./iterations/neb0_image07_iter40_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     0.423820681463E+04    0.42382E+04   -0.23864E+05  2892   0.117E+03 
DAV:   2    -0.425430332358E+03   -0.46636E+04   -0.45661E+04  3345   0.329E+02 
DAV:   3    -0.942602388803E+03   -0.51717E+03   -0.51491E+03  3120   0.118E+02 
DAV:   4    -0.955007043747E+03   -0.12405E+02   -0.12357E+02  3183   0.196E+01 
DAV:   5    -0.955415526932E+03   -0.40848E+00   -0.40794E+00  3192   0.322E+00    0.812E+01
DAV:   6    -0.847218644111E+03    0.10820E+03   -0.47100E+02  3057   0.347E+01    0.376E+01
DAV:   7    -0.846820439702E+03    0.39820E+00   -0.14485E+01  3543   0.645E+00    0.147E+01
DAV:   8    -0.846387421981E+03    0.43302E+00   -0.14555E+00  3525   0.334E+00    0.622E+00
DAV:   9    -0.846317974257E+03    0.69448E-01   -0.60078E-01  3174   0.175E+00    0.131E+00
DAV:  10    -0.846287175696E+03    0.30799E-01   -0.18115E-01  3156   0.953E-01    0.122E+00
DAV:  11    -0.846272501547E+03    0.14674E-01   -0.25976E-02  3606   0.665E-01    0.983E-01
DAV:  12    -0.846277745423E+03   -0.52439E-02   -0.69697E-02  3579   0.536E-01    0.123E+00
DAV:  13    -0.846266879208E+03    0.10866E-01   -0.16117E-01  3894   0.558E-01    0.105E+00
DAV:  14    -0.846259696707E+03    0.71825E-02   -0.11582E-02  3543   0.499E-01    0.807E-01
DAV:  15    -0.846257504310E+03    0.21924E-02   -0.12388E-02  3291   0.284E-01    0.721E-01
DAV:  16    -0.846254388132E+03    0.31162E-02   -0.55274E-03  3048   0.212E-01    0.551E-01
DAV:  17    -0.846253790220E+03    0.59791E-03   -0.70903E-03  3255   0.220E-01    0.157E-01
DAV:  18    -0.846257623235E+03   -0.38330E-02   -0.42468E-03  3210   0.187E-01    0.240E-01
DAV:  19    -0.846259628443E+03   -0.20052E-02   -0.15814E-03  3138   0.110E-01    0.129E-01
DAV:  20    -0.846260783830E+03   -0.11554E-02   -0.37509E-04  3111   0.515E-02    0.753E-02
DAV:  21    -0.846263062179E+03   -0.22783E-02   -0.32989E-04  3129   0.773E-02    0.878E-02
DAV:  22    -0.846264269422E+03   -0.12072E-02   -0.45980E-04  3552   0.669E-02    0.307E-02
DAV:  23    -0.846264831620E+03   -0.56220E-03   -0.15969E-04  3399   0.503E-02    0.308E-02
DAV:  24    -0.846265176566E+03   -0.34495E-03   -0.66150E-05  3237   0.385E-02    0.212E-02
DAV:  25    -0.846265432260E+03   -0.25569E-03   -0.48919E-05  3228   0.523E-02    0.164E-02
DAV:  26    -0.846265532260E+03   -0.10000E-03   -0.12183E-04  3669   0.480E-02    0.161E-02
DAV:  27    -0.846265551984E+03   -0.19723E-04   -0.77633E-05  3210   0.308E-02    0.115E-02
DAV:  28    -0.846265555391E+03   -0.34075E-05   -0.79947E-06  2094   0.196E-02 
   1 F= -.84626556E+03 E0= -.84631224E+03  d E =0.140062E+00