./iterations/neb0_image08_iter33_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 0.800371310947E+03 0.80037E+03 -0.25967E+04 912 0.101E+03
DAV: 2 0.101818732285E+03 -0.69855E+03 -0.68096E+03 1112 0.282E+02
DAV: 3 -0.630522379140E+02 -0.16487E+03 -0.16456E+03 817 0.155E+02
DAV: 4 -0.677690587034E+02 -0.47168E+01 -0.47031E+01 888 0.291E+01
DAV: 5 -0.678291095675E+02 -0.60051E-01 -0.59850E-01 915 0.321E+00 0.197E+01
DAV: 6 -0.631097706787E+02 0.47193E+01 -0.18924E+01 896 0.227E+01 0.108E+01
DAV: 7 -0.629549816681E+02 0.15479E+00 -0.10385E+00 928 0.601E+00 0.399E+00
DAV: 8 -0.629468744344E+02 0.81072E-02 -0.93753E-02 912 0.209E+00 0.138E+00
DAV: 9 -0.629539515279E+02 -0.70771E-02 -0.20078E-02 928 0.111E+00 0.322E-01
DAV: 10 -0.629551297580E+02 -0.11782E-02 -0.68764E-03 918 0.694E-01 0.167E-01
DAV: 11 -0.629558785009E+02 -0.74874E-03 -0.85491E-04 859 0.222E-01 0.776E-02
DAV: 12 -0.629570341977E+02 -0.11557E-02 -0.48217E-04 837 0.185E-01 0.344E-02
DAV: 13 -0.629580756339E+02 -0.10414E-02 -0.22282E-04 873 0.153E-01 0.392E-02
DAV: 14 -0.629592511721E+02 -0.11755E-02 -0.38069E-04 840 0.161E-01 0.208E-02
DAV: 15 -0.629597244428E+02 -0.47327E-03 -0.86498E-05 920 0.688E-02 0.913E-03
DAV: 16 -0.629599579601E+02 -0.23352E-03 -0.20014E-05 654 0.244E-02 0.601E-03
DAV: 17 -0.629601340590E+02 -0.17610E-03 -0.11175E-05 646 0.164E-02 0.343E-03
DAV: 18 -0.629602693189E+02 -0.13526E-03 -0.10203E-05 633 0.126E-02 0.250E-03
DAV: 19 -0.629603122603E+02 -0.42941E-04 -0.29032E-06 627 0.123E-02 0.145E-03
DAV: 20 -0.629603262817E+02 -0.14021E-04 -0.87377E-07 552 0.492E-03 0.102E-03
DAV: 21 -0.629603336303E+02 -0.73486E-05 -0.52756E-07 534 0.491E-03
1 F= -.62960334E+02 E0= -.62964199E+02 d E =0.115963E-01