./iterations/neb0_image06_iter207_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 0.369968046246E+03 0.36997E+03 -0.14342E+04 640 0.799E+02
DAV: 2 0.434635632510E+01 -0.36562E+03 -0.35358E+03 858 0.193E+02
DAV: 3 -0.955168759424E+02 -0.99863E+02 -0.99518E+02 664 0.116E+02
DAV: 4 -0.100294761184E+03 -0.47779E+01 -0.47632E+01 728 0.289E+01
DAV: 5 -0.100393689317E+03 -0.98928E-01 -0.98871E-01 736 0.370E+00 0.224E+01
DAV: 6 -0.918610535817E+02 0.85326E+01 -0.30573E+01 693 0.303E+01 0.117E+01
DAV: 7 -0.910555368765E+02 0.80552E+00 -0.17567E+00 704 0.629E+00 0.479E+00
DAV: 8 -0.906828359999E+02 0.37270E+00 -0.53645E-01 704 0.408E+00 0.167E+00
DAV: 9 -0.905919793147E+02 0.90857E-01 -0.12978E-01 704 0.158E+00 0.421E-01
DAV: 10 -0.905817255980E+02 0.10254E-01 -0.38596E-02 736 0.972E-01 0.288E-01
DAV: 11 -0.905860076792E+02 -0.42821E-02 -0.97932E-03 599 0.511E-01 0.146E-01
DAV: 12 -0.905886981209E+02 -0.26904E-02 -0.24705E-03 626 0.266E-01 0.835E-02
DAV: 13 -0.905926718072E+02 -0.39737E-02 -0.13787E-03 636 0.167E-01 0.622E-02
DAV: 14 -0.905961543754E+02 -0.34826E-02 -0.92564E-04 728 0.210E-01 0.372E-02
DAV: 15 -0.905978625908E+02 -0.17082E-02 -0.27065E-04 725 0.936E-02 0.383E-02
DAV: 16 -0.905992313109E+02 -0.13687E-02 -0.36653E-04 703 0.116E-01 0.184E-02
DAV: 17 -0.905998683622E+02 -0.63705E-03 -0.97326E-05 701 0.554E-02 0.141E-02
DAV: 18 -0.906001284154E+02 -0.26005E-03 -0.26734E-05 562 0.217E-02 0.833E-03
DAV: 19 -0.906002509979E+02 -0.12258E-03 -0.20267E-05 487 0.247E-02 0.211E-03
DAV: 20 -0.906002784205E+02 -0.27423E-04 -0.48922E-06 472 0.109E-02 0.243E-03
DAV: 21 -0.906002973083E+02 -0.18888E-04 -0.27780E-06 400 0.570E-03 0.207E-03
DAV: 22 -0.906002988124E+02 -0.15041E-05 -0.48221E-07 528 0.388E-03
1 F= -.90600299E+02 E0= -.90605394E+02 d E =0.152845E-01