./iterations/neb0_image07_iter98_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 0.376732061010E+03 0.37673E+03 -0.14277E+04 624 0.799E+02
DAV: 2 0.336415649814E+01 -0.37337E+03 -0.36142E+03 877 0.196E+02
DAV: 3 -0.963802420971E+02 -0.99744E+02 -0.99413E+02 664 0.117E+02
DAV: 4 -0.100903301596E+03 -0.45231E+01 -0.45124E+01 696 0.287E+01
DAV: 5 -0.100993879460E+03 -0.90578E-01 -0.90541E-01 728 0.365E+00 0.227E+01
DAV: 6 -0.923846220288E+02 0.86093E+01 -0.30726E+01 709 0.303E+01 0.119E+01
DAV: 7 -0.915225978815E+02 0.86202E+00 -0.16669E+00 736 0.614E+00 0.481E+00
DAV: 8 -0.911420039194E+02 0.38059E+00 -0.56060E-01 704 0.404E+00 0.163E+00
DAV: 9 -0.910581715584E+02 0.83832E-01 -0.13178E-01 728 0.155E+00 0.425E-01
DAV: 10 -0.910488408196E+02 0.93307E-02 -0.47095E-02 733 0.111E+00 0.307E-01
DAV: 11 -0.910533343880E+02 -0.44936E-02 -0.11701E-02 616 0.567E-01 0.133E-01
DAV: 12 -0.910566371373E+02 -0.33027E-02 -0.37528E-03 613 0.285E-01 0.148E-01
DAV: 13 -0.910602987079E+02 -0.36616E-02 -0.27227E-03 728 0.326E-01 0.559E-02
DAV: 14 -0.910628545103E+02 -0.25558E-02 -0.65143E-04 661 0.119E-01 0.600E-02
DAV: 15 -0.910654150359E+02 -0.25605E-02 -0.31185E-04 653 0.895E-02 0.343E-02
DAV: 16 -0.910664916841E+02 -0.10766E-02 -0.41447E-04 680 0.101E-01 0.302E-02
DAV: 17 -0.910670225924E+02 -0.53091E-03 -0.12985E-04 645 0.719E-02 0.103E-02
DAV: 18 -0.910671709239E+02 -0.14833E-03 -0.23752E-05 560 0.264E-02 0.702E-03
DAV: 19 -0.910672584963E+02 -0.87572E-04 -0.17655E-05 477 0.245E-02 0.293E-03
DAV: 20 -0.910672918707E+02 -0.33374E-04 -0.49615E-06 496 0.112E-02 0.325E-03
DAV: 21 -0.910673026859E+02 -0.10815E-04 -0.16494E-06 440 0.770E-03 0.175E-03
DAV: 22 -0.910673113885E+02 -0.87026E-05 -0.19619E-06 403 0.767E-03
1 F= -.91067311E+02 E0= -.91072027E+02 d E =0.141459E-01