iterations/neb0_image09_iter39_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 0.209717305707E+04 0.20972E+04 -0.11612E+05 1704 0.105E+03
DAV: 2 -0.142819981140E+03 -0.22400E+04 -0.21502E+04 2160 0.262E+02
DAV: 3 -0.466457338582E+03 -0.32364E+03 -0.32029E+03 1840 0.108E+02
DAV: 4 -0.479215753723E+03 -0.12758E+02 -0.12710E+02 1968 0.227E+01
DAV: 5 -0.479675145201E+03 -0.45939E+00 -0.45915E+00 2112 0.379E+00 0.428E+01
DAV: 6 -0.447144060475E+03 0.32531E+02 -0.14281E+02 2008 0.309E+01 0.271E+01
DAV: 7 -0.449038418505E+03 -0.18944E+01 -0.74309E+01 1928 0.111E+01 0.136E+01
DAV: 8 -0.446258212056E+03 0.27802E+01 -0.80736E+00 2448 0.801E+00 0.868E+00
DAV: 9 -0.446821365939E+03 -0.56315E+00 -0.15333E+01 1920 0.398E+00 0.490E+00
DAV: 10 -0.445985507073E+03 0.83586E+00 -0.64889E-01 2120 0.391E+00 0.314E+00
DAV: 11 -0.446083607026E+03 -0.98100E-01 -0.21341E+00 1896 0.162E+00 0.392E+00
DAV: 12 -0.446012615481E+03 0.70992E-01 -0.21587E+00 1976 0.126E+00 0.335E+00
DAV: 13 -0.446054591464E+03 -0.41976E-01 -0.19252E+00 2264 0.102E+00 0.380E+00
DAV: 14 -0.445948189639E+03 0.10640E+00 -0.26600E-01 2016 0.664E-01 0.517E-01
DAV: 15 -0.445956221012E+03 -0.80314E-02 -0.27983E-02 1992 0.285E-01 0.319E-01
DAV: 16 -0.445958071904E+03 -0.18509E-02 -0.39308E-03 1856 0.148E-01 0.106E-01
DAV: 17 -0.445960161442E+03 -0.20895E-02 -0.17376E-03 1984 0.965E-02 0.196E-01
DAV: 18 -0.445962623630E+03 -0.24622E-02 -0.18326E-03 1928 0.741E-02 0.234E-01
DAV: 19 -0.445965007776E+03 -0.23841E-02 -0.23155E-03 2216 0.110E-01 0.279E-01
DAV: 20 -0.445966370477E+03 -0.13627E-02 -0.66441E-04 1848 0.493E-02 0.967E-02
DAV: 21 -0.445967556782E+03 -0.11863E-02 -0.54288E-04 1832 0.490E-02 0.406E-02
DAV: 22 -0.445968165640E+03 -0.60886E-03 -0.19185E-04 1936 0.302E-02 0.110E-01
DAV: 23 -0.445968348225E+03 -0.18259E-03 -0.92870E-05 1600 0.201E-02 0.196E-02
DAV: 24 -0.445968597587E+03 -0.24936E-03 -0.46899E-05 1632 0.151E-02 0.418E-02
DAV: 25 -0.445968776956E+03 -0.17937E-03 -0.51038E-05 1344 0.127E-02 0.413E-02
DAV: 26 -0.445968813881E+03 -0.36926E-04 -0.94988E-06 1096 0.663E-03 0.975E-03
DAV: 27 -0.445968841729E+03 -0.27847E-04 -0.24751E-06 960 0.344E-03 0.206E-03
DAV: 28 -0.445968882555E+03 -0.40826E-04 -0.23490E-06 1072 0.292E-03 0.197E-03
DAV: 29 -0.445968890529E+03 -0.79741E-05 -0.43187E-07 936 0.149E-03
1 F= -.44596889E+03 E0= -.44594270E+03 d E =-.785642E-01