iterations/neb3_max1_image01_iter2_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422692409427E+04 0.42269E+04 -0.25390E+05 9008 0.103E+03
DAV: 2 -0.103895657002E+03 -0.43308E+04 -0.39321E+04 11008 0.248E+02
DAV: 3 -0.425824812212E+03 -0.32193E+03 -0.30141E+03 10320 0.656E+01
DAV: 4 -0.434292218426E+03 -0.84674E+01 -0.83649E+01 10856 0.107E+01
DAV: 5 -0.434576343862E+03 -0.28413E+00 -0.28338E+00 11192 0.190E+00 0.103E+02
RMM: 6 -0.378727218785E+03 0.55849E+02 -0.10950E+02 9702 0.142E+01 0.696E+01
RMM: 7 -0.611533189089E+03 -0.23281E+03 -0.25522E+02 10451 0.170E+01 0.114E+02
RMM: 8 -0.523279413017E+03 0.88254E+02 -0.11635E+02 10298 0.116E+01 0.910E+01
RMM: 9 -0.390467165867E+03 0.13281E+03 -0.52511E+01 10188 0.903E+00 0.412E+01
RMM: 10 -0.397256555978E+03 -0.67894E+01 -0.30541E+01 10148 0.708E+00 0.449E+01
RMM: 11 -0.375736622788E+03 0.21520E+02 -0.98856E+00 9861 0.421E+00 0.156E+01
RMM: 12 -0.377875310737E+03 -0.21387E+01 -0.23619E+00 10338 0.187E+00 0.153E+01
RMM: 13 -0.378910496330E+03 -0.10352E+01 -0.13227E+00 10204 0.147E+00 0.127E+01
RMM: 14 -0.381453756400E+03 -0.25433E+01 -0.83272E-01 10256 0.118E+00 0.987E+00
RMM: 15 -0.385902690332E+03 -0.44489E+01 -0.62537E-01 10390 0.104E+00 0.102E+01
RMM: 16 -0.388337368306E+03 -0.24347E+01 -0.76551E-01 10865 0.109E+00 0.930E+00
RMM: 17 -0.392450911989E+03 -0.41135E+01 -0.14228E+00 11648 0.135E+00 0.685E+00
RMM: 18 -0.395863066427E+03 -0.34122E+01 -0.78834E-01 11251 0.999E-01 0.636E+00
RMM: 19 -0.399211460608E+03 -0.33484E+01 -0.96157E-01 11651 0.103E+00 0.657E+00
RMM: 20 -0.401750452935E+03 -0.25390E+01 -0.88877E-01 11690 0.957E-01 0.592E+00
RMM: 21 -0.405871595655E+03 -0.41211E+01 -0.17805E+00 12588 0.122E+00 0.536E+00
RMM: 22 -0.409368742226E+03 -0.34971E+01 -0.12917E+00 12396 0.100E+00 0.582E+00
RMM: 23 -0.410615577148E+03 -0.12468E+01 -0.27066E-01 11105 0.483E-01 0.580E+00
RMM: 24 -0.410496912845E+03 0.11866E+00 -0.39891E-02 10311 0.228E-01 0.585E+00
RMM: 25 -0.409650947851E+03 0.84596E+00 -0.16223E-01 11242 0.422E-01 0.530E+00
RMM: 26 -0.409009946741E+03 0.64100E+00 -0.21442E-01 12076 0.549E-01 0.525E+00
RMM: 27 -0.408478216491E+03 0.53173E+00 -0.13397E-01 11492 0.451E-01 0.615E+00
RMM: 28 -0.410311716259E+03 -0.18335E+01 -0.59127E-01 13005 0.875E-01 0.620E+00
RMM: 29 -0.411399647614E+03 -0.10879E+01 -0.27014E-01 12428 0.545E-01 0.675E+00
RMM: 30 -0.412582211023E+03 -0.11826E+01 -0.84536E-01 14367 0.925E-01 0.461E+00
RMM: 31 -0.413870132212E+03 -0.12879E+01 -0.44300E-01 13532 0.671E-01 0.491E+00
RMM: 32 -0.413854505334E+03 0.15627E-01 -0.40043E-02 10610 0.257E-01 0.394E+00
RMM: 33 -0.414587817589E+03 -0.73331E+00 -0.74790E-02 11130 0.354E-01 0.297E+00
RMM: 34 -0.414981467401E+03 -0.39365E+00 -0.39493E-02 10833 0.246E-01 0.292E+00
RMM: 35 -0.415171324507E+03 -0.18986E+00 -0.22616E-02 10535 0.182E-01 0.241E+00
