iterations/neb3_max1_image01_iter11_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422395780190E+04 0.42240E+04 -0.25388E+05 9008 0.103E+03
DAV: 2 -0.104236467485E+03 -0.43282E+04 -0.39310E+04 11008 0.248E+02
DAV: 3 -0.426128106061E+03 -0.32189E+03 -0.30139E+03 10304 0.656E+01
DAV: 4 -0.434583370891E+03 -0.84553E+01 -0.83462E+01 10920 0.107E+01
DAV: 5 -0.434866457064E+03 -0.28309E+00 -0.28235E+00 11200 0.189E+00 0.102E+02
RMM: 6 -0.381390734676E+03 0.53476E+02 -0.10858E+02 9701 0.142E+01 0.697E+01
RMM: 7 -0.696365498424E+03 -0.31497E+03 -0.32592E+02 10836 0.181E+01 0.133E+02
RMM: 8 -0.514818944438E+03 0.18155E+03 -0.11841E+02 10207 0.115E+01 0.920E+01
RMM: 9 -0.393996502489E+03 0.12082E+03 -0.64014E+01 10238 0.102E+01 0.457E+01
RMM: 10 -0.385170486043E+03 0.88260E+01 -0.35652E+01 10160 0.779E+00 0.365E+01
RMM: 11 -0.396273516175E+03 -0.11103E+02 -0.20096E+01 10278 0.561E+00 0.481E+01
RMM: 12 -0.377304205209E+03 0.18969E+02 -0.62759E+00 9820 0.350E+00 0.283E+01
RMM: 13 -0.374153723166E+03 0.31505E+01 -0.23253E+00 10007 0.202E+00 0.219E+01
RMM: 14 -0.375066322861E+03 -0.91260E+00 -0.16109E+00 10341 0.164E+00 0.140E+01
RMM: 15 -0.379467168509E+03 -0.44008E+01 -0.14561E+00 10513 0.156E+00 0.140E+01
RMM: 16 -0.385236426366E+03 -0.57693E+01 -0.13212E+00 10652 0.147E+00 0.187E+01
RMM: 17 -0.387060355256E+03 -0.18239E+01 -0.79422E-01 10390 0.112E+00 0.164E+01
RMM: 18 -0.388709488370E+03 -0.16491E+01 -0.70204E-01 10638 0.101E+00 0.124E+01
RMM: 19 -0.392324466907E+03 -0.36150E+01 -0.11839E+00 11453 0.124E+00 0.694E+00
RMM: 20 -0.396179381015E+03 -0.38549E+01 -0.84589E-01 11197 0.108E+00 0.580E+00
RMM: 21 -0.399424882396E+03 -0.32455E+01 -0.99062E-01 11604 0.107E+00 0.554E+00
RMM: 22 -0.402071358363E+03 -0.26465E+01 -0.71951E-01 11420 0.870E-01 0.512E+00
RMM: 23 -0.406074803344E+03 -0.40034E+01 -0.14299E+00 12430 0.108E+00 0.525E+00
RMM: 24 -0.409697643110E+03 -0.36228E+01 -0.19100E+00 13109 0.120E+00 0.595E+00
RMM: 25 -0.411928325508E+03 -0.22307E+01 -0.11802E+00 12492 0.915E-01 0.557E+00
RMM: 26 -0.412731307778E+03 -0.80298E+00 -0.48372E-02 10587 0.237E-01 0.540E+00
RMM: 27 -0.412947827340E+03 -0.21652E+00 -0.16454E-02 10733 0.116E-01 0.539E+00
RMM: 28 -0.413810075591E+03 -0.86225E+00 -0.19984E-01 13406 0.405E-01 0.488E+00
RMM: 29 -0.414283739431E+03 -0.47366E+00 -0.24709E-01 14560 0.555E-01 0.401E+00
RMM: 30 -0.414573877219E+03 -0.29014E+00 -0.66909E-02 12152 0.316E-01 0.335E+00
RMM: 31 -0.415092374537E+03 -0.51850E+00 -0.40634E-02 11359 0.251E-01 0.284E+00
RMM: 32 -0.415643300312E+03 -0.55093E+00 -0.44616E-02 11416 0.264E-01 0.257E+00
RMM: 33 -0.416031365517E+03 -0.38807E+00 -0.32480E-02 11098 0.223E-01 0.252E+00
RMM: 34 -0.416166767841E+03 -0.13540E+00 -0.16036E-02 10549 0.160E-01 0.210E+00
RMM: 35 -0.416277106939E+03 -0.11034E+00 -0.88560E-03 10395 0.109E-01 0.177E+00
RMM: 36 -0.416369473089E+03 -0.92366E-01 -0.53486E-03 10473 0.808E-02 0.149E+00
RMM: 37 -0.416447670813E+03 -0.78198E-01 -0.44959E-03 10713 0.719E-02 0.123E+00
