./iterations/neb0_image04_iter44_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     0.423735722141E+04    0.42374E+04   -0.23866E+05  2892   0.117E+03 
DAV:   2    -0.426521312062E+03   -0.46639E+04   -0.45674E+04  3348   0.329E+02 
DAV:   3    -0.942409625685E+03   -0.51589E+03   -0.51363E+03  3120   0.118E+02 
DAV:   4    -0.954818831440E+03   -0.12409E+02   -0.12362E+02  3192   0.197E+01 
DAV:   5    -0.955228688146E+03   -0.40986E+00   -0.40930E+00  3201   0.322E+00    0.813E+01
DAV:   6    -0.847089603389E+03    0.10814E+03   -0.47062E+02  3057   0.347E+01    0.376E+01
DAV:   7    -0.846627835969E+03    0.46177E+00   -0.14419E+01  3543   0.609E+00    0.146E+01
DAV:   8    -0.846296270867E+03    0.33157E+00   -0.97568E-01  3165   0.238E+00    0.594E+00
DAV:   9    -0.846251607766E+03    0.44663E-01   -0.41165E-01  3192   0.153E+00    0.857E-01
DAV:  10    -0.846257832811E+03   -0.62250E-02   -0.74258E-02  3138   0.610E-01    0.612E-01
DAV:  11    -0.846257303852E+03    0.52896E-03   -0.64892E-03  3111   0.209E-01    0.353E-01
DAV:  12    -0.846257930011E+03   -0.62616E-03   -0.71246E-03  3084   0.250E-01    0.120E-01
DAV:  13    -0.846261051881E+03   -0.31219E-02   -0.45710E-03  3201   0.219E-01    0.138E-01
DAV:  14    -0.846265173154E+03   -0.41213E-02   -0.31508E-03  3057   0.149E-01    0.986E-02
DAV:  15    -0.846269801654E+03   -0.46285E-02   -0.12251E-03  3129   0.877E-02    0.370E-02
DAV:  16    -0.846272266063E+03   -0.24644E-02   -0.43476E-04  3084   0.514E-02    0.392E-02
DAV:  17    -0.846273321648E+03   -0.10556E-02   -0.27404E-04  3147   0.408E-02    0.282E-02
DAV:  18    -0.846273982133E+03   -0.66048E-03   -0.35675E-05  2625   0.201E-02    0.151E-02
DAV:  19    -0.846274616158E+03   -0.63402E-03   -0.40921E-05  2652   0.224E-02    0.750E-03
DAV:  20    -0.846274735577E+03   -0.11942E-03   -0.37444E-05  2805   0.154E-02    0.711E-03
DAV:  21    -0.846274781067E+03   -0.45490E-04   -0.35649E-06  2004   0.471E-03    0.621E-03
DAV:  22    -0.846274805336E+03   -0.24270E-04   -0.23616E-06  1977   0.342E-03    0.290E-03
DAV:  23    -0.846274817134E+03   -0.11798E-04   -0.17340E-06  1977   0.317E-03    0.128E-03
DAV:  24    -0.846274819651E+03   -0.25167E-05   -0.66607E-07  1995   0.179E-03 
   1 F= -.84627482E+03 E0= -.84627868E+03  d E =0.115959E-01