RMM: 36 -0.415525965989E+03 -0.35464E+00 -0.20229E-02 10752 0.159E-01 0.180E+00
RMM: 37 -0.415854548018E+03 -0.32858E+00 -0.12173E-02 10622 0.130E-01 0.144E+00
RMM: 38 -0.416064513793E+03 -0.20997E+00 -0.13413E-02 11064 0.134E-01 0.121E+00
RMM: 39 -0.416162736508E+03 -0.98223E-01 -0.14744E-02 11425 0.132E-01 0.108E+00
RMM: 40 -0.416147244161E+03 0.15492E-01 -0.10262E-02 11144 0.107E-01 0.940E-01
RMM: 41 -0.416294514898E+03 -0.14727E+00 -0.96746E-03 11306 0.970E-02 0.734E-01
RMM: 42 -0.416458275789E+03 -0.16376E+00 -0.99152E-03 11416 0.977E-02 0.589E-01
RMM: 43 -0.416521741237E+03 -0.63465E-01 -0.75115E-03 11276 0.836E-02 0.506E-01
RMM: 44 -0.416601889548E+03 -0.80148E-01 -0.55707E-03 11267 0.701E-02 0.453E-01
RMM: 45 -0.416669111982E+03 -0.67222E-01 -0.36681E-03 11144 0.568E-02 0.331E-01
RMM: 46 -0.416743851769E+03 -0.74740E-01 -0.54529E-03 11737 0.614E-02 0.198E-01
RMM: 47 -0.416799882449E+03 -0.56031E-01 -0.31634E-03 11493 0.473E-02 0.247E-01
RMM: 48 -0.416860005687E+03 -0.60123E-01 -0.18526E-03 11290 0.335E-02 0.291E-01
RMM: 49 -0.416904408321E+03 -0.44403E-01 -0.83063E-04 10969 0.252E-02 0.167E-01
RMM: 50 -0.416934551358E+03 -0.30143E-01 -0.45691E-04 10893 0.204E-02 0.792E-02
RMM: 51 -0.416953299556E+03 -0.18748E-01 -0.23833E-04 10726 0.155E-02 0.609E-02
RMM: 52 -0.416963550544E+03 -0.10251E-01 -0.10135E-04 9090 0.942E-03 0.536E-02
RMM: 53 -0.416970156934E+03 -0.66064E-02 -0.77348E-05 8781 0.734E-03 0.293E-02
RMM: 54 -0.416972432847E+03 -0.22759E-02 -0.30226E-05 7663 0.472E-03 0.210E-02
RMM: 55 -0.416973183557E+03 -0.75071E-03 -0.15241E-05 6806 0.328E-03 0.124E-02
RMM: 56 -0.416973380765E+03 -0.19721E-03 -0.75566E-06 6533 0.234E-03 0.102E-02
RMM: 57 -0.416973550638E+03 -0.16987E-03 -0.39821E-06 5316 0.173E-03 0.900E-03
RMM: 58 -0.416973675893E+03 -0.12526E-03 -0.27001E-06 4784 0.142E-03 0.778E-03
RMM: 59 -0.416973754585E+03 -0.78692E-04 -0.20030E-06 4263 0.125E-03 0.795E-03
RMM: 60 -0.416973798390E+03 -0.43806E-04 -0.76513E-07 3419 0.102E-03 0.539E-03
RMM: 61 -0.416973850795E+03 -0.52405E-04 -0.66340E-07 3680 0.105E-03 0.282E-03
RMM: 62 -0.416973950647E+03 -0.99852E-04 -0.96788E-07 3832 0.104E-03 0.303E-03
RMM: 63 -0.416974034357E+03 -0.83710E-04 -0.73231E-07 3654 0.101E-03 0.191E-03
RMM: 64 -0.416974103750E+03 -0.69393E-04 -0.23387E-07 2763 0.848E-04 0.208E-03
RMM: 65 -0.416974173627E+03 -0.69876E-04 -0.43694E-07 3158 0.909E-04 0.151E-03
RMM: 66 -0.416974223948E+03 -0.50321E-04 -0.42974E-07 3114 0.882E-04 0.999E-04
RMM: 67 -0.416974258133E+03 -0.34185E-04 -0.29917E-07 2864 0.839E-04 0.103E-03
RMM: 68 -0.416974278465E+03 -0.20332E-04 -0.27739E-07 2922 0.861E-04 0.562E-04
RMM: 69 -0.416974286018E+03 -0.75539E-05 -0.10740E-07 2451 0.783E-04
1 F= -.45465130E+03 E0= -.45465218E+03 d E =0.261913E-02 mag= -0.0005