./iterations/neb0_image04_iter192_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 0.363263433496E+03 0.36326E+03 -0.14357E+04 640 0.799E+02
DAV: 2 0.112057737622E+01 -0.36214E+03 -0.34934E+03 861 0.193E+02
DAV: 3 -0.961878720849E+02 -0.97308E+02 -0.97012E+02 685 0.115E+02
DAV: 4 -0.100285444917E+03 -0.40976E+01 -0.40877E+01 696 0.268E+01
DAV: 5 -0.100363219495E+03 -0.77775E-01 -0.77748E-01 728 0.334E+00 0.224E+01
DAV: 6 -0.916497928869E+02 0.87134E+01 -0.31141E+01 690 0.298E+01 0.116E+01
DAV: 7 -0.907855147245E+02 0.86428E+00 -0.17849E+00 704 0.630E+00 0.483E+00
DAV: 8 -0.903751173370E+02 0.41040E+00 -0.56683E-01 712 0.425E+00 0.164E+00
DAV: 9 -0.902807005734E+02 0.94417E-01 -0.12674E-01 720 0.183E+00 0.466E-01
DAV: 10 -0.902718204043E+02 0.88802E-02 -0.29699E-02 701 0.887E-01 0.318E-01
DAV: 11 -0.902738758202E+02 -0.20554E-02 -0.96675E-03 680 0.524E-01 0.190E-01
DAV: 12 -0.902767211072E+02 -0.28453E-02 -0.24746E-03 784 0.436E-01 0.117E-01
DAV: 13 -0.902807820795E+02 -0.40610E-02 -0.23371E-03 601 0.298E-01 0.100E-01
DAV: 14 -0.902847878181E+02 -0.40057E-02 -0.16321E-03 636 0.223E-01 0.403E-02
DAV: 15 -0.902867892030E+02 -0.20014E-02 -0.33057E-04 672 0.886E-02 0.350E-02
DAV: 16 -0.902892979778E+02 -0.25088E-02 -0.55165E-04 820 0.147E-01 0.313E-02
DAV: 17 -0.902898222748E+02 -0.52430E-03 -0.73560E-05 680 0.548E-02 0.247E-02
DAV: 18 -0.902903227515E+02 -0.50048E-03 -0.12756E-04 716 0.670E-02 0.860E-03
DAV: 19 -0.902906677739E+02 -0.34502E-03 -0.38414E-05 591 0.317E-02 0.532E-03
DAV: 20 -0.902907840505E+02 -0.11628E-03 -0.10837E-05 464 0.138E-02 0.427E-03
DAV: 21 -0.902908483095E+02 -0.64259E-04 -0.10145E-05 460 0.137E-02 0.106E-03
DAV: 22 -0.902908595371E+02 -0.11228E-04 -0.23705E-06 488 0.640E-03 0.144E-03
DAV: 23 -0.902908610782E+02 -0.15411E-05 -0.45103E-07 512 0.393E-03
1 F= -.90290861E+02 E0= -.90299353E+02 d E =0.254769E-01