iterations/neb0_image09_iter84_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     0.422366284206E+04    0.42237E+04   -0.23876E+05  2901   0.117E+03 
DAV:   2    -0.430324719093E+03   -0.46540E+04   -0.45555E+04  3366   0.329E+02 
DAV:   3    -0.943007068684E+03   -0.51268E+03   -0.51052E+03  3120   0.117E+02 
DAV:   4    -0.955234809679E+03   -0.12228E+02   -0.12183E+02  3183   0.195E+01 
DAV:   5    -0.955637472810E+03   -0.40266E+00   -0.40213E+00  3174   0.321E+00    0.812E+01
DAV:   6    -0.847646113839E+03    0.10799E+03   -0.47156E+02  3057   0.348E+01    0.376E+01
DAV:   7    -0.847084816935E+03    0.56130E+00   -0.14672E+01  3516   0.625E+00    0.148E+01
DAV:   8    -0.846739727250E+03    0.34509E+00   -0.16738E+00  3219   0.354E+00    0.605E+00
DAV:   9    -0.846638855000E+03    0.10087E+00   -0.66569E-01  3201   0.195E+00    0.128E+00
DAV:  10    -0.846607685893E+03    0.31169E-01   -0.12199E-01  3228   0.116E+00    0.973E-01
DAV:  11    -0.846605645017E+03    0.20409E-02   -0.13533E-01  3624   0.975E-01    0.120E+00
DAV:  12    -0.846605955467E+03   -0.31045E-03   -0.22210E-01  3795   0.896E-01    0.846E-01
DAV:  13    -0.846588039083E+03    0.17916E-01   -0.33755E-02  3237   0.581E-01    0.553E-01
DAV:  14    -0.846582373650E+03    0.56654E-02   -0.14261E-02  3192   0.388E-01    0.286E-01
DAV:  15    -0.846582746860E+03   -0.37321E-03   -0.10111E-02  3066   0.299E-01    0.434E-01
DAV:  16    -0.846580713498E+03    0.20334E-02   -0.99819E-03  3255   0.212E-01    0.162E-01
DAV:  17    -0.846582395427E+03   -0.16819E-02   -0.26403E-03  3021   0.120E-01    0.118E-01
DAV:  18    -0.846584687714E+03   -0.22923E-02   -0.16446E-03  3192   0.154E-01    0.714E-02
DAV:  19    -0.846588330507E+03   -0.36428E-02   -0.15901E-03  3066   0.110E-01    0.805E-02
DAV:  20    -0.846590451491E+03   -0.21210E-02   -0.78326E-04  3165   0.703E-02    0.552E-02
DAV:  21    -0.846591931601E+03   -0.14801E-02   -0.28872E-04  3084   0.350E-02    0.317E-02
DAV:  22    -0.846593311335E+03   -0.13797E-02   -0.11342E-04  3075   0.256E-02    0.219E-02
DAV:  23    -0.846593967717E+03   -0.65638E-03   -0.54255E-05  2598   0.218E-02    0.132E-02
DAV:  24    -0.846594324751E+03   -0.35703E-03   -0.23912E-05  2040   0.127E-02    0.825E-03
DAV:  25    -0.846594505400E+03   -0.18065E-03   -0.79672E-06  1977   0.911E-03    0.653E-03
DAV:  26    -0.846594634906E+03   -0.12951E-03   -0.93116E-06  1959   0.780E-03    0.309E-03
DAV:  27    -0.846594672978E+03   -0.38072E-04   -0.43382E-06  1995   0.505E-03    0.328E-03
DAV:  28    -0.846594680858E+03   -0.78804E-05   -0.18306E-06  2004   0.304E-03 
   1 F= -.84659468E+03 E0= -.84664546E+03  d E =0.152326E+00