iterations/neb1_max2_image02_iter30_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422441863389E+04 0.42244E+04 -0.25383E+05 8992 0.103E+03
DAV: 2 -0.103855746954E+03 -0.43283E+04 -0.39229E+04 10976 0.248E+02
DAV: 3 -0.427308760234E+03 -0.32345E+03 -0.30211E+03 10232 0.658E+01
DAV: 4 -0.435815792186E+03 -0.85070E+01 -0.84095E+01 10784 0.107E+01
DAV: 5 -0.436104468146E+03 -0.28868E+00 -0.28790E+00 11120 0.193E+00 0.993E+01
RMM: 6 -0.389124292550E+03 0.46980E+02 -0.11221E+02 9713 0.146E+01 0.735E+01
RMM: 7 -0.811702477947E+03 -0.42258E+03 -0.44610E+02 11330 0.195E+01 0.150E+02
RMM: 8 -0.497161188252E+03 0.31454E+03 -0.11597E+02 10031 0.113E+01 0.914E+01
RMM: 9 -0.421642081960E+03 0.75519E+02 -0.65628E+01 10167 0.105E+01 0.586E+01
RMM: 10 -0.398116898436E+03 0.23525E+02 -0.41295E+01 10355 0.846E+00 0.442E+01
RMM: 11 -0.388491145550E+03 0.96258E+01 -0.25948E+01 10402 0.591E+00 0.459E+01
RMM: 12 -0.373350333489E+03 0.15141E+02 -0.80009E+00 10021 0.383E+00 0.307E+01
RMM: 13 -0.373421763333E+03 -0.71430E-01 -0.36642E+00 10154 0.258E+00 0.231E+01
RMM: 14 -0.372475725581E+03 0.94604E+00 -0.14977E+00 10132 0.162E+00 0.157E+01
RMM: 15 -0.376408950447E+03 -0.39332E+01 -0.15030E+00 10447 0.156E+00 0.119E+01
RMM: 16 -0.381307283865E+03 -0.48983E+01 -0.11807E+00 10390 0.140E+00 0.121E+01
RMM: 17 -0.387895682992E+03 -0.65884E+01 -0.24801E+00 11484 0.186E+00 0.106E+01
RMM: 18 -0.391544243225E+03 -0.36486E+01 -0.12659E+00 10839 0.132E+00 0.738E+00
RMM: 19 -0.394026220229E+03 -0.24820E+01 -0.36794E-01 10262 0.741E-01 0.700E+00
RMM: 20 -0.396854708764E+03 -0.28285E+01 -0.53544E-01 11073 0.814E-01 0.709E+00
RMM: 21 -0.400076566879E+03 -0.32219E+01 -0.95576E-01 11912 0.104E+00 0.622E+00
RMM: 22 -0.403847160812E+03 -0.37706E+01 -0.16320E+00 12634 0.125E+00 0.491E+00
RMM: 23 -0.408093100205E+03 -0.42459E+01 -0.20419E+00 13039 0.131E+00 0.641E+00
RMM: 24 -0.409353937005E+03 -0.12608E+01 -0.48290E-01 11661 0.649E-01 0.653E+00
RMM: 25 -0.409573995448E+03 -0.22006E+00 -0.74228E-02 10582 0.265E-01 0.631E+00
RMM: 26 -0.409722022489E+03 -0.14803E+00 -0.21961E-02 10719 0.130E-01 0.627E+00
RMM: 27 -0.409893561642E+03 -0.17154E+00 -0.11582E-02 10780 0.927E-02 0.631E+00
RMM: 28 -0.409340506776E+03 0.55305E+00 -0.11453E-01 13443 0.378E-01 0.605E+00
RMM: 29 -0.409109072312E+03 0.23143E+00 -0.12818E-01 14494 0.434E-01 0.617E+00
RMM: 30 -0.408804019413E+03 0.30505E+00 -0.65119E-02 13269 0.321E-01 0.644E+00
RMM: 31 -0.409470168921E+03 -0.66615E+00 -0.55374E-02 12114 0.295E-01 0.619E+00
RMM: 32 -0.412639738909E+03 -0.31696E+01 -0.17138E+00 17150 0.123E+00 0.106E+01
RMM: 33 -0.411884396591E+03 0.75534E+00 -0.85203E-02 13249 0.310E-01 0.756E+00
RMM: 34 -0.412907427143E+03 -0.10230E+01 -0.68487E-02 11961 0.222E-01 0.740E+00
RMM: 35 -0.414244376829E+03 -0.13369E+01 -0.51826E-01 15232 0.544E-01 0.719E+00
RMM: 36 -0.413958970728E+03 0.28541E+00 -0.23334E-01 14954 0.423E-01 0.624E+00
RMM: 37 -0.413988167921E+03 -0.29197E-01 -0.15473E-01 15007 0.404E-01 0.457E+00
RMM: 38 -0.414386570287E+03 -0.39840E+00 -0.12432E-02 10838 0.131E-01 0.416E+00
RMM: 39 -0.414632618082E+03 -0.24605E+00 -0.19476E-02 11194 0.142E-01 0.587E+00
RMM: 40 -0.415235158748E+03 -0.60254E+00 -0.22811E-01 14127 0.371E-01 0.386E+00
