iterations/neb0_image09_iter34_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 0.209795411322E+04 0.20980E+04 -0.11612E+05 1704 0.105E+03
DAV: 2 -0.142594201269E+03 -0.22405E+04 -0.21509E+04 2160 0.262E+02
DAV: 3 -0.466501299232E+03 -0.32391E+03 -0.32056E+03 1840 0.108E+02
DAV: 4 -0.479258016528E+03 -0.12757E+02 -0.12708E+02 1968 0.227E+01
DAV: 5 -0.479718034707E+03 -0.46002E+00 -0.45978E+00 2120 0.379E+00 0.428E+01
DAV: 6 -0.447120490319E+03 0.32598E+02 -0.14301E+02 2032 0.308E+01 0.271E+01
DAV: 7 -0.449039015060E+03 -0.19185E+01 -0.74382E+01 1912 0.111E+01 0.137E+01
DAV: 8 -0.446246983073E+03 0.27920E+01 -0.81212E+00 2432 0.802E+00 0.869E+00
DAV: 9 -0.446812166133E+03 -0.56518E+00 -0.15229E+01 1912 0.398E+00 0.491E+00
DAV: 10 -0.445980580666E+03 0.83159E+00 -0.67016E-01 2144 0.392E+00 0.327E+00
DAV: 11 -0.446093958916E+03 -0.11338E+00 -0.23658E+00 1912 0.165E+00 0.408E+00
DAV: 12 -0.445992016125E+03 0.10194E+00 -0.20972E+00 1944 0.129E+00 0.316E+00
DAV: 13 -0.446019272409E+03 -0.27256E-01 -0.15708E+00 2176 0.946E-01 0.341E+00
DAV: 14 -0.445938554599E+03 0.80718E-01 -0.45376E-01 1984 0.671E-01 0.480E-01
DAV: 15 -0.445947529479E+03 -0.89749E-02 -0.17526E-02 1960 0.258E-01 0.483E-01
DAV: 16 -0.445947570719E+03 -0.41240E-04 -0.39941E-03 1872 0.134E-01 0.984E-02
DAV: 17 -0.445949748329E+03 -0.21776E-02 -0.14913E-03 1912 0.856E-02 0.132E-01
DAV: 18 -0.445953005594E+03 -0.32573E-02 -0.54132E-03 2032 0.775E-02 0.410E-01
DAV: 19 -0.445955042572E+03 -0.20370E-02 -0.87594E-03 2264 0.126E-01 0.362E-01
DAV: 20 -0.445956051163E+03 -0.10086E-02 -0.10328E-03 1880 0.618E-02 0.437E-02
DAV: 21 -0.445957138642E+03 -0.10875E-02 -0.40541E-04 1816 0.447E-02 0.250E-02
DAV: 22 -0.445957653491E+03 -0.51485E-03 -0.23518E-04 1864 0.321E-02 0.800E-02
DAV: 23 -0.445957870901E+03 -0.21741E-03 -0.41221E-05 1608 0.159E-02 0.512E-02
DAV: 24 -0.445958017254E+03 -0.14635E-03 -0.75656E-05 1720 0.204E-02 0.971E-03
DAV: 25 -0.445958131321E+03 -0.11407E-03 -0.11513E-05 1120 0.857E-03 0.530E-03
DAV: 26 -0.445958227221E+03 -0.95899E-04 -0.10383E-05 1168 0.651E-03 0.154E-02
DAV: 27 -0.445958248022E+03 -0.20801E-04 -0.36496E-06 936 0.421E-03 0.734E-03
DAV: 28 -0.445958281051E+03 -0.33029E-04 -0.21529E-06 1016 0.410E-03 0.422E-03
DAV: 29 -0.445958297190E+03 -0.16140E-04 -0.15281E-06 968 0.240E-03 0.589E-03
DAV: 30 -0.445958302243E+03 -0.50524E-05 -0.62926E-07 936 0.244E-03
1 F= -.44595830E+03 E0= -.44593205E+03 d E =-.787588E-01