./iterations/neb0_image05_iter46_OSZICAR.out output for 745: 733-->741: H2O near HO-Si on SiO2 surface --> H-OSi + OH-Si on SiO2 surface (TSS)

Status: running

       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1     0.424129118150E+04    0.42413E+04   -0.23863E+05  2892   0.117E+03 
DAV:   2    -0.423686651618E+03   -0.46650E+04   -0.45691E+04  3342   0.329E+02 
DAV:   3    -0.941987740693E+03   -0.51830E+03   -0.51599E+03  3120   0.118E+02 
DAV:   4    -0.954464712250E+03   -0.12477E+02   -0.12429E+02  3174   0.197E+01 
DAV:   5    -0.954876479032E+03   -0.41177E+00   -0.41121E+00  3192   0.323E+00    0.811E+01
DAV:   6    -0.846821911359E+03    0.10805E+03   -0.46985E+02  3057   0.347E+01    0.375E+01
DAV:   7    -0.846329576412E+03    0.49233E+00   -0.14584E+01  3543   0.610E+00    0.146E+01
DAV:   8    -0.845954370464E+03    0.37521E+00   -0.98066E-01  3165   0.240E+00    0.596E+00
DAV:   9    -0.845855544522E+03    0.98826E-01   -0.43812E-01  3183   0.162E+00    0.973E-01
DAV:  10    -0.845858176273E+03   -0.26318E-02   -0.10555E-01  3408   0.992E-01    0.139E+00
DAV:  11    -0.845823314123E+03    0.34862E-01   -0.30464E-02  3525   0.578E-01    0.941E-01
DAV:  12    -0.845815222142E+03    0.80920E-02   -0.15087E-02  3174   0.382E-01    0.687E-01
DAV:  13    -0.845808896228E+03    0.63259E-02   -0.19805E-02  3228   0.319E-01    0.410E-01
DAV:  14    -0.845803869980E+03    0.50262E-02   -0.14253E-02  3516   0.460E-01    0.472E-01
DAV:  15    -0.845802617536E+03    0.12524E-02   -0.23426E-02  3210   0.266E-01    0.291E-01
DAV:  16    -0.845800128364E+03    0.24892E-02   -0.85274E-03  3039   0.392E-01    0.272E-01
DAV:  17    -0.845800860867E+03   -0.73250E-03   -0.65401E-03  3111   0.182E-01    0.169E-01
DAV:  18    -0.845803690525E+03   -0.28297E-02   -0.41578E-03  3219   0.191E-01    0.101E-01
DAV:  19    -0.845806362133E+03   -0.26716E-02   -0.19125E-03  3075   0.125E-01    0.735E-02
DAV:  20    -0.845808319032E+03   -0.19569E-02   -0.81070E-04  3129   0.775E-02    0.784E-02
DAV:  21    -0.845809500129E+03   -0.11811E-02   -0.27536E-04  3093   0.501E-02    0.401E-02
DAV:  22    -0.845810937358E+03   -0.14372E-02   -0.19231E-04  3075   0.311E-02    0.350E-02
DAV:  23    -0.845811971392E+03   -0.10340E-02   -0.10442E-04  2895   0.220E-02    0.159E-02
DAV:  24    -0.845812507916E+03   -0.53652E-03   -0.42467E-05  2571   0.200E-02    0.116E-02
DAV:  25    -0.845812771034E+03   -0.26312E-03   -0.19962E-05  2049   0.105E-02    0.934E-03
DAV:  26    -0.845812911347E+03   -0.14031E-03   -0.76316E-06  1986   0.711E-03    0.526E-03
DAV:  27    -0.845813007475E+03   -0.96128E-04   -0.94917E-06  2004   0.102E-02    0.403E-03
DAV:  28    -0.845813034264E+03   -0.26789E-04   -0.47932E-06  1986   0.579E-03    0.309E-03
DAV:  29    -0.845813040409E+03   -0.61447E-05   -0.17294E-06  2013   0.296E-03 
   1 F= -.84581304E+03 E0= -.84585958E+03  d E =0.139621E+00