RMM: 41 -0.415317348472E+03 -0.82190E-01 -0.14542E-01 13749 0.317E-01 0.286E+00
RMM: 42 -0.415817801260E+03 -0.50045E+00 -0.11744E-01 13868 0.299E-01 0.250E+00
RMM: 43 -0.415717879893E+03 0.99921E-01 -0.38907E-02 11987 0.171E-01 0.292E+00
RMM: 44 -0.415944109627E+03 -0.22623E+00 -0.41053E-02 11909 0.170E-01 0.473E+00
RMM: 45 -0.415917219544E+03 0.26890E-01 -0.37601E-02 11562 0.155E-01 0.416E+00
RMM: 46 -0.415918008435E+03 -0.78889E-03 -0.40603E-02 11855 0.153E-01 0.375E+00
RMM: 47 -0.415833196801E+03 0.84812E-01 -0.29986E-02 12558 0.151E-01 0.351E+00
RMM: 48 -0.415622883914E+03 0.21031E+00 -0.28350E-02 13183 0.152E-01 0.284E+00
RMM: 49 -0.415813739901E+03 -0.19086E+00 -0.25612E-02 12575 0.132E-01 0.334E+00
RMM: 50 -0.416149079740E+03 -0.33534E+00 -0.31597E-02 12281 0.167E-01 0.272E+00
RMM: 51 -0.416281270575E+03 -0.13219E+00 -0.44696E-02 13797 0.213E-01 0.203E+00
RMM: 52 -0.416438143618E+03 -0.15687E+00 -0.13813E-02 11179 0.109E-01 0.144E+00
RMM: 53 -0.416521319232E+03 -0.83176E-01 -0.72243E-03 11136 0.924E-02 0.127E+00
RMM: 54 -0.416548006074E+03 -0.26687E-01 -0.45648E-03 10871 0.649E-02 0.135E+00
RMM: 55 -0.416572571560E+03 -0.24565E-01 -0.78352E-03 11841 0.750E-02 0.141E+00
RMM: 56 -0.416610304264E+03 -0.37733E-01 -0.55592E-03 11695 0.666E-02 0.126E+00
RMM: 57 -0.416656753422E+03 -0.46449E-01 -0.71517E-03 11837 0.672E-02 0.195E+00
RMM: 58 -0.416654939641E+03 0.18138E-02 -0.45177E-03 11669 0.784E-02 0.894E-01
RMM: 59 -0.416775426488E+03 -0.12049E+00 -0.44635E-03 12035 0.679E-02 0.593E-01
RMM: 60 -0.416830160889E+03 -0.54734E-01 -0.34721E-03 11903 0.540E-02 0.113E+00
RMM: 61 -0.416856139665E+03 -0.25979E-01 -0.23649E-03 11465 0.473E-02 0.667E-01
RMM: 62 -0.416907747339E+03 -0.51608E-01 -0.23268E-03 11718 0.461E-02 0.463E-01
RMM: 63 -0.416929686136E+03 -0.21939E-01 -0.12901E-03 10950 0.308E-02 0.284E-01
RMM: 64 -0.416953585779E+03 -0.23900E-01 -0.15068E-03 11601 0.316E-02 0.140E-01
RMM: 65 -0.416980545659E+03 -0.26960E-01 -0.77765E-04 11551 0.251E-02 0.110E-01
RMM: 66 -0.417010719522E+03 -0.30174E-01 -0.42695E-04 11316 0.184E-02 0.120E-01
RMM: 67 -0.417025858013E+03 -0.15138E-01 -0.27524E-04 10530 0.139E-02 0.907E-02
RMM: 68 -0.417031478323E+03 -0.56203E-02 -0.17123E-04 9935 0.107E-02 0.742E-02
RMM: 69 -0.417033992993E+03 -0.25147E-02 -0.69121E-05 8959 0.693E-03 0.702E-02
RMM: 70 -0.417034695476E+03 -0.70248E-03 -0.33036E-05 7672 0.531E-03 0.553E-02
RMM: 71 -0.417035262976E+03 -0.56750E-03 -0.15186E-05 6971 0.399E-03 0.486E-02
RMM: 72 -0.417036172147E+03 -0.90917E-03 -0.21315E-05 7058 0.402E-03 0.553E-02
RMM: 73 -0.417036944163E+03 -0.77202E-03 -0.17372E-05 7161 0.335E-03 0.575E-02
RMM: 74 -0.417037265399E+03 -0.32124E-03 -0.10354E-05 6294 0.247E-03 0.588E-02
RMM: 75 -0.417037304185E+03 -0.38786E-04 -0.45879E-06 5300 0.175E-03 0.580E-02
RMM: 76 -0.417037285551E+03 0.18634E-04 -0.46196E-06 6084 0.190E-03 0.571E-02
RMM: 77 -0.417037355925E+03 -0.70373E-04 -0.47418E-06 5989 0.209E-03 0.638E-02
RMM: 78 -0.417037389114E+03 -0.33189E-04 -0.16672E-06 4342 0.143E-03 0.660E-02
RMM: 79 -0.417037370863E+03 0.18251E-04 -0.97346E-07 4077 0.122E-03 0.675E-02
RMM: 80 -0.417037364896E+03 0.59675E-05 -0.17042E-07 2959 0.924E-04
1 F= -.45474007E+03 E0= -.45474037E+03 d E =0.901496E-03 mag= -0.0050