iterations/neb3_max1_image05_iter24_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421672272719E+04 0.42167E+04 -0.25382E+05 9008 0.103E+03
DAV: 2 -0.105774963030E+03 -0.43225E+04 -0.39278E+04 11024 0.248E+02
DAV: 3 -0.427231627948E+03 -0.32146E+03 -0.30069E+03 10248 0.655E+01
DAV: 4 -0.435713242330E+03 -0.84816E+01 -0.83869E+01 10840 0.107E+01
DAV: 5 -0.435994539416E+03 -0.28130E+00 -0.28066E+00 11184 0.189E+00 0.101E+02
RMM: 6 -0.386536305179E+03 0.49458E+02 -0.11024E+02 9704 0.145E+01 0.714E+01
RMM: 7 -0.690503259859E+03 -0.30397E+03 -0.31788E+02 10871 0.177E+01 0.132E+02
RMM: 8 -0.514789071411E+03 0.17571E+03 -0.11789E+02 10221 0.114E+01 0.927E+01
RMM: 9 -0.395199983368E+03 0.11959E+03 -0.69216E+01 10263 0.106E+01 0.475E+01
RMM: 10 -0.390462600180E+03 0.47374E+01 -0.40038E+01 10173 0.822E+00 0.438E+01
RMM: 11 -0.398154891946E+03 -0.76923E+01 -0.22718E+01 10323 0.590E+00 0.502E+01
RMM: 12 -0.378590493160E+03 0.19564E+02 -0.78248E+00 9932 0.381E+00 0.305E+01
RMM: 13 -0.375941941462E+03 0.26486E+01 -0.24822E+00 9988 0.212E+00 0.241E+01
RMM: 14 -0.375207394851E+03 0.73455E+00 -0.13710E+00 10234 0.153E+00 0.156E+01
RMM: 15 -0.377851547339E+03 -0.26442E+01 -0.11099E+00 10447 0.135E+00 0.115E+01
RMM: 16 -0.383615166546E+03 -0.57636E+01 -0.12100E+00 10743 0.141E+00 0.166E+01
RMM: 17 -0.386421173320E+03 -0.28060E+01 -0.11060E+00 10766 0.132E+00 0.148E+01
RMM: 18 -0.388907716295E+03 -0.24865E+01 -0.91452E-01 10766 0.116E+00 0.113E+01
RMM: 19 -0.393461126331E+03 -0.45534E+01 -0.14373E+00 11462 0.134E+00 0.728E+00
RMM: 20 -0.396963172069E+03 -0.35020E+01 -0.87561E-01 11088 0.110E+00 0.690E+00
RMM: 21 -0.399316784392E+03 -0.23536E+01 -0.73044E-01 11237 0.941E-01 0.710E+00
RMM: 22 -0.401773312193E+03 -0.24565E+01 -0.80614E-01 11576 0.920E-01 0.760E+00
RMM: 23 -0.404849344051E+03 -0.30760E+01 -0.13253E+00 12272 0.107E+00 0.811E+00
RMM: 24 -0.407819541970E+03 -0.29702E+01 -0.17536E+00 12811 0.116E+00 0.733E+00
RMM: 25 -0.409991372363E+03 -0.21718E+01 -0.84769E-01 11970 0.815E-01 0.604E+00
RMM: 26 -0.410536958618E+03 -0.54559E+00 -0.30132E-02 10752 0.191E-01 0.601E+00
RMM: 27 -0.410949939596E+03 -0.41298E+00 -0.35498E-02 10687 0.188E-01 0.585E+00
RMM: 28 -0.411628159180E+03 -0.67822E+00 -0.48236E-02 11221 0.214E-01 0.563E+00
RMM: 29 -0.412398283106E+03 -0.77012E+00 -0.39982E-02 11259 0.195E-01 0.549E+00
RMM: 30 -0.413939790361E+03 -0.15415E+01 -0.26317E-01 14149 0.488E-01 0.479E+00
RMM: 31 -0.414760816119E+03 -0.82103E+00 -0.25116E-01 14520 0.535E-01 0.384E+00
RMM: 32 -0.415032013232E+03 -0.27120E+00 -0.64683E-02 12262 0.307E-01 0.384E+00
RMM: 33 -0.415314500196E+03 -0.28249E+00 -0.61258E-02 11840 0.326E-01 0.352E+00
RMM: 34 -0.415676397167E+03 -0.36190E+00 -0.60748E-02 11933 0.288E-01 0.351E+00
RMM: 35 -0.416032643546E+03 -0.35625E+00 -0.33103E-02 11157 0.213E-01 0.283E+00
