iterations/neb3_max1_image02_iter19_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422054748173E+04 0.42205E+04 -0.25385E+05 9008 0.103E+03
DAV: 2 -0.104988714121E+03 -0.43255E+04 -0.39269E+04 11000 0.248E+02
DAV: 3 -0.426613687874E+03 -0.32162E+03 -0.30111E+03 10296 0.656E+01
DAV: 4 -0.435139102480E+03 -0.85254E+01 -0.84018E+01 10848 0.107E+01
DAV: 5 -0.435434627699E+03 -0.29553E+00 -0.29478E+00 11224 0.192E+00 0.101E+02
RMM: 6 -0.388615815235E+03 0.46819E+02 -0.10765E+02 9692 0.143E+01 0.727E+01
RMM: 7 -0.812770982669E+03 -0.42416E+03 -0.46189E+02 11403 0.196E+01 0.150E+02
RMM: 8 -0.499686551347E+03 0.31308E+03 -0.12060E+02 10041 0.115E+01 0.921E+01
RMM: 9 -0.410994185858E+03 0.88692E+02 -0.67803E+01 10161 0.107E+01 0.552E+01
RMM: 10 -0.402586255002E+03 0.84079E+01 -0.45371E+01 10373 0.878E+00 0.484E+01
RMM: 11 -0.383597341825E+03 0.18989E+02 -0.23830E+01 10251 0.592E+00 0.419E+01
RMM: 12 -0.373733442957E+03 0.98639E+01 -0.77355E+00 9991 0.374E+00 0.265E+01
RMM: 13 -0.374204516058E+03 -0.47107E+00 -0.35357E+00 10166 0.251E+00 0.217E+01
RMM: 14 -0.373695603721E+03 0.50891E+00 -0.12620E+00 10118 0.151E+00 0.137E+01
RMM: 15 -0.378114694132E+03 -0.44191E+01 -0.13958E+00 10448 0.153E+00 0.121E+01
RMM: 16 -0.383606765495E+03 -0.54921E+01 -0.13906E+00 10548 0.155E+00 0.128E+01
RMM: 17 -0.388715855861E+03 -0.51091E+01 -0.20860E+00 11211 0.171E+00 0.968E+00
RMM: 18 -0.391258125833E+03 -0.25423E+01 -0.62010E-01 10339 0.984E-01 0.689E+00
RMM: 19 -0.393719523050E+03 -0.24614E+01 -0.41108E-01 10520 0.775E-01 0.709E+00
RMM: 20 -0.396956404015E+03 -0.32369E+01 -0.77802E-01 11409 0.990E-01 0.724E+00
RMM: 21 -0.400546637564E+03 -0.35902E+01 -0.12024E+00 12158 0.112E+00 0.686E+00
RMM: 22 -0.403854026578E+03 -0.33074E+01 -0.11665E+00 12332 0.105E+00 0.586E+00
RMM: 23 -0.408554688281E+03 -0.47007E+01 -0.20300E+00 13031 0.125E+00 0.664E+00
RMM: 24 -0.410133207869E+03 -0.15785E+01 -0.61469E-01 11804 0.718E-01 0.635E+00
RMM: 25 -0.410758436381E+03 -0.62523E+00 -0.96178E-02 10690 0.296E-01 0.596E+00
RMM: 26 -0.410481896051E+03 0.27654E+00 -0.34902E-02 10250 0.213E-01 0.561E+00
RMM: 27 -0.410172522475E+03 0.30937E+00 -0.53868E-02 10775 0.245E-01 0.510E+00
RMM: 28 -0.409856834989E+03 0.31569E+00 -0.11385E-01 12050 0.394E-01 0.566E+00
RMM: 29 -0.409350559732E+03 0.50628E+00 -0.84668E-02 11705 0.370E-01 0.612E+00
RMM: 30 -0.410533219250E+03 -0.11827E+01 -0.25684E-01 12783 0.610E-01 0.653E+00
RMM: 31 -0.412309473414E+03 -0.17763E+01 -0.90332E-01 15254 0.938E-01 0.768E+00
RMM: 32 -0.413648415242E+03 -0.13389E+01 -0.63260E-01 15155 0.779E-01 0.447E+00
RMM: 33 -0.414773294249E+03 -0.11249E+01 -0.15088E-01 12900 0.386E-01 0.370E+00
RMM: 34 -0.415147560699E+03 -0.37427E+00 -0.40536E-02 10880 0.272E-01 0.294E+00
