./iterations/neb0_image01_iter25_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 0.365918563785E+03 0.36592E+03 -0.14296E+04 624 0.799E+02
DAV: 2 0.297922371438E+01 -0.36294E+03 -0.34977E+03 847 0.195E+02
DAV: 3 -0.956653262311E+02 -0.98645E+02 -0.98304E+02 672 0.116E+02
DAV: 4 -0.100158468702E+03 -0.44931E+01 -0.44831E+01 693 0.286E+01
DAV: 5 -0.100246735228E+03 -0.88267E-01 -0.88215E-01 736 0.359E+00 0.222E+01
DAV: 6 -0.915998294376E+02 0.86469E+01 -0.31279E+01 693 0.299E+01 0.116E+01
DAV: 7 -0.907967112129E+02 0.80312E+00 -0.18324E+00 720 0.633E+00 0.483E+00
DAV: 8 -0.904163032341E+02 0.38041E+00 -0.55551E-01 704 0.429E+00 0.169E+00
DAV: 9 -0.903291858947E+02 0.87117E-01 -0.13989E-01 704 0.167E+00 0.433E-01
DAV: 10 -0.903234703558E+02 0.57155E-02 -0.45233E-02 728 0.125E+00 0.316E-01
DAV: 11 -0.903271977025E+02 -0.37273E-02 -0.65941E-03 616 0.477E-01 0.147E-01
DAV: 12 -0.903307323281E+02 -0.35346E-02 -0.72878E-03 610 0.493E-01 0.130E-01
DAV: 13 -0.903333690038E+02 -0.26367E-02 -0.15432E-03 864 0.321E-01 0.746E-02
DAV: 14 -0.903363820870E+02 -0.30131E-02 -0.13614E-03 626 0.176E-01 0.577E-02
DAV: 15 -0.903384086224E+02 -0.20265E-02 -0.32486E-04 688 0.107E-01 0.431E-02
DAV: 16 -0.903398863898E+02 -0.14778E-02 -0.75233E-04 653 0.162E-01 0.361E-02
DAV: 17 -0.903406291591E+02 -0.74277E-03 -0.12283E-04 680 0.803E-02 0.252E-02
DAV: 18 -0.903408855507E+02 -0.25639E-03 -0.79392E-05 677 0.458E-02 0.104E-02
DAV: 19 -0.903410654054E+02 -0.17985E-03 -0.26731E-05 509 0.261E-02 0.358E-03
DAV: 20 -0.903411226658E+02 -0.57260E-04 -0.10584E-05 480 0.178E-02 0.704E-03
DAV: 21 -0.903411710839E+02 -0.48418E-04 -0.78841E-06 431 0.160E-02 0.409E-03
DAV: 22 -0.903411777101E+02 -0.66262E-05 -0.56507E-06 496 0.139E-02
1 F= -.90341178E+02 E0= -.90346777E+02 d E =0.167983E-01