E+00 -0.29267E+00 11040 0.194E+00 0.970E+01
RMM: 6 -0.388753217816E+03 0.46042E+02 -0.10910E+02 9690 0.144E+01 0.763E+01
RMM: 7 -0.790976480855E+03 -0.40222E+03 -0.38809E+02 11236 0.183E+01 0.149E+02
RMM: 8 -0.481892858546E+03 0.30908E+03 -0.99566E+01 9984 0.106E+01 0.852E+01
RMM: 9 -0.419599150267E+03 0.62294E+02 -0.72187E+01 10257 0.110E+01 0.605E+01
RMM: 10 -0.365095705103E+03 0.54503E+02 -0.29518E+01 10238 0.701E+00 0.224E+01
RMM: 11 -0.369284732322E+03 -0.41890E+01 -0.12506E+01 10208 0.437E+00 0.192E+01
RMM: 12 -0.370582453902E+03 -0.12977E+01 -0.35988E+00 10304 0.235E+00 0.156E+01
RMM: 13 -0.372928577058E+03 -0.23461E+01 -0.22691E+00 10172 0.201E+00 0.124E+01
RMM: 14 -0.378761277115E+03 -0.58327E+01 -0.21082E+00 10328 0.182E+00 0.128E+01
RMM: 15 -0.381582377890E+03 -0.28211E+01 -0.13061E+00 10328 0.142E+00 0.938E+00
RMM: 16 -0.387200968617E+03 -0.56186E+01 -0.13145E+00 10837 0.134E+00 0.822E+00
RMM: 17 -0.390002981658E+03 -0.28020E+01 -0.56538E-01 10352 0.962E-01 0.620E+00
RMM: 18 -0.394461477791E+03 -0.44585E+01 -0.11892E+00 11341 0.115E+00 0.620E+00
RMM: 19 -0.397179880720E+03 -0.27184E+01 -0.78778E-01 11412 0.943E-01 0.617E+00
RMM: 20 -0.401281318082E+03 -0.41014E+01 -0.14113E+00 12220 0.114E+00 0.512E+00
RMM: 21 -0.405149931386E+03 -0.38686E+01 -0.11003E+00 12059 0.993E-01 0.442E+00
RMM: 22 -0.409871134044E+03 -0.47212E+01 -0.22863E+00 13230 0.132E+00 0.542E+00
RMM: 23 -0.411062637718E+03 -0.11915E+01 -0.52146E-01 11643 0.647E-01 0.541E+00
RMM: 24 -0.410895831683E+03 0.16681E+00 -0.27059E-02 10787 0.173E-01 0.533E+00
RMM: 25 -0.410694024594E+03 0.20181E+00 -0.86596E-03 10196 0.110E-01 0.527E+00
RMM: 26 -0.410105009874E+03 0.58901E+00 -0.13697E-01 13409 0.424E-01 0.484E+00
RMM: 27 -0.410214552807E+03 -0.10954E+00 -0.17267E-01 14526 0.494E-01 0.473E+00
RMM: 28 -0.409920331637E+03 0.29422E+00 -0.13130E-01 14112 0.451E-01 0.605E+00
RMM: 29 -0.410236227041E+03 -0.31590E+00 -0.41283E-03 10331 0.913E-02 0.591E+00
RMM: 30 -0.411519939125E+03 -0.12837E+01 -0.47557E-01 16633 0.726E-01 0.500E+00
RMM: 31 -0.412384176036E+03 -0.86424E+00 -0.29976E-01 16213 0.557E-01 0.543E+00
RMM: 32 -0.413038063704E+03 -0.65389E+00 -0.28546E-01 16086 0.560E-01 0.457E+00
RMM: 33 -0.413675170733E+03 -0.63711E+00 -0.41281E-02 13568 0.247E-01 0.309E+00
RMM: 34 -0.413816568798E+03 -0.14140E+00 -0.19400E-03 10357 0.584E-02 0.290E+00
