iterations/neb1_max2_image03_iter9_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.421513553041E+04 0.42151E+04 -0.25370E+05 8984 0.103E+03
DAV: 2 -0.101864010673E+03 -0.43170E+04 -0.39115E+04 11008 0.247E+02
DAV: 3 -0.425425260873E+03 -0.32356E+03 -0.30182E+03 10296 0.656E+01
DAV: 4 -0.434100592432E+03 -0.86753E+01 -0.85576E+01 10616 0.108E+01
DAV: 5 -0.434406760991E+03 -0.30617E+00 -0.30539E+00 11112 0.198E+00 0.964E+01
RMM: 6 -0.405218205942E+03 0.29189E+02 -0.10909E+02 9657 0.145E+01 0.853E+01
RMM: 7 -0.836199348220E+03 -0.43098E+03 -0.38951E+02 11398 0.176E+01 0.153E+02
RMM: 8 -0.470542076346E+03 0.36566E+03 -0.89116E+01 9936 0.103E+01 0.850E+01
RMM: 9 -0.464012897369E+03 0.65292E+01 -0.72519E+01 10296 0.111E+01 0.807E+01
RMM: 10 -0.375899254770E+03 0.88114E+02 -0.40796E+01 10331 0.803E+00 0.354E+01
RMM: 11 -0.368510730565E+03 0.73885E+01 -0.19758E+01 10226 0.547E+00 0.279E+01
RMM: 12 -0.366426596187E+03 0.20841E+01 -0.72433E+00 10264 0.327E+00 0.215E+01
RMM: 13 -0.368548851158E+03 -0.21223E+01 -0.39991E+00 10288 0.258E+00 0.143E+01
RMM: 14 -0.371643561946E+03 -0.30947E+01 -0.15695E+00 10189 0.162E+00 0.119E+01
RMM: 15 -0.375269735400E+03 -0.36262E+01 -0.12586E+00 10317 0.145E+00 0.122E+01
RMM: 16 -0.384999188584E+03 -0.97295E+01 -0.32922E+00 11795 0.220E+00 0.837E+00
RMM: 17 -0.387549503010E+03 -0.25503E+01 -0.77753E-01 10413 0.112E+00 0.926E+00
RMM: 18 -0.389129007112E+03 -0.15795E+01 -0.43808E-01 10436 0.779E-01 0.853E+00
RMM: 19 -0.392625639962E+03 -0.34966E+01 -0.10343E+00 11548 0.105E+00 0.734E+00
RMM: 20 -0.395540132235E+03 -0.29145E+01 -0.80851E-01 11629 0.946E-01 0.568E+00
RMM: 21 -0.398272530457E+03 -0.27324E+01 -0.55696E-01 11428 0.796E-01 0.494E+00
RMM: 22 -0.401174188108E+03 -0.29017E+01 -0.62603E-01 11765 0.836E-01 0.514E+00
RMM: 23 -0.404955343612E+03 -0.37812E+01 -0.11783E+00 12588 0.103E+00 0.529E+00
RMM: 24 -0.408192285711E+03 -0.32369E+01 -0.11372E+00 12758 0.980E-01 0.564E+00
RMM: 25 -0.409616888989E+03 -0.14246E+01 -0.60526E-01 11894 0.702E-01 0.547E+00
RMM: 26 -0.409887965797E+03 -0.27108E+00 -0.67431E-02 10456 0.263E-01 0.536E+00
RMM: 27 -0.409524189657E+03 0.36378E+00 -0.61929E-02 10417 0.286E-01 0.499E+00
RMM: 28 -0.409203272155E+03 0.32092E+00 -0.13089E-01 11542 0.455E-01 0.499E+00
RMM: 29 -0.409085979309E+03 0.11729E+00 -0.98976E-02 10959 0.368E-01 0.464E+00
RMM: 30 -0.409172841607E+03 -0.86862E-01 -0.11924E-01 11575 0.437E-01 0.562E+00
RMM: 31 -0.409345844860E+03 -0.17300E+00 -0.75965E-03 10236 0.111E-01 0.560E+00
RMM: 32 -0.410191219050E+03 -0.84537E+00 -0.15802E-01 13482 0.444E-01 0.420E+00
RMM: 33 -0.410922791506E+03 -0.73157E+00 -0.39132E-01 15144 0.630E-01 0.462E+00
RMM: 34 -0.411179292306E+03 -0.25650E+00 -0.21645E-01 14537 0.437E-01 0.506E+00
RMM: 35 -0.410943974533E+03 0.23532E+00 -0.17666E-01 14608 0.460E-01 0.448E+00
RMM: 36 -0.411620156861E+03 -0.67618E+00 -0.95873E-03 10489 0.130E-01 0.394E+00
RMM: 37 -0.411761714678E+03 -0.14156E+00 -0.16267E-03 10877 0.442E-02 0.400E+00
RMM: 38 -0.411726803312E+03 0.34911E-01 -0.52181E-03 11569 0.752E-02 0.460E+00
RMM: 39 -0.411569038958E+03 0.15776E+00 -0.88016E-03 11957 0.101E-01 0.348E+00
