./iterations/neb0_image09_iter212_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 0.374015381037E+03 0.37402E+03 -0.14281E+04 624 0.799E+02
DAV: 2 0.326906408629E+01 -0.37075E+03 -0.35812E+03 869 0.196E+02
DAV: 3 -0.968190463668E+02 -0.10009E+03 -0.99761E+02 669 0.117E+02
DAV: 4 -0.101268782122E+03 -0.44497E+01 -0.44393E+01 720 0.283E+01
DAV: 5 -0.101355292577E+03 -0.86510E-01 -0.86470E-01 720 0.359E+00 0.227E+01
DAV: 6 -0.926771096538E+02 0.86782E+01 -0.31024E+01 728 0.301E+01 0.119E+01
DAV: 7 -0.918081791382E+02 0.86893E+00 -0.17248E+00 720 0.614E+00 0.479E+00
DAV: 8 -0.914322257756E+02 0.37595E+00 -0.54468E-01 712 0.395E+00 0.163E+00
DAV: 9 -0.913513391193E+02 0.80887E-01 -0.13163E-01 712 0.155E+00 0.423E-01
DAV: 10 -0.913431507386E+02 0.81884E-02 -0.44057E-02 752 0.110E+00 0.299E-01
DAV: 11 -0.913474975251E+02 -0.43468E-02 -0.11698E-02 608 0.561E-01 0.131E-01
DAV: 12 -0.913508162403E+02 -0.33187E-02 -0.29666E-03 623 0.246E-01 0.115E-01
DAV: 13 -0.913542538359E+02 -0.34376E-02 -0.13653E-03 714 0.209E-01 0.408E-02
DAV: 14 -0.913572420940E+02 -0.29883E-02 -0.57200E-04 664 0.126E-01 0.376E-02
DAV: 15 -0.913589746795E+02 -0.17326E-02 -0.14828E-04 688 0.730E-02 0.330E-02
DAV: 16 -0.913603000349E+02 -0.13254E-02 -0.32999E-04 656 0.882E-02 0.188E-02
DAV: 17 -0.913606843432E+02 -0.38431E-03 -0.59655E-05 672 0.523E-02 0.112E-02
DAV: 18 -0.913609294614E+02 -0.24512E-03 -0.41372E-05 576 0.270E-02 0.946E-03
DAV: 19 -0.913609741942E+02 -0.44733E-04 -0.66458E-06 512 0.180E-02 0.414E-03
DAV: 20 -0.913610063095E+02 -0.32115E-04 -0.11179E-05 418 0.206E-02 0.374E-03
DAV: 21 -0.913610193914E+02 -0.13082E-04 -0.24940E-06 464 0.888E-03 0.311E-03
DAV: 22 -0.913610243173E+02 -0.49260E-05 -0.15739E-06 456 0.812E-03
1 F= -.91361024E+02 E0= -.91365666E+02 d E =0.139236E-01