./iterations/neb0_image01_iter6_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     0.422860660260E+04    0.42286E+04   -0.23861E+05  2892   0.117E+03 
DAV:   2    -0.430819197504E+03   -0.46594E+04   -0.45561E+04  3360   0.329E+02 
DAV:   3    -0.943337930984E+03   -0.51252E+03   -0.51031E+03  3120   0.117E+02 
DAV:   4    -0.955549032016E+03   -0.12211E+02   -0.12166E+02  3183   0.195E+01 
DAV:   5    -0.955951070219E+03   -0.40204E+00   -0.40150E+00  3201   0.320E+00    0.812E+01
DAV:   6    -0.847803691109E+03    0.10815E+03   -0.47170E+02  3057   0.347E+01    0.376E+01
DAV:   7    -0.847338633276E+03    0.46506E+00   -0.14383E+01  3552   0.605E+00    0.146E+01
DAV:   8    -0.847002523665E+03    0.33611E+00   -0.96298E-01  3174   0.237E+00    0.593E+00
DAV:   9    -0.846957328276E+03    0.45195E-01   -0.41493E-01  3183   0.150E+00    0.860E-01
DAV:  10    -0.846963348721E+03   -0.60204E-02   -0.68052E-02  3129   0.582E-01    0.589E-01
DAV:  11    -0.846962874512E+03    0.47421E-03   -0.63558E-03  3129   0.208E-01    0.328E-01
DAV:  12    -0.846963874824E+03   -0.10003E-02   -0.70584E-03  3075   0.247E-01    0.116E-01
DAV:  13    -0.846966920422E+03   -0.30456E-02   -0.43623E-03  3219   0.210E-01    0.134E-01
DAV:  14    -0.846970754338E+03   -0.38339E-02   -0.26890E-03  3066   0.135E-01    0.929E-02
DAV:  15    -0.846975817629E+03   -0.50633E-02   -0.13248E-03  3048   0.933E-02    0.393E-02
DAV:  16    -0.846977848823E+03   -0.20312E-02   -0.41006E-04  3129   0.481E-02    0.377E-02
DAV:  17    -0.846978759999E+03   -0.91118E-03   -0.17373E-04  3102   0.313E-02    0.243E-02
DAV:  18    -0.846979531780E+03   -0.77178E-03   -0.28131E-05  2373   0.172E-02    0.131E-02
DAV:  19    -0.846980097742E+03   -0.56596E-03   -0.35810E-05  2616   0.201E-02    0.817E-03
DAV:  20    -0.846980210832E+03   -0.11309E-03   -0.36379E-05  2733   0.162E-02    0.681E-03
DAV:  21    -0.846980240900E+03   -0.30068E-04   -0.45184E-06  2022   0.499E-03    0.572E-03
DAV:  22    -0.846980259123E+03   -0.18223E-04   -0.18910E-06  1977   0.312E-03    0.314E-03
DAV:  23    -0.846980271476E+03   -0.12353E-04   -0.16530E-06  1968   0.324E-03    0.149E-03
DAV:  24    -0.846980274047E+03   -0.25712E-05   -0.77727E-07  2004   0.184E-03 
   1 F= -.84698027E+03 E0= -.84698414E+03  d E =0.115958E-01