iterations/neb3_max1_image04_iter8_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421846088294E+04 0.42185E+04 -0.25384E+05 9008 0.103E+03
DAV: 2 -0.104643835042E+03 -0.43231E+04 -0.39308E+04 11032 0.248E+02
DAV: 3 -0.425902244688E+03 -0.32126E+03 -0.30078E+03 10264 0.654E+01
DAV: 4 -0.434522786729E+03 -0.86205E+01 -0.84799E+01 10848 0.107E+01
DAV: 5 -0.434816685469E+03 -0.29390E+00 -0.29322E+00 11152 0.194E+00 0.994E+01
RMM: 6 -0.391339583969E+03 0.43477E+02 -0.10583E+02 9680 0.141E+01 0.769E+01
RMM: 7 -0.846930450041E+03 -0.45559E+03 -0.45756E+02 11452 0.192E+01 0.151E+02
RMM: 8 -0.492575548038E+03 0.35435E+03 -0.11738E+02 9983 0.116E+01 0.892E+01
RMM: 9 -0.411894703561E+03 0.80681E+02 -0.72887E+01 10200 0.111E+01 0.576E+01
RMM: 10 -0.385518419616E+03 0.26376E+02 -0.33899E+01 10187 0.765E+00 0.395E+01
RMM: 11 -0.378308748770E+03 0.72097E+01 -0.19492E+01 10284 0.533E+00 0.371E+01
RMM: 12 -0.375300372672E+03 0.30084E+01 -0.66912E+00 10062 0.349E+00 0.270E+01
RMM: 13 -0.372878341878E+03 0.24220E+01 -0.30755E+00 10166 0.230E+00 0.217E+01
RMM: 14 -0.372312958017E+03 0.56538E+00 -0.14113E+00 10227 0.157E+00 0.141E+01
RMM: 15 -0.378876630935E+03 -0.65637E+01 -0.19161E+00 10643 0.181E+00 0.155E+01
RMM: 16 -0.382851424622E+03 -0.39748E+01 -0.18058E+00 10604 0.175E+00 0.104E+01
RMM: 17 -0.387817272204E+03 -0.49658E+01 -0.16540E+00 10907 0.155E+00 0.926E+00
RMM: 18 -0.391025024265E+03 -0.32078E+01 -0.65563E-01 10364 0.101E+00 0.109E+01
RMM: 19 -0.389338785106E+03 0.16862E+01 -0.12356E-01 10316 0.414E-01 0.749E+00
RMM: 20 -0.394868710873E+03 -0.55299E+01 -0.93348E-01 12313 0.108E+00 0.139E+01
RMM: 21 -0.396530902440E+03 -0.16622E+01 -0.93524E-01 12264 0.103E+00 0.111E+01
RMM: 22 -0.399042816374E+03 -0.25119E+01 -0.64928E-01 11957 0.824E-01 0.903E+00
RMM: 23 -0.401188550776E+03 -0.21457E+01 -0.25446E-01 11349 0.516E-01 0.839E+00
RMM: 24 -0.404722951969E+03 -0.35344E+01 -0.10387E+00 13294 0.955E-01 0.849E+00
RMM: 25 -0.408863983825E+03 -0.41410E+01 -0.21384E+00 14189 0.126E+00 0.779E+00
RMM: 26 -0.409665887404E+03 -0.80190E+00 -0.11639E-01 11174 0.341E-01 0.827E+00
RMM: 27 -0.409858176445E+03 -0.19229E+00 -0.30094E-02 10514 0.198E-01 0.770E+00
RMM: 28 -0.410269747268E+03 -0.41157E+00 -0.17948E-01 12722 0.390E-01 0.102E+01
RMM: 29 -0.409744407282E+03 0.52534E+00 -0.13664E-01 11670 0.336E-01 0.117E+01
RMM: 30 -0.408887323201E+03 0.85708E+00 -0.14571E-01 11691 0.352E-01 0.128E+01
RMM: 31 -0.407698856688E+03 0.11885E+01 -0.20701E-01 12549 0.423E-01 0.137E+01
RMM: 32 -0.406497046621E+03 0.12018E+01 -0.22632E-01 12832 0.446E-01 0.146E+01
RMM: 33 -0.406841348331E+03 -0.34430E+00 -0.27590E-02 10547 0.178E-01 0.142E+01
RMM: 34 -0.410338929462E+03 -0.34976E+01 -0.12655E+00 16236 0.104E+00 0.869E+00
RMM: 35 -0.412374327228E+03 -0.20354E+01 -0.31116E-01 15168 0.539E-01 0.860E+00
RMM: 36 -0.413897736284E+03 -0.15234E+01 -0.27265E-01 15171 0.522E-01 0.777E+00
RMM: 37 -0.414642072362E+03 -0.74434E+00 -0.13621E-01 13534 0.354E-01 0.728E+00
RMM: 38 -0.414524407913E+03 0.11766E+00 -0.85711E-02 13010 0.319E-01 0.677E+00
