./iterations/neb0_image05_iter195_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 0.368106922538E+03 0.36811E+03 -0.14294E+04 624 0.799E+02
DAV: 2 0.320429704176E+01 -0.36490E+03 -0.35205E+03 864 0.195E+02
DAV: 3 -0.954354201069E+02 -0.98640E+02 -0.98311E+02 677 0.116E+02
DAV: 4 -0.999684588466E+02 -0.45330E+01 -0.45221E+01 696 0.280E+01
DAV: 5 -0.100061033693E+03 -0.92575E-01 -0.92526E-01 728 0.352E+00 0.221E+01
DAV: 6 -0.915567403168E+02 0.85043E+01 -0.30772E+01 680 0.299E+01 0.116E+01
DAV: 7 -0.907769419483E+02 0.77980E+00 -0.18325E+00 728 0.637E+00 0.481E+00
DAV: 8 -0.904069089673E+02 0.37003E+00 -0.52176E-01 720 0.420E+00 0.171E+00
DAV: 9 -0.903187254914E+02 0.88183E-01 -0.14123E-01 712 0.172E+00 0.437E-01
DAV: 10 -0.903115937786E+02 0.71317E-02 -0.42295E-02 792 0.125E+00 0.311E-01
DAV: 11 -0.903147239105E+02 -0.31301E-02 -0.70889E-03 616 0.507E-01 0.155E-01
DAV: 12 -0.903171545695E+02 -0.24307E-02 -0.52653E-03 618 0.462E-01 0.106E-01
DAV: 13 -0.903204942109E+02 -0.33396E-02 -0.11464E-03 672 0.216E-01 0.862E-02
DAV: 14 -0.903235277312E+02 -0.30335E-02 -0.15070E-03 660 0.193E-01 0.500E-02
DAV: 15 -0.903264107660E+02 -0.28830E-02 -0.64448E-04 688 0.170E-01 0.392E-02
DAV: 16 -0.903277400461E+02 -0.13293E-02 -0.43816E-04 680 0.106E-01 0.308E-02
DAV: 17 -0.903284551967E+02 -0.71515E-03 -0.18242E-04 733 0.951E-02 0.161E-02
DAV: 18 -0.903286800741E+02 -0.22488E-03 -0.65988E-05 704 0.419E-02 0.153E-02
DAV: 19 -0.903288724922E+02 -0.19242E-03 -0.33689E-05 618 0.315E-02 0.681E-03
DAV: 20 -0.903289467993E+02 -0.74307E-04 -0.96935E-06 496 0.206E-02 0.370E-03
DAV: 21 -0.903289789426E+02 -0.32143E-04 -0.86684E-06 424 0.148E-02 0.362E-03
DAV: 22 -0.903289825042E+02 -0.35615E-05 -0.12281E-06 528 0.677E-03
1 F= -.90328983E+02 E0= -.90335931E+02 d E =0.208446E-01