iterations/neb1_max2_image01_iter14_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422648173067E+04 0.42265E+04 -0.25386E+05 8992 0.103E+03
DAV: 2 -0.103091380603E+03 -0.43296E+04 -0.39291E+04 10984 0.248E+02
DAV: 3 -0.426838765986E+03 -0.32375E+03 -0.30233E+03 10224 0.657E+01
DAV: 4 -0.435339426616E+03 -0.85007E+01 -0.83989E+01 10808 0.107E+01
DAV: 5 -0.435629992166E+03 -0.29057E+00 -0.28981E+00 11176 0.192E+00 0.100E+02
RMM: 6 -0.389636867356E+03 0.45993E+02 -0.11152E+02 9703 0.146E+01 0.737E+01
RMM: 7 -0.830882759966E+03 -0.44125E+03 -0.47209E+02 11407 0.197E+01 0.152E+02
RMM: 8 -0.497633346298E+03 0.33325E+03 -0.11483E+02 9987 0.113E+01 0.920E+01
RMM: 9 -0.427611769569E+03 0.70022E+02 -0.66975E+01 10158 0.106E+01 0.615E+01
RMM: 10 -0.379556810753E+03 0.48055E+02 -0.39571E+01 10313 0.820E+00 0.361E+01
RMM: 11 -0.388005137068E+03 -0.84483E+01 -0.22767E+01 10443 0.541E+00 0.465E+01
RMM: 12 -0.375345215340E+03 0.12660E+02 -0.63062E+00 9998 0.342E+00 0.304E+01
RMM: 13 -0.372940171160E+03 0.24050E+01 -0.36010E+00 10189 0.260E+00 0.215E+01
RMM: 14 -0.373739413036E+03 -0.79924E+00 -0.18155E+00 10210 0.178E+00 0.136E+01
RMM: 15 -0.378509270435E+03 -0.47699E+01 -0.12601E+00 10394 0.145E+00 0.138E+01
RMM: 16 -0.381995411062E+03 -0.34861E+01 -0.14043E+00 10535 0.154E+00 0.120E+01
RMM: 17 -0.386633981984E+03 -0.46386E+01 -0.18666E+00 11086 0.166E+00 0.931E+00
RMM: 18 -0.390664077160E+03 -0.40301E+01 -0.11680E+00 10755 0.128E+00 0.754E+00
RMM: 19 -0.393970972965E+03 -0.33069E+01 -0.84845E-01 10868 0.111E+00 0.876E+00
RMM: 20 -0.397333295386E+03 -0.33623E+01 -0.10963E+00 11422 0.113E+00 0.812E+00
RMM: 21 -0.399064157878E+03 -0.17309E+01 -0.43248E-01 10862 0.728E-01 0.748E+00
RMM: 22 -0.401522161823E+03 -0.24580E+01 -0.77443E-01 11649 0.905E-01 0.716E+00
RMM: 23 -0.404597274682E+03 -0.30751E+01 -0.11550E+00 12349 0.103E+00 0.698E+00
RMM: 24 -0.406441525186E+03 -0.18443E+01 -0.49004E-01 11620 0.657E-01 0.557E+00
RMM: 25 -0.407711984126E+03 -0.12705E+01 -0.12526E-01 10855 0.342E-01 0.517E+00
RMM: 26 -0.408858769019E+03 -0.11468E+01 -0.13482E-01 11346 0.336E-01 0.510E+00
RMM: 27 -0.408936070656E+03 -0.77302E-01 -0.85974E-03 11088 0.917E-02 0.504E+00
RMM: 28 -0.408812181846E+03 0.12389E+00 -0.41167E-03 10198 0.776E-02 0.458E+00
RMM: 29 -0.408463588156E+03 0.34859E+00 -0.19495E-01 15952 0.498E-01 0.403E+00
RMM: 30 -0.409067763336E+03 -0.60418E+00 -0.15500E-01 15928 0.463E-01 0.597E+00
RMM: 31 -0.408941326020E+03 0.12644E+00 -0.16780E-01 16197 0.489E-01 0.907E+00
RMM: 32 -0.409203125083E+03 -0.26180E+00 -0.61291E-01 16851 0.814E-01 0.735E+00
RMM: 33 -0.411054775690E+03 -0.18517E+01 -0.12257E+00 17562 0.100E+00 0.812E+00
RMM: 34 -0.412037565311E+03 -0.98279E+00 -0.20551E-01 16087 0.472E-01 0.717E+00
RMM: 35 -0.412972771732E+03 -0.93521E+00 -0.64062E-02 14393 0.275E-01 0.643E+00
RMM: 36 -0.413355161227E+03 -0.38239E+00 -0.68551E-03 10868 0.106E-01 0.766E+00
RMM: 37 -0.413830870156E+03 -0.47571E+00 -0.14155E-01 15625 0.373E-01 0.713E+00
RMM: 38 -0.413733937783E+03 0.96932E-01 -0.24331E-02 13339 0.186E-01 0.512E+00
