./iterations/neb0_image08_iter252_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 0.374450047160E+03 0.37445E+03 -0.14285E+04 624 0.799E+02
DAV: 2 0.390849821529E+01 -0.37054E+03 -0.35814E+03 869 0.196E+02
DAV: 3 -0.967706800508E+02 -0.10068E+03 -0.10036E+03 669 0.117E+02
DAV: 4 -0.101286354758E+03 -0.45157E+01 -0.45032E+01 720 0.285E+01
DAV: 5 -0.101373510099E+03 -0.87155E-01 -0.87106E-01 736 0.359E+00 0.228E+01
DAV: 6 -0.926641634682E+02 0.87093E+01 -0.31035E+01 725 0.301E+01 0.119E+01
DAV: 7 -0.917930819254E+02 0.87108E+00 -0.17253E+00 728 0.613E+00 0.480E+00
DAV: 8 -0.914176716647E+02 0.37541E+00 -0.54073E-01 720 0.395E+00 0.162E+00
DAV: 9 -0.913375194790E+02 0.80152E-01 -0.13257E-01 736 0.155E+00 0.420E-01
DAV: 10 -0.913293962148E+02 0.81233E-02 -0.45921E-02 736 0.110E+00 0.306E-01
DAV: 11 -0.913343530784E+02 -0.49569E-02 -0.15395E-02 616 0.644E-01 0.161E-01
DAV: 12 -0.913371103207E+02 -0.27572E-02 -0.28398E-03 626 0.231E-01 0.115E-01
DAV: 13 -0.913408390870E+02 -0.37288E-02 -0.29656E-03 642 0.283E-01 0.590E-02
DAV: 14 -0.913438916247E+02 -0.30525E-02 -0.86814E-04 672 0.172E-01 0.253E-02
DAV: 15 -0.913454120580E+02 -0.15204E-02 -0.17257E-04 656 0.681E-02 0.174E-02
DAV: 16 -0.913464706507E+02 -0.10586E-02 -0.12673E-04 661 0.609E-02 0.972E-03
DAV: 17 -0.913469254605E+02 -0.45481E-03 -0.40971E-05 600 0.272E-02 0.968E-03
DAV: 18 -0.913470838376E+02 -0.15838E-03 -0.18114E-05 512 0.267E-02 0.368E-03
DAV: 19 -0.913471697999E+02 -0.85962E-04 -0.13584E-05 450 0.158E-02 0.386E-03
DAV: 20 -0.913471821396E+02 -0.12340E-04 -0.17712E-06 528 0.860E-03 0.209E-03
DAV: 21 -0.913471975410E+02 -0.15401E-04 -0.55205E-06 406 0.150E-02 0.320E-03
DAV: 22 -0.913471984267E+02 -0.88565E-06 -0.10627E-06 504 0.737E-03
1 F= -.91347198E+02 E0= -.91352294E+02 d E =0.152880E-01