RMM: 40 -0.411967940077E+03 -0.39890E+00 -0.15591E-02 13403 0.137E-01 0.288E+00
RMM: 41 -0.412571393872E+03 -0.60345E+00 -0.20420E-02 14314 0.160E-01 0.288E+00
RMM: 42 -0.412842096308E+03 -0.27070E+00 -0.99612E-03 12898 0.123E-01 0.315E+00
RMM: 43 -0.412914706015E+03 -0.72610E-01 -0.94386E-03 12621 0.125E-01 0.360E+00
RMM: 44 -0.412736995205E+03 0.17771E+00 -0.86137E-03 12243 0.119E-01 0.362E+00
RMM: 45 -0.412714983015E+03 0.22012E-01 -0.11110E-02 12632 0.123E-01 0.371E+00
RMM: 46 -0.412773380225E+03 -0.58397E-01 -0.12495E-02 12893 0.125E-01 0.314E+00
RMM: 47 -0.412912400522E+03 -0.13902E+00 -0.81799E-03 12186 0.919E-02 0.217E+00
RMM: 48 -0.413174252400E+03 -0.26185E+00 -0.69608E-03 12200 0.849E-02 0.131E+00
RMM: 49 -0.413499962459E+03 -0.32571E+00 -0.59311E-03 12071 0.802E-02 0.750E-01
RMM: 50 -0.413825357327E+03 -0.32539E+00 -0.75959E-03 12301 0.878E-02 0.395E-01
RMM: 51 -0.414029222662E+03 -0.20387E+00 -0.10830E-02 12941 0.104E-01 0.944E-01
RMM: 52 -0.414057411420E+03 -0.28189E-01 -0.65632E-03 11726 0.763E-02 0.105E+00
RMM: 53 -0.414083403321E+03 -0.25992E-01 -0.35938E-03 11348 0.556E-02 0.101E+00
RMM: 54 -0.414129483407E+03 -0.46080E-01 -0.20489E-03 11124 0.396E-02 0.646E-01
RMM: 55 -0.414209920710E+03 -0.80437E-01 -0.18771E-03 11469 0.399E-02 0.335E-01
RMM: 56 -0.414262265223E+03 -0.52345E-01 -0.12399E-03 11269 0.342E-02 0.130E-01
RMM: 57 -0.414327097546E+03 -0.64832E-01 -0.90675E-04 11157 0.262E-02 0.116E-01
RMM: 58 -0.414359778125E+03 -0.32681E-01 -0.24358E-04 10528 0.152E-02 0.117E-01
RMM: 59 -0.414374938798E+03 -0.15161E-01 -0.13300E-04 9964 0.115E-02 0.690E-02
RMM: 60 -0.414379423239E+03 -0.44844E-02 -0.11374E-04 10043 0.103E-02 0.559E-02
RMM: 61 -0.414380733530E+03 -0.13103E-02 -0.43552E-05 8517 0.700E-03 0.838E-02
RMM: 62 -0.414381886614E+03 -0.11531E-02 -0.25971E-05 7591 0.503E-03 0.898E-02
RMM: 63 -0.414382586024E+03 -0.69941E-03 -0.11627E-05 6639 0.361E-03 0.764E-02
RMM: 64 -0.414382692142E+03 -0.10612E-03 -0.16459E-05 7027 0.381E-03 0.367E-02
RMM: 65 -0.414382611468E+03 0.80674E-04 -0.54811E-06 6391 0.246E-03 0.300E-02
RMM: 66 -0.414382659548E+03 -0.48080E-04 -0.25072E-06 5741 0.175E-03 0.334E-02
RMM: 67 -0.414382696533E+03 -0.36985E-04 -0.26652E-06 5701 0.165E-03 0.285E-02
RMM: 68 -0.414382808870E+03 -0.11234E-03 -0.22928E-06 5546 0.152E-03 0.235E-02
RMM: 69 -0.414382912765E+03 -0.10389E-03 -0.34680E-06 6188 0.173E-03 0.417E-03
RMM: 70 -0.414383057361E+03 -0.14460E-03 -0.15521E-06 4474 0.126E-03 0.369E-03
RMM: 71 -0.414383189385E+03 -0.13202E-03 -0.18022E-06 4691 0.128E-03 0.761E-03
RMM: 72 -0.414383262378E+03 -0.72993E-04 -0.86606E-07 3573 0.101E-03 0.676E-03
RMM: 73 -0.414383304702E+03 -0.42325E-04 -0.69487E-07 3461 0.969E-04 0.531E-03
RMM: 74 -0.414383336758E+03 -0.32056E-04 -0.37096E-07 3078 0.918E-04 0.385E-03
RMM: 75 -0.414383359409E+03 -0.22651E-04 -0.23744E-07 2801 0.896E-04 0.263E-03
RMM: 76 -0.414383385600E+03 -0.26191E-04 -0.58567E-07 3555 0.999E-04 0.164E-03
RMM: 77 -0.414383393321E+03 -0.77212E-05 -0.21038E-07 2716 0.858E-04
1 F= -.45211782E+03 E0= -.45211728E+03 d E =-.164159E-02 mag= -0.0008