RMM: 39 -0.414577261568E+03 -0.52854E-01 -0.12835E-01 13816 0.359E-01 0.563E+00
RMM: 40 -0.414969180148E+03 -0.39192E+00 -0.81185E-02 13164 0.339E-01 0.437E+00
RMM: 41 -0.415186410272E+03 -0.21723E+00 -0.18730E-02 10831 0.163E-01 0.387E+00
RMM: 42 -0.415454433352E+03 -0.26802E+00 -0.39164E-02 11641 0.199E-01 0.294E+00
RMM: 43 -0.415564224434E+03 -0.10979E+00 -0.27640E-02 11492 0.170E-01 0.218E+00
RMM: 44 -0.415690192985E+03 -0.12597E+00 -0.26989E-02 11629 0.162E-01 0.165E+00
RMM: 45 -0.415877640128E+03 -0.18745E+00 -0.18950E-02 11589 0.138E-01 0.135E+00
RMM: 46 -0.416142316616E+03 -0.26468E+00 -0.27062E-02 12282 0.157E-01 0.134E+00
RMM: 47 -0.416264392701E+03 -0.12208E+00 -0.78498E-03 11089 0.893E-02 0.134E+00
RMM: 48 -0.416402599987E+03 -0.13821E+00 -0.19765E-02 12218 0.120E-01 0.103E+00
RMM: 49 -0.416491571272E+03 -0.88971E-01 -0.12857E-02 11812 0.980E-02 0.780E-01
RMM: 50 -0.416550830724E+03 -0.59259E-01 -0.83646E-03 11574 0.776E-02 0.612E-01
RMM: 51 -0.416616178067E+03 -0.65347E-01 -0.54758E-03 11442 0.742E-02 0.410E-01
RMM: 52 -0.416678218127E+03 -0.62040E-01 -0.41634E-03 11506 0.578E-02 0.377E-01
RMM: 53 -0.416702766893E+03 -0.24549E-01 -0.13951E-03 10815 0.362E-02 0.262E-01
RMM: 54 -0.416733706836E+03 -0.30940E-01 -0.11563E-03 11003 0.322E-02 0.193E-01
RMM: 55 -0.416758032793E+03 -0.24326E-01 -0.46113E-04 10659 0.226E-02 0.113E-01
RMM: 56 -0.416790857226E+03 -0.32824E-01 -0.40662E-04 10983 0.198E-02 0.146E-01
RMM: 57 -0.416826936577E+03 -0.36079E-01 -0.25770E-04 10709 0.161E-02 0.725E-02
RMM: 58 -0.416859755103E+03 -0.32819E-01 -0.33765E-04 11141 0.167E-02 0.881E-02
RMM: 59 -0.416876314039E+03 -0.16559E-01 -0.29075E-04 10609 0.148E-02 0.714E-02
RMM: 60 -0.416882692675E+03 -0.63786E-02 -0.13930E-04 9508 0.103E-02 0.685E-02
RMM: 61 -0.416885381994E+03 -0.26893E-02 -0.45035E-05 8159 0.643E-03 0.653E-02
RMM: 62 -0.416886977603E+03 -0.15956E-02 -0.34270E-05 7431 0.577E-03 0.450E-02
RMM: 63 -0.416889091269E+03 -0.21137E-02 -0.45674E-05 7759 0.580E-03 0.332E-02
RMM: 64 -0.416890064351E+03 -0.97308E-03 -0.14382E-05 6904 0.333E-03 0.239E-02
RMM: 65 -0.416890705155E+03 -0.64080E-03 -0.99799E-06 6471 0.258E-03 0.209E-02
RMM: 66 -0.416891145860E+03 -0.44071E-03 -0.99680E-06 6560 0.241E-03 0.179E-02
RMM: 67 -0.416891450778E+03 -0.30492E-03 -0.57533E-06 5456 0.185E-03 0.154E-02
RMM: 68 -0.416891666124E+03 -0.21535E-03 -0.57899E-06 5506 0.175E-03 0.123E-02
RMM: 69 -0.416891829278E+03 -0.16315E-03 -0.26751E-06 4702 0.138E-03 0.109E-02
RMM: 70 -0.416891984659E+03 -0.15538E-03 -0.23836E-06 4634 0.133E-03 0.942E-03
RMM: 71 -0.416892131508E+03 -0.14685E-03 -0.48134E-06 5417 0.161E-03 0.723E-03
RMM: 72 -0.416892235530E+03 -0.10402E-03 -0.72327E-07 3514 0.110E-03 0.632E-03
RMM: 73 -0.416892313457E+03 -0.77927E-04 -0.53988E-07 3229 0.102E-03 0.660E-03
RMM: 74 -0.416892347027E+03 -0.33570E-04 -0.32086E-07 3019 0.937E-04 0.490E-03
RMM: 75 -0.416892379225E+03 -0.32198E-04 -0.40701E-07 3098 0.974E-04 0.344E-03
RMM: 76 -0.416892388967E+03 -0.97411E-05 -0.39904E-07 3285 0.991E-04
1 F= -.45457804E+03 E0= -.45457896E+03 d E =0.275925E-02 mag= -0.0009