./iterations/neb0_image08_iter28_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 0.210505947411E+04 0.21051E+04 -0.11606E+05 1696 0.105E+03
DAV: 2 -0.140918204925E+03 -0.22460E+04 -0.21565E+04 2160 0.262E+02
DAV: 3 -0.466557524276E+03 -0.32564E+03 -0.32234E+03 1864 0.108E+02
DAV: 4 -0.478837147148E+03 -0.12280E+02 -0.12229E+02 1944 0.224E+01
DAV: 5 -0.479302201397E+03 -0.46505E+00 -0.46480E+00 2136 0.381E+00 0.429E+01
DAV: 6 -0.447669505909E+03 0.31633E+02 -0.14472E+02 1992 0.313E+01 0.271E+01
DAV: 7 -0.447703452250E+03 -0.33946E-01 -0.38377E+01 1848 0.112E+01 0.135E+01
DAV: 8 -0.447205940351E+03 0.49751E+00 -0.76942E+00 2544 0.821E+00 0.993E+00
DAV: 9 -0.445804782197E+03 0.14012E+01 -0.71366E+00 2056 0.452E+00 0.551E+00
DAV: 10 -0.446433926211E+03 -0.62914E+00 -0.63075E+00 2184 0.431E+00 0.641E+00
DAV: 11 -0.445650737230E+03 0.78319E+00 -0.65677E-01 1920 0.220E+00 0.328E+00
DAV: 12 -0.445677682117E+03 -0.26945E-01 -0.17954E+00 2008 0.167E+00 0.411E+00
DAV: 13 -0.445605616517E+03 0.72066E-01 -0.85904E-01 1880 0.912E-01 0.112E+00
DAV: 14 -0.445619620606E+03 -0.14004E-01 -0.91451E-02 1832 0.366E-01 0.142E+00
DAV: 15 -0.445635997442E+03 -0.16377E-01 -0.31424E-02 1920 0.373E-01 0.205E+00
DAV: 16 -0.445613281868E+03 0.22716E-01 -0.66163E-02 2144 0.304E-01 0.718E-01
DAV: 17 -0.445616583114E+03 -0.33012E-02 -0.15516E-02 1952 0.201E-01 0.242E-01
DAV: 18 -0.445619256435E+03 -0.26733E-02 -0.17868E-03 1888 0.122E-01 0.184E-01
DAV: 19 -0.445620554661E+03 -0.12982E-02 -0.50175E-03 1872 0.120E-01 0.309E-01
DAV: 20 -0.445621143724E+03 -0.58906E-03 -0.61683E-04 1976 0.925E-02 0.164E-01
DAV: 21 -0.445622951701E+03 -0.18080E-02 -0.17301E-03 1960 0.926E-02 0.816E-02
DAV: 22 -0.445624647160E+03 -0.16955E-02 -0.43570E-04 1840 0.483E-02 0.117E-01
DAV: 23 -0.445625449804E+03 -0.80264E-03 -0.78023E-04 1936 0.464E-02 0.924E-02
DAV: 24 -0.445625842890E+03 -0.39309E-03 -0.14624E-04 1768 0.257E-02 0.325E-02
DAV: 25 -0.445626060580E+03 -0.21769E-03 -0.71740E-05 1736 0.224E-02 0.244E-02
DAV: 26 -0.445626139874E+03 -0.79295E-04 -0.15817E-05 1064 0.886E-03 0.762E-03
DAV: 27 -0.445626219778E+03 -0.79904E-04 -0.92817E-06 1152 0.634E-03 0.110E-02
DAV: 28 -0.445626247424E+03 -0.27646E-04 -0.27413E-06 944 0.432E-03 0.243E-03
DAV: 29 -0.445626279785E+03 -0.32361E-04 -0.26803E-06 1048 0.358E-03 0.121E-03
DAV: 30 -0.445626288392E+03 -0.86072E-05 -0.64735E-07 936 0.173E-03
1 F= -.44562629E+03 E0= -.44560196E+03 d E =-.729919E-01