./iterations/neb0_image04_iter8_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 0.208898224845E+04 0.20890E+04 -0.11605E+05 1704 0.105E+03
DAV: 2 -0.138085174971E+03 -0.22271E+04 -0.21351E+04 2136 0.261E+02
DAV: 3 -0.464212443312E+03 -0.32613E+03 -0.32245E+03 1880 0.107E+02
DAV: 4 -0.476775157271E+03 -0.12563E+02 -0.12512E+02 1944 0.225E+01
DAV: 5 -0.477270681593E+03 -0.49552E+00 -0.49524E+00 2144 0.386E+00 0.430E+01
DAV: 6 -0.446972083238E+03 0.30299E+02 -0.14636E+02 2048 0.318E+01 0.342E+01
DAV: 7 -0.450785367890E+03 -0.38133E+01 -0.98429E+01 1864 0.155E+01 0.192E+01
DAV: 8 -0.444528794429E+03 0.62566E+01 -0.85424E+00 1880 0.105E+01 0.118E+01
DAV: 9 -0.450855511365E+03 -0.63267E+01 -0.40117E+01 2104 0.157E+01 0.324E+01
DAV: 10 -0.444002718299E+03 0.68528E+01 -0.17969E+01 1776 0.500E+00 0.878E+00
DAV: 11 -0.443801354348E+03 0.20136E+00 -0.67486E+00 2040 0.205E+00 0.126E+01
DAV: 12 -0.443341251688E+03 0.46010E+00 -0.30354E+00 1968 0.106E+00 0.705E+00
DAV: 13 -0.443174127973E+03 0.16712E+00 -0.12501E-01 1936 0.112E+00 0.529E+00
DAV: 14 -0.443463879317E+03 -0.28975E+00 -0.69241E+00 2080 0.289E+00 0.800E+00
DAV: 15 -0.442876532449E+03 0.58735E+00 -0.10255E+00 1824 0.162E+00 0.254E+00
DAV: 16 -0.442927819920E+03 -0.51287E-01 -0.10429E-01 1992 0.656E-01 0.244E+00
DAV: 17 -0.442952880579E+03 -0.25061E-01 -0.50434E-01 1904 0.717E-01 0.244E+00
DAV: 18 -0.442931880992E+03 0.21000E-01 -0.12930E-01 1904 0.359E-01 0.116E+00
DAV: 19 -0.442939519662E+03 -0.76387E-02 -0.51028E-02 2000 0.234E-01 0.922E-01
DAV: 20 -0.442943033897E+03 -0.35142E-02 -0.12868E-02 1912 0.184E-01 0.588E-01
DAV: 21 -0.442948846162E+03 -0.58123E-02 -0.45751E-03 1840 0.150E-01 0.431E-01
DAV: 22 -0.442950365908E+03 -0.15197E-02 -0.12648E-03 2408 0.111E-01 0.295E-01
DAV: 23 -0.442953663013E+03 -0.32971E-02 -0.30970E-03 1960 0.123E-01 0.265E-01
DAV: 24 -0.442954906650E+03 -0.12436E-02 -0.29247E-03 2168 0.894E-02 0.200E-01
DAV: 25 -0.442955653309E+03 -0.74666E-03 -0.10787E-03 1824 0.445E-02 0.670E-02
DAV: 26 -0.442956368728E+03 -0.71542E-03 -0.10926E-04 1672 0.257E-02 0.603E-02
DAV: 27 -0.442956653055E+03 -0.28433E-03 -0.27061E-04 1960 0.391E-02 0.598E-02
DAV: 28 -0.442956778285E+03 -0.12523E-03 -0.86363E-05 1712 0.210E-02 0.296E-02
DAV: 29 -0.442957044741E+03 -0.26646E-03 -0.64585E-05 1728 0.163E-02 0.235E-02
DAV: 30 -0.442957090382E+03 -0.45641E-04 -0.62478E-06 1008 0.728E-03 0.177E-02
DAV: 31 -0.442957194625E+03 -0.10424E-03 -0.20277E-05 1256 0.872E-03 0.785E-03
DAV: 32 -0.442957222388E+03 -0.27763E-04 -0.27723E-06 1056 0.392E-03 0.466E-03
DAV: 33 -0.442957233441E+03 -0.11054E-04 -0.27644E-06 928 0.398E-03 0.584E-03
DAV: 34 -0.442957242824E+03 -0.93826E-05 -0.16414E-06 992 0.218E-03
1 F= -.44295724E+03 E0= -.44294021E+03 d E =-.510901E-01