./iterations/neb0_image01_iter85_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 0.803567838154E+03 0.80357E+03 -0.25788E+04 896 0.101E+03
DAV: 2 0.107364926452E+03 -0.69620E+03 -0.68013E+03 1144 0.281E+02
DAV: 3 -0.599646391222E+02 -0.16733E+03 -0.16690E+03 848 0.154E+02
DAV: 4 -0.650204246587E+02 -0.50558E+01 -0.50390E+01 888 0.291E+01
DAV: 5 -0.650817594529E+02 -0.61335E-01 -0.61224E-01 842 0.325E+00 0.206E+01
DAV: 6 -0.599972033880E+02 0.50846E+01 -0.17629E+01 800 0.214E+01 0.110E+01
DAV: 7 -0.597048418970E+02 0.29236E+00 -0.10934E+00 912 0.579E+00 0.418E+00
DAV: 8 -0.596935156843E+02 0.11326E-01 -0.16328E-01 864 0.240E+00 0.132E+00
DAV: 9 -0.597014781863E+02 -0.79625E-02 -0.24663E-02 928 0.139E+00 0.359E-01
DAV: 10 -0.597030930378E+02 -0.16149E-02 -0.49089E-03 859 0.398E-01 0.199E-01
DAV: 11 -0.597047933550E+02 -0.17003E-02 -0.18884E-03 785 0.305E-01 0.750E-02
DAV: 12 -0.597061405486E+02 -0.13472E-02 -0.38382E-04 847 0.143E-01 0.285E-02
DAV: 13 -0.597072978513E+02 -0.11573E-02 -0.12852E-04 849 0.716E-02 0.214E-02
DAV: 14 -0.597079152578E+02 -0.61741E-03 -0.43351E-05 790 0.365E-02 0.993E-03
DAV: 15 -0.597084951469E+02 -0.57989E-03 -0.51839E-05 765 0.358E-02 0.664E-03
DAV: 16 -0.597086504232E+02 -0.15528E-03 -0.14939E-05 654 0.212E-02 0.372E-03
DAV: 17 -0.597087684092E+02 -0.11799E-03 -0.79949E-06 568 0.128E-02 0.322E-03
DAV: 18 -0.597088291679E+02 -0.60759E-04 -0.26306E-06 580 0.677E-03 0.109E-03
DAV: 19 -0.597088754776E+02 -0.46310E-04 -0.31180E-06 563 0.666E-03 0.107E-03
DAV: 20 -0.597088822742E+02 -0.67966E-05 -0.51576E-07 480 0.306E-03
1 F= -.59708882E+02 E0= -.59712748E+02 d E =0.115964E-01