./iterations/neb0_image08_iter50_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 0.210247905937E+04 0.21025E+04 -0.11603E+05 1696 0.105E+03
DAV: 2 -0.142049112059E+03 -0.22445E+04 -0.21542E+04 2176 0.262E+02
DAV: 3 -0.466139349702E+03 -0.32409E+03 -0.32080E+03 1824 0.108E+02
DAV: 4 -0.478931459928E+03 -0.12792E+02 -0.12742E+02 2000 0.227E+01
DAV: 5 -0.479383318305E+03 -0.45186E+00 -0.45164E+00 2088 0.378E+00 0.427E+01
DAV: 6 -0.447622733977E+03 0.31761E+02 -0.14406E+02 2000 0.310E+01 0.271E+01
DAV: 7 -0.448300947712E+03 -0.67821E+00 -0.56901E+01 1840 0.111E+01 0.136E+01
DAV: 8 -0.446891622280E+03 0.14093E+01 -0.82421E+00 2448 0.792E+00 0.993E+00
DAV: 9 -0.446387604658E+03 0.50402E+00 -0.12918E+01 2008 0.453E+00 0.557E+00
DAV: 10 -0.446086412721E+03 0.30119E+00 -0.88905E-01 2216 0.439E+00 0.605E+00
DAV: 11 -0.445767432958E+03 0.31898E+00 -0.35022E+00 1920 0.210E+00 0.293E+00
DAV: 12 -0.445763041578E+03 0.43914E-02 -0.95521E-01 1944 0.107E+00 0.219E+00
DAV: 13 -0.445774853288E+03 -0.11812E-01 -0.69387E-01 1992 0.671E-01 0.249E+00
DAV: 14 -0.445743149878E+03 0.31703E-01 -0.29120E-01 2072 0.559E-01 0.605E-01
DAV: 15 -0.445749969163E+03 -0.68193E-02 -0.16399E-02 1912 0.271E-01 0.514E-01
DAV: 16 -0.445749484368E+03 0.48480E-03 -0.49372E-03 1872 0.127E-01 0.228E-01
DAV: 17 -0.445751159133E+03 -0.16748E-02 -0.18126E-03 2024 0.922E-02 0.149E-01
DAV: 18 -0.445753829070E+03 -0.26699E-02 -0.54414E-04 1896 0.720E-02 0.564E-02
DAV: 19 -0.445756234047E+03 -0.24050E-02 -0.64712E-04 1848 0.627E-02 0.213E-01
DAV: 20 -0.445756945849E+03 -0.71180E-03 -0.35726E-04 1880 0.498E-02 0.340E-02
DAV: 21 -0.445758497367E+03 -0.15515E-02 -0.30337E-04 1832 0.355E-02 0.998E-02
DAV: 22 -0.445759172433E+03 -0.67507E-03 -0.17559E-04 1792 0.290E-02 0.430E-02
DAV: 23 -0.445759422833E+03 -0.25040E-03 -0.66420E-05 1744 0.195E-02 0.236E-02
DAV: 24 -0.445759527815E+03 -0.10498E-03 -0.20042E-05 1216 0.130E-02 0.125E-02
DAV: 25 -0.445759569893E+03 -0.42078E-04 -0.11543E-05 968 0.842E-03 0.107E-02
DAV: 26 -0.445759625790E+03 -0.55897E-04 -0.38418E-06 1056 0.496E-03 0.140E-02
DAV: 27 -0.445759667214E+03 -0.41424E-04 -0.39914E-06 1072 0.632E-03 0.543E-03
DAV: 28 -0.445759680918E+03 -0.13704E-04 -0.14817E-06 936 0.317E-03 0.304E-03
DAV: 29 -0.445759688230E+03 -0.73115E-05 -0.74151E-07 936 0.212E-03
1 F= -.44575969E+03 E0= -.44573421E+03 d E =-.764298E-01