./iterations/neb0_image09_iter3_OSZICAR.out output for 39: 512-->524:: F2 + Si-NH-Si on surface slat V5 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.210142631577E+04 0.21014E+04 -0.11614E+05 1704 0.105E+03
DAV: 2 -0.141543918040E+03 -0.22430E+04 -0.21532E+04 2152 0.262E+02
DAV: 3 -0.466226981150E+03 -0.32468E+03 -0.32133E+03 1840 0.108E+02
DAV: 4 -0.478927248776E+03 -0.12700E+02 -0.12651E+02 1952 0.227E+01
DAV: 5 -0.479389003775E+03 -0.46175E+00 -0.46149E+00 2128 0.379E+00 0.430E+01
DAV: 6 -0.447061068529E+03 0.32328E+02 -0.14339E+02 2016 0.309E+01 0.272E+01
DAV: 7 -0.448447763509E+03 -0.13867E+01 -0.67030E+01 1912 0.111E+01 0.136E+01
DAV: 8 -0.446246258599E+03 0.22015E+01 -0.77894E+00 2520 0.800E+00 0.989E+00
DAV: 9 -0.446610102208E+03 -0.36384E+00 -0.21218E+01 2000 0.464E+00 0.550E+00
DAV: 10 -0.445615496731E+03 0.99461E+00 -0.87655E-01 2184 0.410E+00 0.244E+00
DAV: 11 -0.445643949549E+03 -0.28453E-01 -0.10733E+00 1888 0.152E+00 0.229E+00
DAV: 12 -0.445656435141E+03 -0.12486E-01 -0.10729E+00 1960 0.949E-01 0.291E+00
DAV: 13 -0.445694768302E+03 -0.38333E-01 -0.16109E+00 2336 0.958E-01 0.365E+00
DAV: 14 -0.445603595121E+03 0.91173E-01 -0.36709E-01 2016 0.652E-01 0.520E-01
DAV: 15 -0.445612782332E+03 -0.91872E-02 -0.41022E-02 2032 0.349E-01 0.643E-01
DAV: 16 -0.445613129191E+03 -0.34686E-03 -0.55746E-03 1800 0.163E-01 0.239E-01
DAV: 17 -0.445615409422E+03 -0.22802E-02 -0.14481E-03 2048 0.822E-02 0.385E-01
DAV: 18 -0.445617826495E+03 -0.24171E-02 -0.67013E-03 1976 0.102E-01 0.285E-01
DAV: 19 -0.445619296593E+03 -0.14701E-02 -0.12069E-03 1832 0.723E-02 0.908E-02
DAV: 20 -0.445621359462E+03 -0.20629E-02 -0.70878E-04 1976 0.612E-02 0.319E-02
DAV: 21 -0.445622683502E+03 -0.13240E-02 -0.24544E-04 1800 0.316E-02 0.662E-02
DAV: 22 -0.445623324044E+03 -0.64054E-03 -0.17156E-04 2032 0.295E-02 0.165E-02
DAV: 23 -0.445623564554E+03 -0.24051E-03 -0.72465E-05 1624 0.175E-02 0.454E-02
DAV: 24 -0.445623695190E+03 -0.13064E-03 -0.30951E-05 1400 0.132E-02 0.302E-02
DAV: 25 -0.445623756626E+03 -0.61436E-04 -0.16528E-05 1040 0.834E-03 0.545E-03
DAV: 26 -0.445623846560E+03 -0.89934E-04 -0.10414E-05 1136 0.870E-03 0.323E-03
DAV: 27 -0.445623883278E+03 -0.36718E-04 -0.33707E-06 1016 0.389E-03 0.587E-03
DAV: 28 -0.445623897724E+03 -0.14446E-04 -0.13438E-06 936 0.301E-03 0.163E-03
DAV: 29 -0.445623914074E+03 -0.16350E-04 -0.22040E-06 992 0.372E-03 0.259E-03
DAV: 30 -0.445623918375E+03 -0.43016E-05 -0.51801E-07 936 0.202E-03
1 F= -.44562392E+03 E0= -.44559942E+03 d E =-.734864E-01