RMM: 38 -0.416508978180E+03 -0.61307E-01 -0.29932E-03 10660 0.576E-02 0.108E+00
RMM: 39 -0.416571804944E+03 -0.62827E-01 -0.44420E-03 11453 0.687E-02 0.103E+00
RMM: 40 -0.416599176739E+03 -0.27372E-01 -0.37479E-03 11453 0.644E-02 0.908E-01
RMM: 41 -0.416688003547E+03 -0.88827E-01 -0.59851E-03 12143 0.768E-02 0.638E-01
RMM: 42 -0.416842748865E+03 -0.15475E+00 -0.12954E-02 13307 0.107E-01 0.442E-01
RMM: 43 -0.416884709341E+03 -0.41960E-01 -0.64342E-03 12229 0.781E-02 0.577E-01
RMM: 44 -0.416900606014E+03 -0.15897E-01 -0.17553E-03 10895 0.436E-02 0.448E-01
RMM: 45 -0.416971106226E+03 -0.70500E-01 -0.36390E-03 11667 0.542E-02 0.353E-01
RMM: 46 -0.417059188817E+03 -0.88083E-01 -0.36641E-03 11917 0.498E-02 0.345E-01
RMM: 47 -0.417126095421E+03 -0.66907E-01 -0.28994E-03 11898 0.437E-02 0.257E-01
RMM: 48 -0.417161159123E+03 -0.35064E-01 -0.15869E-03 11427 0.338E-02 0.186E-01
RMM: 49 -0.417190052508E+03 -0.28893E-01 -0.11692E-03 11450 0.297E-02 0.160E-01
RMM: 50 -0.417217940941E+03 -0.27888E-01 -0.64645E-04 11168 0.219E-02 0.116E-01
RMM: 51 -0.417237993671E+03 -0.20053E-01 -0.38421E-04 11028 0.200E-02 0.724E-02
RMM: 52 -0.417252477736E+03 -0.14484E-01 -0.19573E-04 10509 0.135E-02 0.681E-02
RMM: 53 -0.417260485858E+03 -0.80081E-02 -0.11437E-04 9413 0.989E-03 0.816E-02
RMM: 54 -0.417263863562E+03 -0.33777E-02 -0.79547E-05 8865 0.767E-03 0.557E-02
RMM: 55 -0.417264616891E+03 -0.75333E-03 -0.27273E-05 7716 0.493E-03 0.335E-02
RMM: 56 -0.417264060335E+03 0.55656E-03 -0.17218E-05 6830 0.440E-03 0.210E-02
RMM: 57 -0.417264632759E+03 -0.57242E-03 -0.11147E-05 6722 0.365E-03 0.130E-02
RMM: 58 -0.417265017089E+03 -0.38433E-03 -0.75553E-06 6596 0.245E-03 0.110E-02
RMM: 59 -0.417265212252E+03 -0.19516E-03 -0.45181E-06 6080 0.187E-03 0.671E-03
RMM: 60 -0.417265361830E+03 -0.14958E-03 -0.27801E-06 4627 0.143E-03 0.429E-03
RMM: 61 -0.417265602154E+03 -0.24032E-03 -0.28026E-06 4582 0.136E-03 0.446E-03
RMM: 62 -0.417265790720E+03 -0.18857E-03 -0.17999E-06 3855 0.115E-03 0.388E-03
RMM: 63 -0.417265972244E+03 -0.18152E-03 -0.21251E-06 4239 0.119E-03 0.254E-03
RMM: 64 -0.417266050188E+03 -0.77944E-04 -0.84522E-07 3304 0.100E-03 0.291E-03
RMM: 65 -0.417266126677E+03 -0.76489E-04 -0.70387E-07 3448 0.980E-04 0.276E-03
RMM: 66 -0.417266181119E+03 -0.54442E-04 -0.63185E-07 3590 0.101E-03 0.546E-03
RMM: 67 -0.417266227797E+03 -0.46678E-04 -0.87842E-08 2442 0.827E-04 0.293E-03
RMM: 68 -0.417266255951E+03 -0.28154E-04 -0.66956E-08 2287 0.817E-04 0.101E-03
RMM: 69 -0.417266294708E+03 -0.38757E-04 -0.18072E-07 2589 0.872E-04 0.245E-03
RMM: 70 -0.417266318849E+03 -0.24141E-04 -0.21277E-07 2637 0.874E-04 0.285E-03
RMM: 71 -0.417266335914E+03 -0.17065E-04 -0.16975E-07 2559 0.869E-04 0.240E-03
RMM: 72 -0.417266347758E+03 -0.11844E-04 -0.88500E-08 2326 0.837E-04 0.177E-03
RMM: 73 -0.417266354916E+03 -0.71585E-05 -0.82798E-08 2288 0.832E-04
1 F= -.45493754E+03 E0= -.45493835E+03 d E =0.242297E-02 mag= -0.0002