RMM: 36 -0.416460736369E+03 -0.42809E+00 -0.17414E-02 10684 0.155E-01 0.218E+00
RMM: 37 -0.416767847466E+03 -0.30711E+00 -0.11827E-02 10611 0.127E-01 0.167E+00
RMM: 38 -0.416899895167E+03 -0.13205E+00 -0.60956E-03 10413 0.888E-02 0.151E+00
RMM: 39 -0.416959901420E+03 -0.60006E-01 -0.57456E-03 10816 0.841E-02 0.126E+00
RMM: 40 -0.417018695484E+03 -0.58794E-01 -0.69595E-03 11297 0.916E-02 0.114E+00
RMM: 41 -0.417058859322E+03 -0.40164E-01 -0.72005E-03 11572 0.888E-02 0.881E-01
RMM: 42 -0.417164007696E+03 -0.10515E+00 -0.71133E-03 11667 0.853E-02 0.672E-01
RMM: 43 -0.417271609406E+03 -0.10760E+00 -0.73931E-03 11822 0.847E-02 0.474E-01
RMM: 44 -0.417340148120E+03 -0.68539E-01 -0.46378E-03 11272 0.694E-02 0.393E-01
RMM: 45 -0.417357262901E+03 -0.17115E-01 -0.32079E-03 11078 0.560E-02 0.403E-01
RMM: 46 -0.417416429955E+03 -0.59167E-01 -0.47092E-03 11734 0.606E-02 0.465E-01
RMM: 47 -0.417522462634E+03 -0.10603E+00 -0.52897E-03 11813 0.608E-02 0.456E-01
RMM: 48 -0.417584197244E+03 -0.61735E-01 -0.32644E-03 11379 0.476E-02 0.374E-01
RMM: 49 -0.417625106363E+03 -0.40909E-01 -0.20129E-03 11367 0.379E-02 0.254E-01
RMM: 50 -0.417646229340E+03 -0.21123E-01 -0.89026E-04 10962 0.268E-02 0.218E-01
RMM: 51 -0.417630187375E+03 0.16042E-01 -0.12580E-03 11630 0.331E-02 0.137E-01
RMM: 52 -0.417669370101E+03 -0.39183E-01 -0.12433E-03 11737 0.326E-02 0.782E-02
RMM: 53 -0.417701706531E+03 -0.32336E-01 -0.41441E-04 10953 0.190E-02 0.571E-02
RMM: 54 -0.417727074408E+03 -0.25368E-01 -0.23624E-04 10222 0.142E-02 0.600E-02
RMM: 55 -0.417738153142E+03 -0.11079E-01 -0.17758E-04 10076 0.111E-02 0.643E-02
RMM: 56 -0.417739031702E+03 -0.87856E-03 -0.30073E-05 7841 0.609E-03 0.371E-02
RMM: 57 -0.417740710791E+03 -0.16791E-02 -0.40186E-05 8054 0.574E-03 0.305E-02
RMM: 58 -0.417741829337E+03 -0.11185E-02 -0.27680E-05 7599 0.450E-03 0.203E-02
RMM: 59 -0.417742461421E+03 -0.63208E-03 -0.15043E-05 6929 0.349E-03 0.138E-02
RMM: 60 -0.417742560914E+03 -0.99493E-04 -0.47794E-06 6342 0.223E-03 0.910E-03
RMM: 61 -0.417742619819E+03 -0.58906E-04 -0.36948E-06 6369 0.191E-03 0.590E-03
RMM: 62 -0.417742887455E+03 -0.26764E-03 -0.22380E-06 4712 0.140E-03 0.440E-03
RMM: 63 -0.417743071130E+03 -0.18368E-03 -0.19095E-06 4043 0.121E-03 0.322E-03
RMM: 64 -0.417743186819E+03 -0.11569E-03 -0.12651E-06 3858 0.112E-03 0.346E-03
RMM: 65 -0.417743275932E+03 -0.89114E-04 -0.98731E-07 3784 0.105E-03 0.323E-03
RMM: 66 -0.417743332017E+03 -0.56084E-04 -0.43740E-07 3091 0.924E-04 0.253E-03
RMM: 67 -0.417743386027E+03 -0.54011E-04 -0.70710E-07 3737 0.104E-03 0.978E-03
RMM: 68 -0.417743402300E+03 -0.16272E-04 -0.92399E-08 2511 0.845E-04 0.844E-03
RMM: 69 -0.417743408407E+03 -0.61073E-05 -0.52419E-08 2355 0.802E-04
1 F= -.45537868E+03 E0= -.45537916E+03 d E =0.143072E-02 mag= 0.0008