./iterations/neb0_image09_iter6_OSZICAR.out output for 40: 572-->565: F2 + F3Si-NF-SiF3, to SiF4 + F3Si-NF2 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.794803760407E+03 0.79480E+03 -0.25935E+04 912 0.101E+03
DAV: 2 0.100390692040E+03 -0.69441E+03 -0.67863E+03 1104 0.282E+02
DAV: 3 -0.633960127742E+02 -0.16379E+03 -0.16340E+03 819 0.155E+02
DAV: 4 -0.679169920707E+02 -0.45210E+01 -0.45032E+01 920 0.289E+01
DAV: 5 -0.679690476287E+02 -0.52056E-01 -0.51939E-01 904 0.309E+00 0.193E+01
DAV: 6 -0.633058487211E+02 0.46632E+01 -0.18783E+01 811 0.219E+01 0.106E+01
DAV: 7 -0.631479360002E+02 0.15791E+00 -0.92912E-01 923 0.547E+00 0.397E+00
DAV: 8 -0.631447663425E+02 0.31697E-02 -0.95439E-02 896 0.200E+00 0.137E+00
DAV: 9 -0.631556275294E+02 -0.10861E-01 -0.19828E-02 928 0.947E-01 0.330E-01
DAV: 10 -0.631569713514E+02 -0.13438E-02 -0.37436E-03 928 0.463E-01 0.174E-01
DAV: 11 -0.631579202318E+02 -0.94888E-03 -0.50022E-04 888 0.169E-01 0.742E-02
DAV: 12 -0.631590226730E+02 -0.11024E-02 -0.26081E-04 849 0.134E-01 0.289E-02
DAV: 13 -0.631599471036E+02 -0.92443E-03 -0.15139E-04 812 0.107E-01 0.324E-02
DAV: 14 -0.631606640217E+02 -0.71692E-03 -0.11920E-04 817 0.808E-02 0.142E-02
DAV: 15 -0.631610062658E+02 -0.34224E-03 -0.34787E-05 795 0.396E-02 0.625E-03
DAV: 16 -0.631612124976E+02 -0.20623E-03 -0.12851E-05 657 0.203E-02 0.516E-03
DAV: 17 -0.631613321281E+02 -0.11963E-03 -0.76115E-06 657 0.136E-02 0.302E-03
DAV: 18 -0.631614133811E+02 -0.81253E-04 -0.53831E-06 639 0.866E-03 0.185E-03
DAV: 19 -0.631614443808E+02 -0.31000E-04 -0.21135E-06 649 0.733E-03 0.863E-04
DAV: 20 -0.631614619815E+02 -0.17601E-04 -0.11917E-06 604 0.400E-03 0.855E-04
DAV: 21 -0.631614674024E+02 -0.54209E-05 -0.34465E-07 547 0.306E-03
1 F= -.63161467E+02 E0= -.63165333E+02 d E =0.115964E-01