iterations/neb0_image08_iter10_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 0.210432004282E+04 0.21043E+04 -0.11604E+05 1696 0.105E+03
DAV: 2 -0.138800999059E+03 -0.22431E+04 -0.21538E+04 2160 0.262E+02
DAV: 3 -0.465508840925E+03 -0.32671E+03 -0.32323E+03 1864 0.108E+02
DAV: 4 -0.478030130381E+03 -0.12521E+02 -0.12472E+02 1928 0.226E+01
DAV: 5 -0.478525196461E+03 -0.49507E+00 -0.49481E+00 2120 0.390E+00 0.427E+01
DAV: 6 -0.447679701416E+03 0.30845E+02 -0.14489E+02 2016 0.314E+01 0.270E+01
DAV: 7 -0.446817220895E+03 0.86248E+00 -0.25273E+01 1880 0.114E+01 0.134E+01
DAV: 8 -0.447321619317E+03 -0.50440E+00 -0.76728E+00 2536 0.865E+00 0.989E+00
DAV: 9 -0.445325882205E+03 0.19957E+01 -0.23349E+00 2168 0.463E+00 0.456E+00
DAV: 10 -0.446071589657E+03 -0.74571E+00 -0.88807E+00 2088 0.421E+00 0.729E+00
DAV: 11 -0.445239135020E+03 0.83245E+00 -0.78870E-01 2208 0.304E+00 0.183E+00
DAV: 12 -0.445408623855E+03 -0.16949E+00 -0.17331E+00 1944 0.121E+00 0.493E+00
DAV: 13 -0.445291741997E+03 0.11688E+00 -0.23826E+00 2504 0.150E+00 0.247E+00
DAV: 14 -0.445287637590E+03 0.41044E-02 -0.46233E-02 1816 0.524E-01 0.175E+00
DAV: 15 -0.445273461409E+03 0.14176E-01 -0.13747E-01 2128 0.601E-01 0.875E-01
DAV: 16 -0.445274390890E+03 -0.92948E-03 -0.23461E-02 1896 0.268E-01 0.300E-01
DAV: 17 -0.445275672433E+03 -0.12815E-02 -0.22329E-03 2016 0.118E-01 0.322E-01
DAV: 18 -0.445276923257E+03 -0.12508E-02 -0.47486E-03 2160 0.141E-01 0.271E-01
DAV: 19 -0.445279341945E+03 -0.24187E-02 -0.92522E-04 1792 0.711E-02 0.170E-01
DAV: 20 -0.445281107194E+03 -0.17652E-02 -0.91232E-04 1984 0.637E-02 0.628E-02
DAV: 21 -0.445282312436E+03 -0.12052E-02 -0.22013E-04 1816 0.354E-02 0.228E-02
DAV: 22 -0.445283276661E+03 -0.96422E-03 -0.14908E-04 1736 0.273E-02 0.240E-02
DAV: 23 -0.445283523742E+03 -0.24708E-03 -0.50083E-05 1648 0.160E-02 0.101E-02
DAV: 24 -0.445283683889E+03 -0.16015E-03 -0.28424E-05 1504 0.113E-02 0.162E-02
DAV: 25 -0.445283724324E+03 -0.40435E-04 -0.76316E-06 992 0.674E-03 0.771E-03
DAV: 26 -0.445283782071E+03 -0.57747E-04 -0.96286E-06 1096 0.885E-03 0.869E-03
DAV: 27 -0.445283822135E+03 -0.40065E-04 -0.53801E-06 1032 0.551E-03 0.106E-02
DAV: 28 -0.445283838532E+03 -0.16397E-04 -0.34948E-06 936 0.492E-03 0.210E-03
DAV: 29 -0.445283850756E+03 -0.12224E-04 -0.10862E-06 976 0.246E-03 0.495E-03
DAV: 30 -0.445283857293E+03 -0.65368E-05 -0.72196E-07 936 0.228E-03
1 F= -.44528386E+03 E0= -.44526354E+03 d E =-.609442E-01