./iterations/neb0_image08_iter68_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 0.793625967811E+03 0.79363E+03 -0.26033E+04 920 0.101E+03
DAV: 2 0.101055702282E+03 -0.69257E+03 -0.67422E+03 1104 0.281E+02
DAV: 3 -0.630680519841E+02 -0.16412E+03 -0.16376E+03 809 0.154E+02
DAV: 4 -0.679334503682E+02 -0.48654E+01 -0.48477E+01 904 0.293E+01
DAV: 5 -0.679896829878E+02 -0.56233E-01 -0.56058E-01 899 0.319E+00 0.198E+01
DAV: 6 -0.633625174724E+02 0.46272E+01 -0.18830E+01 902 0.223E+01 0.109E+01
DAV: 7 -0.632148140519E+02 0.14770E+00 -0.97673E-01 891 0.565E+00 0.399E+00
DAV: 8 -0.632112942464E+02 0.35198E-02 -0.89536E-02 920 0.198E+00 0.139E+00
DAV: 9 -0.632210235185E+02 -0.97293E-02 -0.19076E-02 928 0.976E-01 0.324E-01
DAV: 10 -0.632227594441E+02 -0.17359E-02 -0.54395E-03 918 0.605E-01 0.160E-01
DAV: 11 -0.632235880697E+02 -0.82863E-03 -0.73695E-04 864 0.201E-01 0.753E-02
DAV: 12 -0.632247328375E+02 -0.11448E-02 -0.33890E-04 857 0.136E-01 0.297E-02
DAV: 13 -0.632256747649E+02 -0.94193E-03 -0.13400E-04 891 0.111E-01 0.331E-02
DAV: 14 -0.632264718320E+02 -0.79707E-03 -0.19502E-04 804 0.111E-01 0.163E-02
DAV: 15 -0.632268043581E+02 -0.33253E-03 -0.40590E-05 827 0.435E-02 0.734E-03
DAV: 16 -0.632269988426E+02 -0.19448E-03 -0.15710E-05 609 0.242E-02 0.484E-03
DAV: 17 -0.632271449002E+02 -0.14606E-03 -0.84143E-06 625 0.160E-02 0.295E-03
DAV: 18 -0.632272395232E+02 -0.94623E-04 -0.69893E-06 599 0.108E-02 0.212E-03
DAV: 19 -0.632272757677E+02 -0.36244E-04 -0.26453E-06 622 0.111E-02 0.136E-03
DAV: 20 -0.632272881469E+02 -0.12379E-04 -0.97582E-07 560 0.432E-03 0.125E-03
DAV: 21 -0.632272933682E+02 -0.52213E-05 -0.44770E-07 510 0.497E-03
1 F= -.63227293E+02 E0= -.63231159E+02 d E =0.115964E-01