iterations/neb1_max2_image03_iter32_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422783821932E+04 0.42278E+04 -0.25387E+05 8992 0.103E+03
DAV: 2 -0.103677854187E+03 -0.43315E+04 -0.39319E+04 11000 0.248E+02
DAV: 3 -0.426887671738E+03 -0.32321E+03 -0.30218E+03 10200 0.657E+01
DAV: 4 -0.435435770428E+03 -0.85481E+01 -0.84453E+01 10816 0.107E+01
DAV: 5 -0.435734304608E+03 -0.29853E+00 -0.29776E+00 11120 0.194E+00 0.995E+01
RMM: 6 -0.388799438727E+03 0.46935E+02 -0.11134E+02 9707 0.146E+01 0.734E+01
RMM: 7 -0.819028843789E+03 -0.43023E+03 -0.45939E+02 11344 0.197E+01 0.155E+02
RMM: 8 -0.497276940027E+03 0.32175E+03 -0.11017E+02 9995 0.111E+01 0.918E+01
RMM: 9 -0.437045345604E+03 0.60232E+02 -0.66015E+01 10182 0.105E+01 0.656E+01
RMM: 10 -0.379564579584E+03 0.57481E+02 -0.37892E+01 10318 0.808E+00 0.319E+01
RMM: 11 -0.390304357917E+03 -0.10740E+02 -0.20946E+01 10552 0.480E+00 0.489E+01
RMM: 12 -0.370668266072E+03 0.19636E+02 -0.54342E+00 9935 0.321E+00 0.241E+01
RMM: 13 -0.370205021007E+03 0.46325E+00 -0.16601E+00 10129 0.188E+00 0.161E+01
RMM: 14 -0.374798511098E+03 -0.45935E+01 -0.16683E+00 10318 0.175E+00 0.132E+01
RMM: 15 -0.382767076406E+03 -0.79686E+01 -0.21338E+00 10666 0.191E+00 0.132E+01
RMM: 16 -0.386982623152E+03 -0.42155E+01 -0.13527E+00 10513 0.147E+00 0.146E+01
RMM: 17 -0.389692880878E+03 -0.27103E+01 -0.11480E+00 10686 0.127E+00 0.125E+01
RMM: 18 -0.392734989843E+03 -0.30421E+01 -0.11462E+00 11065 0.122E+00 0.949E+00
RMM: 19 -0.395989616490E+03 -0.32546E+01 -0.98394E-01 11174 0.116E+00 0.790E+00
RMM: 20 -0.398545981620E+03 -0.25564E+01 -0.36585E-01 10557 0.708E-01 0.751E+00
RMM: 21 -0.399849302853E+03 -0.13033E+01 -0.19178E-01 10626 0.487E-01 0.749E+00
RMM: 22 -0.403262763776E+03 -0.34135E+01 -0.15752E+00 13006 0.121E+00 0.700E+00
RMM: 23 -0.406793159291E+03 -0.35304E+01 -0.16183E+00 13171 0.119E+00 0.634E+00
RMM: 24 -0.409414685377E+03 -0.26215E+01 -0.87314E-01 12322 0.853E-01 0.611E+00
RMM: 25 -0.410619559073E+03 -0.12049E+01 -0.31410E-01 11476 0.523E-01 0.587E+00
RMM: 26 -0.410989895339E+03 -0.37034E+00 -0.29380E-02 10490 0.176E-01 0.587E+00
RMM: 27 -0.411067234693E+03 -0.77339E-01 -0.99749E-03 10743 0.869E-02 0.585E+00
RMM: 28 -0.410917088496E+03 0.15015E+00 -0.94362E-03 10355 0.116E-01 0.576E+00
RMM: 29 -0.410355087923E+03 0.56200E+00 -0.15345E-01 14851 0.457E-01 0.504E+00
RMM: 30 -0.410725031429E+03 -0.36994E+00 -0.97990E-02 14758 0.382E-01 0.524E+00
RMM: 31 -0.410824811969E+03 -0.99781E-01 -0.45809E-02 13610 0.265E-01 0.570E+00
RMM: 32 -0.411265068547E+03 -0.44026E+00 -0.34354E-02 12112 0.246E-01 0.497E+00
RMM: 33 -0.412441959387E+03 -0.11769E+01 -0.66557E-01 16991 0.883E-01 0.571E+00
RMM: 34 -0.413546610673E+03 -0.11047E+01 -0.32815E-01 16230 0.600E-01 0.432E+00
RMM: 35 -0.414189338951E+03 -0.64273E+00 -0.19943E-01 15497 0.484E-01 0.393E+00
