iterations/neb1_max2_image01_iter6_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422359376094E+04 0.42236E+04 -0.25383E+05 8992 0.103E+03
DAV: 2 -0.103054505199E+03 -0.43266E+04 -0.39261E+04 10984 0.248E+02
DAV: 3 -0.426709170018E+03 -0.32365E+03 -0.30212E+03 10216 0.656E+01
DAV: 4 -0.435303070137E+03 -0.85939E+01 -0.84891E+01 10792 0.107E+01
DAV: 5 -0.435596125310E+03 -0.29306E+00 -0.29230E+00 11072 0.193E+00 0.997E+01
RMM: 6 -0.390057138350E+03 0.45539E+02 -0.11126E+02 9688 0.146E+01 0.738E+01
RMM: 7 -0.827541001040E+03 -0.43748E+03 -0.45952E+02 11397 0.195E+01 0.152E+02
RMM: 8 -0.494592602206E+03 0.33295E+03 -0.10670E+02 9944 0.110E+01 0.913E+01
RMM: 9 -0.429349843058E+03 0.65243E+02 -0.70287E+01 10208 0.108E+01 0.631E+01
RMM: 10 -0.368501988569E+03 0.60848E+02 -0.37634E+01 10292 0.787E+00 0.268E+01
RMM: 11 -0.381263847542E+03 -0.12762E+02 -0.15059E+01 10390 0.432E+00 0.367E+01
RMM: 12 -0.372360351120E+03 0.89035E+01 -0.45341E+00 9944 0.301E+00 0.199E+01
RMM: 13 -0.371409806979E+03 0.95054E+00 -0.15349E+00 10121 0.172E+00 0.141E+01
RMM: 14 -0.373772237146E+03 -0.23624E+01 -0.86694E-01 10152 0.123E+00 0.111E+01
RMM: 15 -0.382924330124E+03 -0.91521E+01 -0.23512E+00 11662 0.194E+00 0.152E+01
RMM: 16 -0.388071375330E+03 -0.51470E+01 -0.19656E+00 11309 0.172E+00 0.138E+01
RMM: 17 -0.388831063492E+03 -0.75969E+00 -0.91526E-01 10563 0.116E+00 0.830E+00
RMM: 18 -0.392797145833E+03 -0.39661E+01 -0.80958E-01 10916 0.104E+00 0.716E+00
RMM: 19 -0.394602205392E+03 -0.18051E+01 -0.37173E-01 10470 0.764E-01 0.710E+00
RMM: 20 -0.396419043095E+03 -0.18168E+01 -0.35327E-01 10950 0.668E-01 0.680E+00
RMM: 21 -0.399614683185E+03 -0.31956E+01 -0.10292E+00 12223 0.102E+00 0.595E+00
RMM: 22 -0.403760652300E+03 -0.41460E+01 -0.13437E+00 12651 0.109E+00 0.519E+00
RMM: 23 -0.407526995565E+03 -0.37663E+01 -0.11840E+00 12616 0.100E+00 0.490E+00
RMM: 24 -0.409903053825E+03 -0.23761E+01 -0.56249E-01 11808 0.688E-01 0.489E+00
RMM: 25 -0.410997935483E+03 -0.10949E+01 -0.16667E-01 11077 0.387E-01 0.488E+00
RMM: 26 -0.411606603663E+03 -0.60867E+00 -0.78910E-02 10784 0.262E-01 0.501E+00
RMM: 27 -0.411601525804E+03 0.50779E-02 -0.80495E-03 10492 0.992E-02 0.497E+00
RMM: 28 -0.411468104268E+03 0.13342E+00 -0.33502E-02 11149 0.227E-01 0.498E+00
RMM: 29 -0.411501838388E+03 -0.33734E-01 -0.84255E-02 12788 0.381E-01 0.491E+00
RMM: 30 -0.411355144332E+03 0.14669E+00 -0.23323E-01 14913 0.585E-01 0.641E+00
RMM: 31 -0.411155647832E+03 0.19950E+00 -0.16577E-02 10578 0.175E-01 0.691E+00
RMM: 32 -0.412577529262E+03 -0.14219E+01 -0.10542E+00 16717 0.117E+00 0.805E+00
RMM: 33 -0.412714838540E+03 -0.13731E+00 -0.20688E-02 11173 0.213E-01 0.642E+00
RMM: 34 -0.414053252092E+03 -0.13384E+01 -0.39618E-01 15983 0.614E-01 0.965E+00
RMM: 35 -0.413714837809E+03 0.33841E+00 -0.19313E-02 11290 0.169E-01 0.939E+00
RMM: 36 -0.413492321661E+03 0.22252E+00 -0.34899E-03 10503 0.707E-02 0.834E+00
RMM: 37 -0.413806287767E+03 -0.31397E+00 -0.70064E-02 15384 0.310E-01 0.567E+00
RMM: 38 -0.414400280379E+03 -0.59399E+00 -0.34193E-02 14397 0.235E-01 0.625E+00
RMM: 39 -0.414327736900E+03 0.72543E-01 -0.19087E-02 12697 0.172E-01 0.577E+00
RMM: 40 -0.414229605445E+03 0.98131E-01 -0.10672E-01 15467 0.334E-01 0.257E+00
RMM: 41 -0.414824823382E+03 -0.59522E+00 -0.13145E-02 12610 0.148E-01 0.299E+00
