./iterations/neb0_image08_iter80_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 0.791921733168E+03 0.79192E+03 -0.26031E+04 920 0.101E+03
DAV: 2 0.999496305545E+02 -0.69197E+03 -0.67455E+03 1112 0.281E+02
DAV: 3 -0.633690261628E+02 -0.16332E+03 -0.16302E+03 825 0.154E+02
DAV: 4 -0.679804190611E+02 -0.46114E+01 -0.45981E+01 880 0.288E+01
DAV: 5 -0.680448843339E+02 -0.64465E-01 -0.64240E-01 910 0.325E+00 0.197E+01
DAV: 6 -0.634232641544E+02 0.46216E+01 -0.18874E+01 889 0.221E+01 0.109E+01
DAV: 7 -0.632733179246E+02 0.14995E+00 -0.95297E-01 899 0.554E+00 0.399E+00
DAV: 8 -0.632695931151E+02 0.37248E-02 -0.90526E-02 912 0.200E+00 0.137E+00
DAV: 9 -0.632797385359E+02 -0.10145E-01 -0.18411E-02 928 0.950E-01 0.324E-01
DAV: 10 -0.632816642052E+02 -0.19257E-02 -0.52427E-03 918 0.561E-01 0.155E-01
DAV: 11 -0.632825332480E+02 -0.86904E-03 -0.64308E-04 864 0.187E-01 0.755E-02
DAV: 12 -0.632838510207E+02 -0.13178E-02 -0.36470E-04 854 0.140E-01 0.323E-02
DAV: 13 -0.632848123615E+02 -0.96134E-03 -0.14295E-04 803 0.106E-01 0.336E-02
DAV: 14 -0.632856079824E+02 -0.79562E-03 -0.17459E-04 847 0.977E-02 0.163E-02
DAV: 15 -0.632859147958E+02 -0.30681E-03 -0.36568E-05 739 0.426E-02 0.661E-03
DAV: 16 -0.632861114612E+02 -0.19667E-03 -0.17153E-05 601 0.237E-02 0.496E-03
DAV: 17 -0.632862397762E+02 -0.12831E-03 -0.80963E-06 630 0.170E-02 0.291E-03
DAV: 18 -0.632863254265E+02 -0.85650E-04 -0.57500E-06 599 0.889E-03 0.198E-03
DAV: 19 -0.632863624783E+02 -0.37052E-04 -0.27308E-06 622 0.108E-02 0.143E-03
DAV: 20 -0.632863770967E+02 -0.14618E-04 -0.10240E-06 587 0.442E-03 0.126E-03
DAV: 21 -0.632863847150E+02 -0.76183E-05 -0.69565E-07 542 0.636E-03
1 F= -.63286385E+02 E0= -.63290250E+02 d E =0.115964E-01