iterations/neb2_max2_image01_iter8_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422813553696E+04 0.42281E+04 -0.25387E+05 8992 0.103E+03
DAV: 2 -0.103887826041E+03 -0.43320E+04 -0.39312E+04 11024 0.248E+02
DAV: 3 -0.426234763519E+03 -0.32235E+03 -0.30192E+03 10208 0.657E+01
DAV: 4 -0.434817863772E+03 -0.85831E+01 -0.84740E+01 10832 0.107E+01
DAV: 5 -0.435120014151E+03 -0.30215E+00 -0.30131E+00 11088 0.196E+00 0.995E+01
RMM: 6 -0.388298395478E+03 0.46822E+02 -0.11037E+02 9700 0.146E+01 0.737E+01
RMM: 7 -0.826275449500E+03 -0.43798E+03 -0.46731E+02 11433 0.197E+01 0.159E+02
RMM: 8 -0.493598271734E+03 0.33268E+03 -0.98500E+01 9889 0.106E+01 0.903E+01
RMM: 9 -0.445656321340E+03 0.47942E+02 -0.67890E+01 10194 0.106E+01 0.688E+01
RMM: 10 -0.370339720966E+03 0.75317E+02 -0.36596E+01 10294 0.768E+00 0.234E+01
RMM: 11 -0.370625069519E+03 -0.28535E+00 -0.15517E+01 10236 0.469E+00 0.260E+01
RMM: 12 -0.370793028973E+03 -0.16796E+00 -0.43814E+00 10245 0.264E+00 0.216E+01
RMM: 13 -0.374497561792E+03 -0.37045E+01 -0.29353E+00 10185 0.240E+00 0.148E+01
RMM: 14 -0.379268651557E+03 -0.47711E+01 -0.18647E+00 10193 0.184E+00 0.150E+01
RMM: 15 -0.381187041728E+03 -0.19184E+01 -0.92970E-01 10171 0.125E+00 0.121E+01
RMM: 16 -0.388081955399E+03 -0.68949E+01 -0.20875E+00 11391 0.171E+00 0.123E+01
RMM: 17 -0.392655639282E+03 -0.45737E+01 -0.19454E+00 11276 0.160E+00 0.830E+00
RMM: 18 -0.394751343316E+03 -0.20957E+01 -0.33946E-01 10197 0.728E-01 0.763E+00
RMM: 19 -0.396035131254E+03 -0.12838E+01 -0.16619E-01 10304 0.476E-01 0.744E+00
RMM: 20 -0.399082913061E+03 -0.30478E+01 -0.84636E-01 12187 0.935E-01 0.732E+00
RMM: 21 -0.401471342845E+03 -0.23884E+01 -0.58547E-01 11875 0.791E-01 0.601E+00
RMM: 22 -0.406021920511E+03 -0.45506E+01 -0.13932E+00 13001 0.109E+00 0.468E+00
RMM: 23 -0.409899319743E+03 -0.38774E+01 -0.11333E+00 12751 0.980E-01 0.440E+00
RMM: 24 -0.411759420467E+03 -0.18601E+01 -0.48772E-01 11846 0.654E-01 0.488E+00
RMM: 25 -0.412264107103E+03 -0.50469E+00 -0.10008E-01 10799 0.313E-01 0.478E+00
RMM: 26 -0.412121730767E+03 0.14238E+00 -0.99806E-03 10421 0.117E-01 0.477E+00
RMM: 27 -0.411602077795E+03 0.51965E+00 -0.68874E-02 11637 0.306E-01 0.445E+00
RMM: 28 -0.411438124521E+03 0.16395E+00 -0.23586E-01 14358 0.610E-01 0.544E+00
RMM: 29 -0.411047152053E+03 0.39097E+00 -0.85442E-02 12458 0.384E-01 0.666E+00
RMM: 30 -0.412492440890E+03 -0.14453E+01 -0.79770E-01 15654 0.105E+00 0.655E+00
RMM: 31 -0.412998721241E+03 -0.50628E+00 -0.37477E-01 15014 0.633E-01 0.675E+00
RMM: 32 -0.414204503512E+03 -0.12058E+01 -0.32413E-01 14694 0.579E-01 0.412E+00
