./iterations/neb0_image08_iter49_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     0.423757903397E+04    0.42376E+04   -0.23865E+05  2892   0.117E+03 
DAV:   2    -0.428241637657E+03   -0.46658E+04   -0.45669E+04  3360   0.329E+02 
DAV:   3    -0.942942116185E+03   -0.51470E+03   -0.51252E+03  3120   0.118E+02 
DAV:   4    -0.955209929815E+03   -0.12268E+02   -0.12222E+02  3192   0.196E+01 
DAV:   5    -0.955607360362E+03   -0.39743E+00   -0.39689E+00  3192   0.319E+00    0.813E+01
DAV:   6    -0.847558384790E+03    0.10805E+03   -0.47165E+02  3084   0.348E+01    0.376E+01
DAV:   7    -0.846948093499E+03    0.61029E+00   -0.14809E+01  3516   0.639E+00    0.148E+01
DAV:   8    -0.846642397053E+03    0.30570E+00   -0.20686E+00  3183   0.357E+00    0.606E+00
DAV:   9    -0.846546678652E+03    0.95718E-01   -0.77455E-01  3336   0.212E+00    0.149E+00
DAV:  10    -0.846500875985E+03    0.45803E-01   -0.15441E-01  3435   0.107E+00    0.102E+00
DAV:  11    -0.846480361825E+03    0.20514E-01   -0.95794E-02  3534   0.960E-01    0.984E-01
DAV:  12    -0.846474410291E+03    0.59515E-02   -0.11524E-01  3570   0.560E-01    0.622E-01
DAV:  13    -0.846470336111E+03    0.40742E-02   -0.89474E-02  3147   0.672E-01    0.896E-01
DAV:  14    -0.846461537440E+03    0.87987E-02   -0.25896E-02  3291   0.326E-01    0.308E-01
DAV:  15    -0.846461412519E+03    0.12492E-03   -0.18370E-02  3066   0.341E-01    0.357E-01
DAV:  16    -0.846460452106E+03    0.96041E-03   -0.11859E-02  3345   0.224E-01    0.314E-01
DAV:  17    -0.846460106847E+03    0.34526E-03   -0.50965E-03  3129   0.146E-01    0.160E-01
DAV:  18    -0.846462225552E+03   -0.21187E-02   -0.34779E-03  3138   0.133E-01    0.182E-01
DAV:  19    -0.846465564509E+03   -0.33390E-02   -0.24323E-03  3075   0.121E-01    0.810E-02
DAV:  20    -0.846467550422E+03   -0.19859E-02   -0.14542E-03  3093   0.858E-02    0.729E-02
DAV:  21    -0.846469761763E+03   -0.22113E-02   -0.27756E-04  3084   0.432E-02    0.525E-02
DAV:  22    -0.846471498151E+03   -0.17364E-02   -0.20672E-04  3066   0.350E-02    0.260E-02
DAV:  23    -0.846472199426E+03   -0.70128E-03   -0.91698E-05  3030   0.261E-02    0.196E-02
DAV:  24    -0.846472576732E+03   -0.37731E-03   -0.36826E-05  2202   0.183E-02    0.158E-02
DAV:  25    -0.846472790068E+03   -0.21334E-03   -0.19257E-05  1986   0.105E-02    0.906E-03
DAV:  26    -0.846472944714E+03   -0.15465E-03   -0.87106E-06  1977   0.750E-03    0.518E-03
DAV:  27    -0.846473047890E+03   -0.10318E-03   -0.55562E-06  1959   0.909E-03    0.327E-03
DAV:  28    -0.846473062706E+03   -0.14816E-04   -0.39387E-06  2013   0.401E-03    0.258E-03
DAV:  29    -0.846473069156E+03   -0.64494E-05   -0.91405E-07  1959   0.186E-03 
   1 F= -.84647307E+03 E0= -.84652197E+03  d E =0.146711E+00