./iterations/neb0_image06_iter57_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     0.423920673193E+04    0.42392E+04   -0.23862E+05  2892   0.117E+03 
DAV:   2    -0.428345035429E+03   -0.46676E+04   -0.45705E+04  3375   0.329E+02 
DAV:   3    -0.942410109209E+03   -0.51407E+03   -0.51183E+03  3120   0.117E+02 
DAV:   4    -0.954670292287E+03   -0.12260E+02   -0.12215E+02  3201   0.196E+01 
DAV:   5    -0.955066702151E+03   -0.39641E+00   -0.39587E+00  3183   0.319E+00    0.811E+01
DAV:   6    -0.847077709003E+03    0.10799E+03   -0.46990E+02  3057   0.347E+01    0.375E+01
DAV:   7    -0.846607819544E+03    0.46989E+00   -0.14601E+01  3525   0.609E+00    0.146E+01
DAV:   8    -0.846253293154E+03    0.35453E+00   -0.96434E-01  3147   0.233E+00    0.597E+00
DAV:   9    -0.846183381838E+03    0.69911E-01   -0.42469E-01  3183   0.147E+00    0.866E-01
DAV:  10    -0.846179402596E+03    0.39792E-02   -0.69384E-02  3102   0.584E-01    0.575E-01
DAV:  11    -0.846173726525E+03    0.56761E-02   -0.68064E-03  3138   0.227E-01    0.319E-01
DAV:  12    -0.846168499405E+03    0.52271E-02   -0.76739E-03  3093   0.272E-01    0.125E-01
DAV:  13    -0.846168461231E+03    0.38174E-04   -0.49044E-03  3075   0.233E-01    0.147E-01
DAV:  14    -0.846171631297E+03   -0.31701E-02   -0.33377E-03  3075   0.157E-01    0.102E-01
DAV:  15    -0.846176917827E+03   -0.52865E-02   -0.14876E-03  3111   0.122E-01    0.419E-02
DAV:  16    -0.846179125555E+03   -0.22077E-02   -0.59330E-04  3102   0.590E-02    0.380E-02
DAV:  17    -0.846180070722E+03   -0.94517E-03   -0.14501E-04  3120   0.259E-02    0.240E-02
DAV:  18    -0.846181172229E+03   -0.11015E-02   -0.46298E-05  2652   0.169E-02    0.108E-02
DAV:  19    -0.846181830870E+03   -0.65864E-03   -0.32720E-05  2499   0.182E-02    0.886E-03
DAV:  20    -0.846181965663E+03   -0.13479E-03   -0.28634E-05  2607   0.130E-02    0.692E-03
DAV:  21    -0.846182020266E+03   -0.54603E-04   -0.46860E-06  1977   0.648E-03    0.379E-03
DAV:  22    -0.846182077873E+03   -0.57607E-04   -0.40412E-06  1950   0.547E-03    0.214E-03
DAV:  23    -0.846182090200E+03   -0.12327E-04   -0.23174E-06  1986   0.377E-03    0.218E-03
DAV:  24    -0.846182093454E+03   -0.32542E-05   -0.11669E-06  1995   0.299E-03 
   1 F= -.84618209E+03 E0= -.84618596E+03  d E =0.116123E-01