RMM: 36 -0.414232547784E+03 -0.43209E-01 -0.19104E-02 11738 0.179E-01 0.350E+00
RMM: 37 -0.415053062278E+03 -0.82051E+00 -0.51729E-02 13687 0.280E-01 0.359E+00
RMM: 38 -0.415377543641E+03 -0.32448E+00 -0.41848E-02 13261 0.243E-01 0.286E+00
RMM: 39 -0.415513450156E+03 -0.13591E+00 -0.23762E-02 12346 0.183E-01 0.244E+00
RMM: 40 -0.415776980078E+03 -0.26353E+00 -0.11034E-02 11079 0.124E-01 0.196E+00
RMM: 41 -0.416012918387E+03 -0.23594E+00 -0.88212E-03 11034 0.105E-01 0.161E+00
RMM: 42 -0.416122475716E+03 -0.10956E+00 -0.46695E-03 10665 0.764E-02 0.136E+00
RMM: 43 -0.416205198431E+03 -0.82723E-01 -0.74465E-03 11525 0.917E-02 0.105E+00
RMM: 44 -0.416324632809E+03 -0.11943E+00 -0.12699E-02 12369 0.112E-01 0.799E-01
RMM: 45 -0.416381725158E+03 -0.57092E-01 -0.14633E-02 12603 0.120E-01 0.730E-01
RMM: 46 -0.416448618559E+03 -0.66893E-01 -0.65141E-03 11582 0.774E-02 0.681E-01
RMM: 47 -0.416578526625E+03 -0.12991E+00 -0.55876E-03 11412 0.738E-02 0.464E-01
RMM: 48 -0.416670844817E+03 -0.92318E-01 -0.81776E-03 12131 0.791E-02 0.366E-01
RMM: 49 -0.416718119579E+03 -0.47275E-01 -0.27980E-03 11120 0.513E-02 0.342E-01
RMM: 50 -0.416773660552E+03 -0.55541E-01 -0.19442E-03 10913 0.468E-02 0.340E-01
RMM: 51 -0.416739906084E+03 0.33754E-01 -0.39009E-03 11886 0.666E-02 0.379E-01
RMM: 52 -0.416798177711E+03 -0.58272E-01 -0.24157E-03 11355 0.514E-02 0.198E-01
RMM: 53 -0.416829543267E+03 -0.31366E-01 -0.64925E-04 10639 0.245E-02 0.148E-01
RMM: 54 -0.416856237588E+03 -0.26694E-01 -0.27098E-04 10411 0.170E-02 0.163E-01
RMM: 55 -0.416900761155E+03 -0.44524E-01 -0.50807E-04 11403 0.212E-02 0.121E-01
RMM: 56 -0.416921336847E+03 -0.20576E-01 -0.36058E-04 11194 0.198E-02 0.880E-02
RMM: 57 -0.416935293762E+03 -0.13957E-01 -0.13981E-04 9940 0.113E-02 0.514E-02
RMM: 58 -0.416940387253E+03 -0.50935E-02 -0.85716E-05 9168 0.875E-03 0.392E-02
RMM: 59 -0.416943128756E+03 -0.27415E-02 -0.65264E-05 8650 0.700E-03 0.325E-02
RMM: 60 -0.416945182038E+03 -0.20533E-02 -0.52918E-05 8291 0.608E-03 0.232E-02
RMM: 61 -0.416946554416E+03 -0.13724E-02 -0.39603E-05 7911 0.537E-03 0.180E-02
RMM: 62 -0.416947050236E+03 -0.49582E-03 -0.12200E-05 6830 0.307E-03 0.152E-02
RMM: 63 -0.416947650952E+03 -0.60072E-03 -0.88454E-06 6691 0.250E-03 0.629E-03
RMM: 64 -0.416948132707E+03 -0.48176E-03 -0.53356E-06 6389 0.195E-03 0.648E-03
RMM: 65 -0.416948461592E+03 -0.32888E-03 -0.45379E-06 4910 0.157E-03 0.535E-03
RMM: 66 -0.416948520092E+03 -0.58500E-04 -0.12480E-06 3945 0.121E-03 0.279E-03
RMM: 67 -0.416948633447E+03 -0.11336E-03 -0.12351E-06 3860 0.111E-03 0.324E-03
RMM: 68 -0.416948679901E+03 -0.46454E-04 -0.12593E-06 4509 0.119E-03 0.110E-02
RMM: 69 -0.416948682758E+03 -0.28577E-05 -0.18814E-07 2757 0.863E-04
1 F= -.45466865E+03 E0= -.45466810E+03 d E =-.166697E-02 mag= -0.0015