RMM: 35 -0.415799937273E+03 -0.65238E+00 -0.10086E-01 12154 0.367E-01 0.269E+00
RMM: 36 -0.416085834176E+03 -0.28590E+00 -0.47952E-02 11307 0.262E-01 0.267E+00
RMM: 37 -0.416195395796E+03 -0.10956E+00 -0.26724E-02 10695 0.203E-01 0.261E+00
RMM: 38 -0.416370739675E+03 -0.17534E+00 -0.17872E-02 10582 0.158E-01 0.182E+00
RMM: 39 -0.416664627102E+03 -0.29389E+00 -0.13199E-02 10627 0.139E-01 0.159E+00
RMM: 40 -0.416725573907E+03 -0.60947E-01 -0.12919E-02 11054 0.123E-01 0.156E+00
RMM: 41 -0.416761060599E+03 -0.35487E-01 -0.11537E-02 11175 0.112E-01 0.110E+00
RMM: 42 -0.416915157351E+03 -0.15410E+00 -0.78849E-03 10964 0.921E-02 0.787E-01
RMM: 43 -0.417067601461E+03 -0.15244E+00 -0.91674E-03 11522 0.957E-02 0.594E-01
RMM: 44 -0.417126070815E+03 -0.58469E-01 -0.51126E-03 10976 0.749E-02 0.606E-01
RMM: 45 -0.417165953906E+03 -0.39883E-01 -0.83214E-03 11738 0.910E-02 0.467E-01
RMM: 46 -0.417199108980E+03 -0.33155E-01 -0.58267E-03 11302 0.786E-02 0.388E-01
RMM: 47 -0.417273416747E+03 -0.74308E-01 -0.37735E-03 11073 0.605E-02 0.298E-01
RMM: 48 -0.417364046325E+03 -0.90630E-01 -0.63140E-03 11781 0.704E-02 0.296E-01
RMM: 49 -0.417439639960E+03 -0.75594E-01 -0.43878E-03 11488 0.543E-02 0.240E-01
RMM: 50 -0.417481801224E+03 -0.42161E-01 -0.16808E-03 10981 0.361E-02 0.166E-01
RMM: 51 -0.417498308115E+03 -0.16507E-01 -0.15945E-03 11237 0.379E-02 0.220E-01
RMM: 52 -0.417537508432E+03 -0.39200E-01 -0.67423E-04 10839 0.254E-02 0.269E-01
RMM: 53 -0.417570519280E+03 -0.33011E-01 -0.30398E-04 10494 0.162E-02 0.238E-01
RMM: 54 -0.417596060198E+03 -0.25541E-01 -0.23616E-04 10588 0.137E-02 0.153E-01
RMM: 55 -0.417617872967E+03 -0.21813E-01 -0.27324E-04 11411 0.164E-02 0.815E-02
RMM: 56 -0.417616516363E+03 0.13566E-02 -0.87499E-05 10186 0.112E-02 0.512E-02
RMM: 57 -0.417627751640E+03 -0.11235E-01 -0.12527E-04 10047 0.106E-02 0.411E-02
RMM: 58 -0.417631277792E+03 -0.35262E-02 -0.67949E-05 8893 0.731E-03 0.383E-02
RMM: 59 -0.417632428439E+03 -0.11506E-02 -0.23382E-05 7398 0.468E-03 0.210E-02
RMM: 60 -0.417633177872E+03 -0.74943E-03 -0.17343E-05 7131 0.362E-03 0.106E-02
RMM: 61 -0.417633724995E+03 -0.54712E-03 -0.10824E-05 6787 0.272E-03 0.918E-03
RMM: 62 -0.417634122754E+03 -0.39776E-03 -0.53729E-06 5619 0.185E-03 0.861E-03
RMM: 63 -0.417634345211E+03 -0.22246E-03 -0.33728E-06 4702 0.149E-03 0.542E-03
RMM: 64 -0.417634458631E+03 -0.11342E-03 -0.23039E-06 5105 0.140E-03 0.468E-03
RMM: 65 -0.417634532116E+03 -0.73485E-04 -0.14957E-06 4078 0.111E-03 0.308E-03
RMM: 66 -0.417634585361E+03 -0.53246E-04 -0.52137E-07 3028 0.874E-04 0.175E-03
RMM: 67 -0.417634621799E+03 -0.36437E-04 -0.44313E-07 3183 0.876E-04 0.187E-03
RMM: 68 -0.417634628633E+03 -0.68347E-05 -0.23839E-07 2789 0.828E-04
1 F= -.45529030E+03 E0= -.45529095E+03 d E =0.195604E-02 mag= -0.0007