./iterations/neb0_image08_iter66_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 0.210229151667E+04 0.21023E+04 -0.11603E+05 1696 0.105E+03
DAV: 2 -0.142296553278E+03 -0.22446E+04 -0.21541E+04 2176 0.262E+02
DAV: 3 -0.466261806865E+03 -0.32397E+03 -0.32069E+03 1824 0.108E+02
DAV: 4 -0.479024451972E+03 -0.12763E+02 -0.12712E+02 1992 0.227E+01
DAV: 5 -0.479485032743E+03 -0.46058E+00 -0.46035E+00 2104 0.381E+00 0.427E+01
DAV: 6 -0.447485360278E+03 0.32000E+02 -0.14343E+02 2016 0.311E+01 0.271E+01
DAV: 7 -0.448538847295E+03 -0.10535E+01 -0.63511E+01 1864 0.110E+01 0.137E+01
DAV: 8 -0.446731612197E+03 0.18072E+01 -0.84576E+00 2488 0.803E+00 0.999E+00
DAV: 9 -0.446619933583E+03 0.11168E+00 -0.16792E+01 2024 0.450E+00 0.550E+00
DAV: 10 -0.445931624277E+03 0.68831E+00 -0.81522E-01 2192 0.431E+00 0.470E+00
DAV: 11 -0.445888633975E+03 0.42990E-01 -0.26349E+00 1920 0.192E+00 0.404E+00
DAV: 12 -0.445816853509E+03 0.71780E-01 -0.16170E+00 1952 0.113E+00 0.259E+00
DAV: 13 -0.445843585425E+03 -0.26732E-01 -0.10386E+00 2024 0.760E-01 0.309E+00
DAV: 14 -0.445787671539E+03 0.55914E-01 -0.43722E-01 2072 0.670E-01 0.669E-01
DAV: 15 -0.445795723607E+03 -0.80521E-02 -0.14772E-02 1904 0.280E-01 0.446E-01
DAV: 16 -0.445795810922E+03 -0.87315E-04 -0.33311E-03 1912 0.123E-01 0.242E-01
DAV: 17 -0.445797360308E+03 -0.15494E-02 -0.19409E-03 1976 0.938E-02 0.903E-02
DAV: 18 -0.445799882058E+03 -0.25217E-02 -0.38404E-04 1880 0.592E-02 0.105E-01
DAV: 19 -0.445802569352E+03 -0.26873E-02 -0.77109E-04 1984 0.700E-02 0.245E-01
DAV: 20 -0.445804028709E+03 -0.14594E-02 -0.12779E-03 2048 0.834E-02 0.283E-01
DAV: 21 -0.445804730551E+03 -0.70184E-03 -0.53010E-04 1792 0.529E-02 0.263E-02
DAV: 22 -0.445805117033E+03 -0.38648E-03 -0.12995E-04 1840 0.277E-02 0.152E-02
DAV: 23 -0.445805375239E+03 -0.25821E-03 -0.77307E-05 1712 0.219E-02 0.285E-02
DAV: 24 -0.445805524273E+03 -0.14903E-03 -0.39630E-05 1568 0.178E-02 0.201E-02
DAV: 25 -0.445805591951E+03 -0.67678E-04 -0.20163E-05 1240 0.108E-02 0.153E-02
DAV: 26 -0.445805647623E+03 -0.55672E-04 -0.38231E-06 1032 0.549E-03 0.155E-02
DAV: 27 -0.445805683175E+03 -0.35552E-04 -0.49477E-06 1040 0.652E-03 0.520E-03
DAV: 28 -0.445805704623E+03 -0.21448E-04 -0.23646E-06 944 0.392E-03 0.612E-03
DAV: 29 -0.445805716453E+03 -0.11830E-04 -0.94629E-07 984 0.205E-03 0.203E-03
DAV: 30 -0.445805720787E+03 -0.43342E-05 -0.43960E-07 936 0.193E-03
1 F= -.44580572E+03 E0= -.44577916E+03 d E =-.796762E-01