iterations/neb0_image02_iter42_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422696581502E+04 0.42270E+04 -0.25387E+05 8992 0.103E+03
DAV: 2 -0.104310106036E+03 -0.43313E+04 -0.39264E+04 11016 0.248E+02
DAV: 3 -0.426743974494E+03 -0.32243E+03 -0.30127E+03 10208 0.657E+01
DAV: 4 -0.435243034161E+03 -0.84991E+01 -0.83989E+01 10792 0.107E+01
DAV: 5 -0.435538588589E+03 -0.29555E+00 -0.29478E+00 11264 0.195E+00 0.999E+01
RMM: 6 -0.388966892944E+03 0.46572E+02 -0.11060E+02 9701 0.145E+01 0.726E+01
RMM: 7 -0.794689954275E+03 -0.40572E+03 -0.43267E+02 11330 0.193E+01 0.148E+02
RMM: 8 -0.496986170160E+03 0.29770E+03 -0.11060E+02 10018 0.111E+01 0.911E+01
RMM: 9 -0.420582557103E+03 0.76404E+02 -0.67221E+01 10164 0.106E+01 0.588E+01
RMM: 10 -0.375046200699E+03 0.45536E+02 -0.38242E+01 10278 0.801E+00 0.313E+01
RMM: 11 -0.390797763151E+03 -0.15752E+02 -0.20270E+01 10379 0.522E+00 0.450E+01
RMM: 12 -0.376572375149E+03 0.14225E+02 -0.56600E+00 9926 0.329E+00 0.282E+01
RMM: 13 -0.373928692935E+03 0.26437E+01 -0.28546E+00 10211 0.227E+00 0.205E+01
RMM: 14 -0.374803147046E+03 -0.87445E+00 -0.15080E+00 10258 0.162E+00 0.133E+01
RMM: 15 -0.379698674910E+03 -0.48955E+01 -0.12278E+00 10456 0.144E+00 0.155E+01
RMM: 16 -0.382545205553E+03 -0.28465E+01 -0.14438E+00 10629 0.158E+00 0.130E+01
RMM: 17 -0.386102547877E+03 -0.35573E+01 -0.14640E+00 10872 0.149E+00 0.942E+00
RMM: 18 -0.391097591449E+03 -0.49950E+01 -0.14209E+00 11067 0.139E+00 0.739E+00
RMM: 19 -0.394282967914E+03 -0.31854E+01 -0.76643E-01 10674 0.108E+00 0.770E+00
RMM: 20 -0.397789565485E+03 -0.35066E+01 -0.12431E+00 11495 0.123E+00 0.764E+00
RMM: 21 -0.399313139960E+03 -0.15236E+01 -0.40593E-01 10750 0.715E-01 0.729E+00
RMM: 22 -0.401376902320E+03 -0.20638E+01 -0.56216E-01 11337 0.776E-01 0.740E+00
RMM: 23 -0.404671814015E+03 -0.32949E+01 -0.14851E+00 12627 0.115E+00 0.681E+00
RMM: 24 -0.407680472395E+03 -0.30087E+01 -0.11256E+00 12486 0.954E-01 0.516E+00
RMM: 25 -0.409542547563E+03 -0.18621E+01 -0.19147E-01 11064 0.423E-01 0.477E+00
RMM: 26 -0.410184198093E+03 -0.64165E+00 -0.40298E-02 10532 0.195E-01 0.476E+00
RMM: 27 -0.410225612757E+03 -0.41415E-01 -0.69952E-03 11260 0.744E-02 0.473E+00
RMM: 28 -0.410207252598E+03 0.18360E-01 -0.16422E-03 10207 0.452E-02 0.484E+00
RMM: 29 -0.410320418853E+03 -0.11317E+00 -0.32704E-02 14359 0.190E-01 0.541E+00
RMM: 30 -0.410030664374E+03 0.28975E+00 -0.17936E-02 13557 0.157E-01 0.615E+00
RMM: 31 -0.409517555569E+03 0.51311E+00 -0.10505E-02 12577 0.126E-01 0.671E+00
RMM: 32 -0.409136342324E+03 0.38121E+00 -0.49784E-03 11306 0.864E-02 0.706E+00
RMM: 33 -0.408770402519E+03 0.36594E+00 -0.76881E-02 16054 0.325E-01 0.806E+00
RMM: 34 -0.408625500809E+03 0.14490E+00 -0.49016E-02 15170 0.270E-01 0.771E+00
RMM: 35 -0.408577648025E+03 0.47853E-01 -0.57609E-02 15297 0.301E-01 0.832E+00
RMM: 36 -0.409441802254E+03 -0.86415E+00 -0.72716E-02 15534 0.360E-01 0.695E+00
RMM: 37 -0.411417492710E+03 -0.19757E+01 -0.11429E+00 17900 0.119E+00 0.523E+00
RMM: 38 -0.414162102144E+03 -0.27446E+01 -0.46218E-01 17541 0.668E-01 0.836E+00
RMM: 39 -0.413770329555E+03 0.39177E+00 -0.20976E-02 12790 0.184E-01 0.855E+00
RMM: 40 -0.413959332961E+03 -0.18900E+00 -0.16281E-01 16541 0.375E-01 0.514E+00