RMM: 42 -0.415050491905E+03 -0.22567E+00 -0.43535E-03 10854 0.935E-02 0.278E+00
RMM: 43 -0.415191066675E+03 -0.14057E+00 -0.69429E-03 11238 0.924E-02 0.231E+00
RMM: 44 -0.415490686760E+03 -0.29962E+00 -0.11614E-02 12105 0.116E-01 0.182E+00
RMM: 45 -0.415696635358E+03 -0.20595E+00 -0.72371E-03 11426 0.972E-02 0.168E+00
RMM: 46 -0.415855053372E+03 -0.15842E+00 -0.80218E-03 11891 0.956E-02 0.134E+00
RMM: 47 -0.415984178158E+03 -0.12912E+00 -0.10752E-02 12564 0.109E-01 0.107E+00
RMM: 48 -0.416097344665E+03 -0.11317E+00 -0.61327E-03 11574 0.795E-02 0.938E-01
RMM: 49 -0.416200048295E+03 -0.10270E+00 -0.89932E-03 12160 0.889E-02 0.799E-01
RMM: 50 -0.416259695444E+03 -0.59647E-01 -0.81302E-03 12153 0.854E-02 0.711E-01
RMM: 51 -0.416268376943E+03 -0.86815E-02 -0.71145E-03 12222 0.855E-02 0.493E-01
RMM: 52 -0.416325139901E+03 -0.56763E-01 -0.49369E-03 11631 0.713E-02 0.469E-01
RMM: 53 -0.416394727752E+03 -0.69588E-01 -0.33768E-03 11583 0.592E-02 0.367E-01
RMM: 54 -0.416429677733E+03 -0.34950E-01 -0.20551E-03 11212 0.459E-02 0.296E-01
RMM: 55 -0.416479808924E+03 -0.50131E-01 -0.18428E-03 11497 0.392E-02 0.263E-01
RMM: 56 -0.416540172598E+03 -0.60364E-01 -0.18189E-03 11835 0.396E-02 0.240E-01
RMM: 57 -0.416575016495E+03 -0.34844E-01 -0.51787E-04 10756 0.213E-02 0.220E-01
RMM: 58 -0.416592645035E+03 -0.17629E-01 -0.28297E-04 10664 0.165E-02 0.191E-01
RMM: 59 -0.416603205719E+03 -0.10561E-01 -0.15585E-04 9820 0.113E-02 0.187E-01
RMM: 60 -0.416611858312E+03 -0.86526E-02 -0.17954E-04 10148 0.112E-02 0.179E-01
RMM: 61 -0.416614500751E+03 -0.26424E-02 -0.73212E-05 9003 0.766E-03 0.170E-01
RMM: 62 -0.416614889466E+03 -0.38871E-03 -0.28975E-05 7572 0.520E-03 0.161E-01
RMM: 63 -0.416615211529E+03 -0.32206E-03 -0.20486E-05 7040 0.406E-03 0.153E-01
RMM: 64 -0.416615480370E+03 -0.26884E-03 -0.16298E-05 6962 0.350E-03 0.147E-01
RMM: 65 -0.416615942126E+03 -0.46176E-03 -0.32874E-05 7520 0.446E-03 0.139E-01
RMM: 66 -0.416616307272E+03 -0.36515E-03 -0.29564E-05 7241 0.436E-03 0.130E-01
RMM: 67 -0.416616505319E+03 -0.19805E-03 -0.29203E-05 7383 0.416E-03 0.120E-01
RMM: 68 -0.416616690706E+03 -0.18539E-03 -0.34486E-05 7525 0.430E-03 0.112E-01
RMM: 69 -0.416616653045E+03 0.37662E-04 -0.21844E-05 6829 0.359E-03 0.104E-01
RMM: 70 -0.416616582434E+03 0.70611E-04 -0.28833E-05 7207 0.404E-03 0.924E-02
RMM: 71 -0.416616450741E+03 0.13169E-03 -0.12221E-05 6571 0.300E-03 0.866E-02
RMM: 72 -0.416616346729E+03 0.10401E-03 -0.16238E-05 6228 0.314E-03 0.784E-02
RMM: 73 -0.416616247463E+03 0.99266E-04 -0.12472E-05 6274 0.285E-03 0.713E-02
RMM: 74 -0.416616056384E+03 0.19108E-03 -0.35479E-05 7231 0.427E-03 0.593E-02
RMM: 75 -0.416615910747E+03 0.14564E-03 -0.19117E-05 6482 0.336E-03 0.517E-02
RMM: 76 -0.416615263600E+03 0.64715E-03 -0.25153E-04 10251 0.107E-02 0.205E-02
RMM: 77 -0.416615319662E+03 -0.56062E-04 -0.33328E-05 7355 0.458E-03 0.109E-02
RMM: 78 -0.416615423246E+03 -0.10358E-03 -0.10392E-05 6239 0.283E-03 0.119E-02
RMM: 79 -0.416615493188E+03 -0.69942E-04 -0.18031E-06 4819 0.148E-03 0.108E-02
RMM: 80 -0.416615551824E+03 -0.58636E-04 -0.19383E-06 4721 0.140E-03 0.758E-03
RMM: 81 -0.416615557606E+03 -0.57829E-05 -0.42830E-06 5602 0.179E-03
1 F= -.45431960E+03 E0= -.45431936E+03 d E =-.718236E-03 mag= -0.0012