./iterations/neb0_image01_iter4_OSZICAR.out output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.367060036067E+03 0.36706E+03 -0.14309E+04 624 0.799E+02
DAV: 2 0.255867144634E+01 -0.36450E+03 -0.35275E+03 850 0.196E+02
DAV: 3 -0.957132524129E+02 -0.98272E+02 -0.97954E+02 664 0.116E+02
DAV: 4 -0.100156811915E+03 -0.44436E+01 -0.44334E+01 712 0.283E+01
DAV: 5 -0.100243485361E+03 -0.86673E-01 -0.86636E-01 744 0.354E+00 0.224E+01
DAV: 6 -0.914148194060E+02 0.88287E+01 -0.31451E+01 693 0.301E+01 0.118E+01
DAV: 7 -0.905921205429E+02 0.82270E+00 -0.18751E+00 712 0.631E+00 0.483E+00
DAV: 8 -0.902129068897E+02 0.37921E+00 -0.54133E-01 712 0.424E+00 0.173E+00
DAV: 9 -0.901241206877E+02 0.88786E-01 -0.14649E-01 736 0.173E+00 0.433E-01
DAV: 10 -0.901187089415E+02 0.54117E-02 -0.44829E-02 728 0.122E+00 0.313E-01
DAV: 11 -0.901227295792E+02 -0.40206E-02 -0.69956E-03 616 0.531E-01 0.124E-01
DAV: 12 -0.901263176678E+02 -0.35881E-02 -0.67278E-03 624 0.438E-01 0.136E-01
DAV: 13 -0.901286202548E+02 -0.23026E-02 -0.21584E-03 842 0.360E-01 0.711E-02
DAV: 14 -0.901318053006E+02 -0.31850E-02 -0.12518E-03 639 0.165E-01 0.591E-02
DAV: 15 -0.901335315949E+02 -0.17263E-02 -0.22152E-04 672 0.881E-02 0.416E-02
DAV: 16 -0.901350314235E+02 -0.14998E-02 -0.68951E-04 668 0.156E-01 0.331E-02
DAV: 17 -0.901356892912E+02 -0.65787E-03 -0.84691E-05 669 0.643E-02 0.259E-02
DAV: 18 -0.901360936552E+02 -0.40436E-03 -0.12157E-04 661 0.574E-02 0.949E-03
DAV: 19 -0.901361905693E+02 -0.96914E-04 -0.18168E-05 496 0.246E-02 0.602E-03
DAV: 20 -0.901362520764E+02 -0.61507E-04 -0.11311E-05 434 0.169E-02 0.669E-03
DAV: 21 -0.901362929188E+02 -0.40842E-04 -0.63838E-06 455 0.169E-02 0.297E-03
DAV: 22 -0.901363010043E+02 -0.80855E-05 -0.81041E-06 512 0.151E-02
1 F= -.90136301E+02 E0= -.90141415E+02 d E =0.153427E-01