./iterations/neb0_image03_iter66_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 0.209808110247E+04 0.20981E+04 -0.11599E+05 1696 0.105E+03
DAV: 2 -0.138652999668E+03 -0.22367E+04 -0.21460E+04 2160 0.262E+02
DAV: 3 -0.463732947272E+03 -0.32508E+03 -0.31941E+03 1904 0.108E+02
DAV: 4 -0.476778628760E+03 -0.13046E+02 -0.13001E+02 1992 0.228E+01
DAV: 5 -0.477211305552E+03 -0.43268E+00 -0.43249E+00 2112 0.371E+00 0.433E+01
DAV: 6 -0.453671153439E+03 0.23540E+02 -0.14812E+02 2016 0.318E+01 0.419E+01
DAV: 7 -0.453638614215E+03 0.32539E-01 -0.83343E+01 1808 0.145E+01 0.219E+01
DAV: 8 -0.447033267234E+03 0.66053E+01 -0.96954E+00 1856 0.878E+00 0.137E+01
DAV: 9 -0.447172025287E+03 -0.13876E+00 -0.24218E+01 2040 0.112E+01 0.118E+01
DAV: 10 -0.446382068885E+03 0.78996E+00 -0.36840E+00 1824 0.346E+00 0.110E+01
DAV: 11 -0.445499772724E+03 0.88230E+00 -0.64308E-01 1960 0.206E+00 0.920E+00
DAV: 12 -0.445299509216E+03 0.20026E+00 -0.70483E+00 2112 0.480E+00 0.116E+01
DAV: 13 -0.444428757730E+03 0.87075E+00 -0.12385E+00 2000 0.391E+00 0.554E+00
DAV: 14 -0.444210357965E+03 0.21840E+00 -0.26847E-01 1840 0.112E+00 0.248E+00
DAV: 15 -0.444186710192E+03 0.23648E-01 -0.20767E-01 1872 0.796E-01 0.116E+00
DAV: 16 -0.444216114835E+03 -0.29405E-01 -0.33266E-02 1952 0.551E-01 0.551E-01
DAV: 17 -0.444231971487E+03 -0.15857E-01 -0.11820E-02 1840 0.282E-01 0.203E+00
DAV: 18 -0.444210548666E+03 0.21423E-01 -0.45042E-03 1944 0.235E-01 0.487E-01
DAV: 19 -0.444219815344E+03 -0.92667E-02 -0.59167E-03 1928 0.209E-01 0.555E-01
DAV: 20 -0.444220498755E+03 -0.68341E-03 -0.17103E-03 1784 0.957E-02 0.998E-02
DAV: 21 -0.444221870085E+03 -0.13713E-02 -0.31310E-04 1952 0.597E-02 0.280E-01
DAV: 22 -0.444222361555E+03 -0.49147E-03 -0.30956E-04 1816 0.502E-02 0.622E-02
DAV: 23 -0.444224186464E+03 -0.18249E-02 -0.22191E-04 1800 0.406E-02 0.149E-01
DAV: 24 -0.444225163093E+03 -0.97663E-03 -0.23666E-04 1816 0.326E-02 0.108E-01
DAV: 25 -0.444225373075E+03 -0.20998E-03 -0.54349E-05 1720 0.210E-02 0.674E-02
DAV: 26 -0.444225619145E+03 -0.24607E-03 -0.20775E-05 1328 0.107E-02 0.482E-02
DAV: 27 -0.444225811504E+03 -0.19236E-03 -0.16794E-05 1472 0.106E-02 0.183E-02
DAV: 28 -0.444225880600E+03 -0.69097E-04 -0.50039E-06 1128 0.603E-03 0.983E-03
DAV: 29 -0.444225915000E+03 -0.34400E-04 -0.55532E-06 1072 0.722E-03 0.606E-03
DAV: 30 -0.444225924992E+03 -0.99920E-05 -0.16272E-06 936 0.335E-03
1 F= -.44422592E+03 E0= -.44421534E+03 d E =-.317573E-01