RMM: 39 -0.414190547528E+03 -0.45661E+00 -0.42946E-02 14325 0.244E-01 0.374E+00
RMM: 40 -0.414581847029E+03 -0.39130E+00 -0.35333E-02 13873 0.207E-01 0.301E+00
RMM: 41 -0.414916234967E+03 -0.33439E+00 -0.29449E-02 13528 0.199E-01 0.233E+00
RMM: 42 -0.415142028542E+03 -0.22579E+00 -0.16543E-02 12619 0.152E-01 0.192E+00
RMM: 43 -0.415294623329E+03 -0.15259E+00 -0.86759E-03 11208 0.108E-01 0.175E+00
RMM: 44 -0.415423136991E+03 -0.12851E+00 -0.66543E-03 10795 0.917E-02 0.152E+00
RMM: 45 -0.415570327294E+03 -0.14719E+00 -0.60769E-03 10770 0.826E-02 0.130E+00
RMM: 46 -0.415822167652E+03 -0.25184E+00 -0.67277E-03 11318 0.874E-02 0.961E-01
RMM: 47 -0.416072230795E+03 -0.25006E+00 -0.88193E-03 12250 0.100E-01 0.893E-01
RMM: 48 -0.416098341133E+03 -0.26110E-01 -0.73054E-03 11980 0.912E-02 0.845E-01
RMM: 49 -0.416136814758E+03 -0.38474E-01 -0.73214E-03 11848 0.869E-02 0.608E-01
RMM: 50 -0.416309396561E+03 -0.17258E+00 -0.12886E-02 12712 0.105E-01 0.433E-01
RMM: 51 -0.416403777814E+03 -0.94381E-01 -0.79118E-03 11908 0.916E-02 0.405E-01
RMM: 52 -0.416445501866E+03 -0.41724E-01 -0.30844E-03 11068 0.552E-02 0.359E-01
RMM: 53 -0.416498728561E+03 -0.53227E-01 -0.48693E-03 11782 0.622E-02 0.309E-01
RMM: 54 -0.416544165160E+03 -0.45437E-01 -0.30747E-03 11664 0.507E-02 0.307E-01
RMM: 55 -0.416583860194E+03 -0.39695E-01 -0.23461E-03 11642 0.448E-02 0.277E-01
RMM: 56 -0.416607749779E+03 -0.23890E-01 -0.96557E-04 10890 0.345E-02 0.269E-01
RMM: 57 -0.416653439578E+03 -0.45690E-01 -0.76711E-04 11007 0.282E-02 0.207E-01
RMM: 58 -0.416705168915E+03 -0.51729E-01 -0.83471E-04 11424 0.297E-02 0.123E-01
RMM: 59 -0.416722342358E+03 -0.17173E-01 -0.23730E-04 10573 0.162E-02 0.946E-02
RMM: 60 -0.416732494660E+03 -0.10152E-01 -0.10591E-04 9749 0.105E-02 0.741E-02
RMM: 61 -0.416739812375E+03 -0.73177E-02 -0.74506E-05 8940 0.865E-03 0.631E-02
RMM: 62 -0.416744719276E+03 -0.49069E-02 -0.64903E-05 8624 0.725E-03 0.486E-02
RMM: 63 -0.416746996488E+03 -0.22772E-02 -0.40672E-05 8008 0.561E-03 0.384E-02
RMM: 64 -0.416748483307E+03 -0.14868E-02 -0.43068E-05 7902 0.546E-03 0.237E-02
RMM: 65 -0.416749114572E+03 -0.63127E-03 -0.18570E-05 7083 0.363E-03 0.193E-02
RMM: 66 -0.416749385756E+03 -0.27118E-03 -0.11607E-05 6753 0.283E-03 0.170E-02
RMM: 67 -0.416749456883E+03 -0.71127E-04 -0.27526E-06 5602 0.180E-03 0.112E-02
RMM: 68 -0.416749539358E+03 -0.82474E-04 -0.23960E-06 5002 0.151E-03 0.975E-03
RMM: 69 -0.416749585666E+03 -0.46309E-04 -0.61604E-06 6628 0.217E-03 0.824E-03
RMM: 70 -0.416749655445E+03 -0.69779E-04 -0.14913E-06 4176 0.126E-03 0.488E-03
RMM: 71 -0.416749668453E+03 -0.13007E-04 -0.10094E-06 4358 0.119E-03 0.400E-03
RMM: 72 -0.416749693576E+03 -0.25123E-04 -0.17484E-07 2781 0.882E-04 0.443E-03
RMM: 73 -0.416749718826E+03 -0.25250E-04 -0.43965E-07 3298 0.963E-04 0.323E-03
RMM: 74 -0.416749739507E+03 -0.20681E-04 -0.50673E-07 3337 0.986E-04 0.198E-03
RMM: 75 -0.416749760704E+03 -0.21197E-04 -0.10474E-06 4105 0.110E-03 0.141E-03
RMM: 76 -0.416749761553E+03 -0.84857E-06 -0.41544E-07 3244 0.932E-04
1 F= -.45445166E+03 E0= -.45445143E+03 d E =-.708763E-03 mag= -0.0005