./iterations/neb0_image04_iter29_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     0.423375805866E+04    0.42338E+04   -0.23862E+05  2892   0.117E+03 
DAV:   2    -0.428818220796E+03   -0.46626E+04   -0.45680E+04  3360   0.329E+02 
DAV:   3    -0.942212154044E+03   -0.51339E+03   -0.51113E+03  3120   0.117E+02 
DAV:   4    -0.954502378887E+03   -0.12290E+02   -0.12243E+02  3192   0.196E+01 
DAV:   5    -0.954905943936E+03   -0.40357E+00   -0.40299E+00  3183   0.320E+00    0.812E+01
DAV:   6    -0.846745926857E+03    0.10816E+03   -0.47078E+02  3057   0.347E+01    0.376E+01
DAV:   7    -0.846288733146E+03    0.45719E+00   -0.14396E+01  3543   0.610E+00    0.146E+01
DAV:   8    -0.845960766814E+03    0.32797E+00   -0.97546E-01  3165   0.239E+00    0.596E+00
DAV:   9    -0.845918860922E+03    0.41906E-01   -0.41610E-01  3183   0.153E+00    0.859E-01
DAV:  10    -0.845924860847E+03   -0.59999E-02   -0.72453E-02  3111   0.602E-01    0.608E-01
DAV:  11    -0.845924180982E+03    0.67986E-03   -0.65681E-03  3111   0.210E-01    0.350E-01
DAV:  12    -0.845924385874E+03   -0.20489E-03   -0.68717E-03  3084   0.248E-01    0.118E-01
DAV:  13    -0.845926925071E+03   -0.25392E-02   -0.43592E-03  3129   0.216E-01    0.135E-01
DAV:  14    -0.845930604454E+03   -0.36794E-02   -0.30593E-03  3111   0.147E-01    0.958E-02
DAV:  15    -0.845935191047E+03   -0.45866E-02   -0.12979E-03  3084   0.949E-02    0.406E-02
DAV:  16    -0.845937394367E+03   -0.22033E-02   -0.40434E-04  3138   0.520E-02    0.386E-02
DAV:  17    -0.845938457876E+03   -0.10635E-02   -0.26878E-04  3129   0.394E-02    0.270E-02
DAV:  18    -0.845939161771E+03   -0.70390E-03   -0.34989E-05  2598   0.204E-02    0.135E-02
DAV:  19    -0.845939756501E+03   -0.59473E-03   -0.37498E-05  2670   0.215E-02    0.698E-03
DAV:  20    -0.845939854533E+03   -0.98033E-04   -0.29873E-05  2679   0.133E-02    0.629E-03
DAV:  21    -0.845939899313E+03   -0.44780E-04   -0.28004E-06  1995   0.402E-03    0.537E-03
DAV:  22    -0.845939929241E+03   -0.29928E-04   -0.25016E-06  1968   0.360E-03    0.214E-03
DAV:  23    -0.845939939720E+03   -0.10479E-04   -0.14575E-06  1986   0.308E-03    0.124E-03
DAV:  24    -0.845939941871E+03   -0.21505E-05   -0.59234E-07  1995   0.170E-03 
   1 F= -.84593994E+03 E0= -.84594381E+03  d E =0.115959E-01