RMM: 41 -0.414763519961E+03 -0.80419E+00 -0.12759E-01 16726 0.420E-01 0.600E+00
RMM: 42 -0.414609674381E+03 0.15385E+00 -0.43799E-02 15173 0.237E-01 0.556E+00
RMM: 43 -0.414826790240E+03 -0.21712E+00 -0.37279E-02 14991 0.211E-01 0.471E+00
RMM: 44 -0.415204471003E+03 -0.37768E+00 -0.80284E-02 16201 0.325E-01 0.327E+00
RMM: 45 -0.415558900358E+03 -0.35443E+00 -0.16120E-02 13289 0.157E-01 0.281E+00
RMM: 46 -0.415769762049E+03 -0.21086E+00 -0.76200E-03 11747 0.112E-01 0.262E+00
RMM: 47 -0.415943333673E+03 -0.17357E+00 -0.17061E-02 12740 0.149E-01 0.217E+00
RMM: 48 -0.416064401587E+03 -0.12107E+00 -0.70184E-03 11277 0.885E-02 0.177E+00
RMM: 49 -0.416167088804E+03 -0.10269E+00 -0.31243E-03 10696 0.611E-02 0.153E+00
RMM: 50 -0.416258931070E+03 -0.91842E-01 -0.49276E-03 11480 0.711E-02 0.128E+00
RMM: 51 -0.416233965287E+03 0.24966E-01 -0.74471E-02 16222 0.275E-01 0.126E+00
RMM: 52 -0.416363105597E+03 -0.12914E+00 -0.13343E-02 13204 0.136E-01 0.525E-01
RMM: 53 -0.416478281756E+03 -0.11518E+00 -0.10061E-02 12750 0.107E-01 0.693E-01
RMM: 54 -0.416629581379E+03 -0.15130E+00 -0.14660E-02 12942 0.119E-01 0.395E-01
RMM: 55 -0.416710119277E+03 -0.80538E-01 -0.67090E-03 11991 0.731E-02 0.351E-01
RMM: 56 -0.416757910701E+03 -0.47791E-01 -0.22299E-03 11111 0.475E-02 0.283E-01
RMM: 57 -0.416802537733E+03 -0.44627E-01 -0.59952E-03 12349 0.767E-02 0.328E-01
RMM: 58 -0.416843022331E+03 -0.40485E-01 -0.27312E-03 11605 0.468E-02 0.291E-01
RMM: 59 -0.416902346003E+03 -0.59324E-01 -0.50456E-03 12621 0.639E-02 0.201E-01
RMM: 60 -0.416936678210E+03 -0.34332E-01 -0.13772E-03 11384 0.344E-02 0.171E-01
RMM: 61 -0.416956360649E+03 -0.19682E-01 -0.51170E-04 10695 0.237E-02 0.155E-01
RMM: 62 -0.416998261666E+03 -0.41901E-01 -0.96276E-04 11650 0.271E-02 0.123E-01
RMM: 63 -0.417029537862E+03 -0.31276E-01 -0.29244E-04 10948 0.166E-02 0.110E-01
RMM: 64 -0.417049195275E+03 -0.19657E-01 -0.10889E-04 10269 0.117E-02 0.927E-02
RMM: 65 -0.417059396475E+03 -0.10201E-01 -0.60268E-05 8600 0.741E-03 0.850E-02
RMM: 66 -0.417063842176E+03 -0.44457E-02 -0.69685E-05 8465 0.730E-03 0.767E-02
RMM: 67 -0.417065760249E+03 -0.19181E-02 -0.34290E-05 7708 0.612E-03 0.653E-02
RMM: 68 -0.417066542490E+03 -0.78224E-03 -0.30995E-05 7470 0.445E-03 0.561E-02
RMM: 69 -0.417066869990E+03 -0.32750E-03 -0.86949E-06 6450 0.268E-03 0.519E-02
RMM: 70 -0.417067144103E+03 -0.27411E-03 -0.86594E-06 6520 0.253E-03 0.475E-02
RMM: 71 -0.417067278980E+03 -0.13488E-03 -0.10308E-05 6579 0.257E-03 0.429E-02
RMM: 72 -0.417067665751E+03 -0.38677E-03 -0.82056E-06 6458 0.243E-03 0.375E-02
RMM: 73 -0.417067902541E+03 -0.23679E-03 -0.17774E-05 6808 0.313E-03 0.371E-02
RMM: 74 -0.417067927893E+03 -0.25353E-04 -0.55241E-06 5463 0.197E-03 0.293E-02
RMM: 75 -0.417067972824E+03 -0.44931E-04 -0.87972E-06 6453 0.234E-03 0.233E-02
RMM: 76 -0.417068023616E+03 -0.50792E-04 -0.80928E-06 5957 0.216E-03 0.209E-02
RMM: 77 -0.417068083981E+03 -0.60365E-04 -0.15529E-06 4124 0.129E-03 0.174E-02
RMM: 78 -0.417068097866E+03 -0.13885E-04 -0.37162E-06 5573 0.162E-03 0.144E-02
RMM: 79 -0.417068112818E+03 -0.14952E-04 -0.67595E-06 6123 0.201E-03 0.118E-02
RMM: 80 -0.417068122001E+03 -0.91824E-05 -0.20603E-06 4321 0.138E-03
1 F= -.45479114E+03 E0= -.45479135E+03 d E =0.606299E-03 mag= -0.0005