RMM: 35 -0.413986235329E+03 -0.16967E+00 -0.81084E-03 11955 0.116E-01 0.273E+00
RMM: 36 -0.414323188520E+03 -0.33695E+00 -0.26246E-02 14405 0.205E-01 0.206E+00
RMM: 37 -0.414486562371E+03 -0.16337E+00 -0.17719E-02 13584 0.162E-01 0.143E+00
RMM: 38 -0.414672016447E+03 -0.18545E+00 -0.12001E-02 12809 0.129E-01 0.108E+00
RMM: 39 -0.414784981026E+03 -0.11296E+00 -0.62759E-03 11970 0.933E-02 0.907E-01
RMM: 40 -0.414891715972E+03 -0.10673E+00 -0.76700E-03 12171 0.990E-02 0.741E-01
RMM: 41 -0.414995063238E+03 -0.10335E+00 -0.10618E-02 12407 0.110E-01 0.480E-01
RMM: 42 -0.415108012029E+03 -0.11295E+00 -0.12114E-02 12442 0.106E-01 0.480E-01
RMM: 43 -0.415213620617E+03 -0.10561E+00 -0.13299E-02 12535 0.102E-01 0.399E-01
RMM: 44 -0.415304274418E+03 -0.90654E-01 -0.11008E-02 12290 0.883E-02 0.410E-01
RMM: 45 -0.415368236058E+03 -0.63962E-01 -0.54647E-03 11544 0.629E-02 0.342E-01
RMM: 46 -0.415417692625E+03 -0.49457E-01 -0.34228E-03 11375 0.493E-02 0.258E-01
RMM: 47 -0.415452272378E+03 -0.34580E-01 -0.16043E-03 11029 0.357E-02 0.165E-01
RMM: 48 -0.415494234905E+03 -0.41963E-01 -0.94183E-04 10977 0.268E-02 0.126E-01
RMM: 49 -0.415536204586E+03 -0.41970E-01 -0.57340E-04 10991 0.212E-02 0.944E-02
RMM: 50 -0.415566121579E+03 -0.29917E-01 -0.32062E-04 10671 0.155E-02 0.819E-02
RMM: 51 -0.415571880395E+03 -0.57588E-02 -0.26165E-04 11135 0.146E-02 0.699E-02
RMM: 52 -0.415578766538E+03 -0.68861E-02 -0.72688E-05 9138 0.878E-03 0.430E-02
RMM: 53 -0.415581222514E+03 -0.24560E-02 -0.40276E-05 8253 0.607E-03 0.380E-02
RMM: 54 -0.415582115914E+03 -0.89340E-03 -0.17267E-05 6985 0.426E-03 0.317E-02
RMM: 55 -0.415582693379E+03 -0.57747E-03 -0.11806E-05 6697 0.354E-03 0.248E-02
RMM: 56 -0.415583001034E+03 -0.30766E-03 -0.11654E-05 6676 0.349E-03 0.131E-02
RMM: 57 -0.415583451175E+03 -0.45014E-03 -0.39737E-06 6161 0.204E-03 0.130E-02
RMM: 58 -0.415583708483E+03 -0.25731E-03 -0.24673E-06 6032 0.165E-03 0.907E-03
RMM: 59 -0.415584015445E+03 -0.30696E-03 -0.32867E-06 5333 0.156E-03 0.803E-03
RMM: 60 -0.415584131379E+03 -0.11593E-03 -0.33204E-06 5889 0.168E-03 0.260E-02
RMM: 61 -0.415584118443E+03 0.12936E-04 -0.82374E-07 3893 0.112E-03 0.327E-02
RMM: 62 -0.415584140736E+03 -0.22293E-04 -0.80126E-07 4082 0.110E-03 0.414E-02
RMM: 63 -0.415584136124E+03 0.46121E-05 -0.14181E-07 2769 0.850E-04
1 F= -.45329079E+03 E0= -.45329029E+03 d E =-.150433E-02 mag= -0.0076