RMM: 33 -0.414954262558E+03 -0.74976E+00 -0.67531E-02 12014 0.297E-01 0.349E+00
RMM: 34 -0.415029451785E+03 -0.75189E-01 -0.24587E-02 10750 0.213E-01 0.311E+00
RMM: 35 -0.415293851929E+03 -0.26440E+00 -0.39168E-02 11085 0.265E-01 0.286E+00
RMM: 36 -0.415396099483E+03 -0.10225E+00 -0.20228E-02 10614 0.188E-01 0.212E+00
RMM: 37 -0.415507357301E+03 -0.11126E+00 -0.12817E-02 10464 0.143E-01 0.176E+00
RMM: 38 -0.415671638222E+03 -0.16428E+00 -0.10417E-02 10441 0.122E-01 0.137E+00
RMM: 39 -0.415885000268E+03 -0.21336E+00 -0.63275E-03 10440 0.941E-02 0.102E+00
RMM: 40 -0.416051016834E+03 -0.16602E+00 -0.53048E-03 10751 0.814E-02 0.881E-01
RMM: 41 -0.416144490338E+03 -0.93474E-01 -0.49300E-03 11001 0.742E-02 0.715E-01
RMM: 42 -0.416231705709E+03 -0.87215E-01 -0.74795E-03 11769 0.847E-02 0.578E-01
RMM: 43 -0.416301196783E+03 -0.69491E-01 -0.14324E-02 12799 0.112E-01 0.587E-01
RMM: 44 -0.416354441836E+03 -0.53245E-01 -0.11388E-02 12444 0.946E-02 0.663E-01
RMM: 45 -0.416435322460E+03 -0.80881E-01 -0.60569E-03 11617 0.725E-02 0.504E-01
RMM: 46 -0.416506724344E+03 -0.71402E-01 -0.46518E-03 11338 0.675E-02 0.314E-01
RMM: 47 -0.416527345481E+03 -0.20621E-01 -0.22499E-03 10902 0.469E-02 0.228E-01
RMM: 48 -0.416582639136E+03 -0.55294E-01 -0.19577E-03 11268 0.403E-02 0.167E-01
RMM: 49 -0.416628766313E+03 -0.46127E-01 -0.11844E-03 11113 0.305E-02 0.148E-01
RMM: 50 -0.416678306308E+03 -0.49540E-01 -0.82725E-04 11166 0.239E-02 0.128E-01
RMM: 51 -0.416694148323E+03 -0.15842E-01 -0.62241E-04 11293 0.236E-02 0.945E-02
RMM: 52 -0.416723138483E+03 -0.28990E-01 -0.35772E-04 10958 0.181E-02 0.508E-02
RMM: 53 -0.416737240463E+03 -0.14102E-01 -0.17099E-04 9933 0.118E-02 0.410E-02
RMM: 54 -0.416742503149E+03 -0.52627E-02 -0.10543E-04 9387 0.948E-03 0.368E-02
RMM: 55 -0.416744417502E+03 -0.19144E-02 -0.48254E-05 8403 0.616E-03 0.244E-02
RMM: 56 -0.416744322810E+03 0.94692E-04 -0.15355E-05 6805 0.417E-03 0.203E-02
RMM: 57 -0.416745153279E+03 -0.83047E-03 -0.17518E-05 7071 0.384E-03 0.129E-02
RMM: 58 -0.416745541907E+03 -0.38863E-03 -0.11336E-05 6773 0.287E-03 0.131E-02
RMM: 59 -0.416745739174E+03 -0.19727E-03 -0.61847E-06 6185 0.214E-03 0.675E-03
RMM: 60 -0.416745907440E+03 -0.16827E-03 -0.37160E-06 5069 0.158E-03 0.407E-03
RMM: 61 -0.416745997946E+03 -0.90506E-04 -0.15154E-06 4021 0.120E-03 0.329E-03
RMM: 62 -0.416746052240E+03 -0.54293E-04 -0.71088E-07 3454 0.104E-03 0.231E-03
RMM: 63 -0.416746118033E+03 -0.65794E-04 -0.14192E-06 4867 0.121E-03 0.103E-02
RMM: 64 -0.416746125922E+03 -0.78883E-05 -0.10317E-07 2529 0.796E-04
1 F= -.45446873E+03 E0= -.45446821E+03 d E =-.155839E-02 mag= -0.0000