./iterations/neb0_image07_iter67_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     0.423802018490E+04    0.42380E+04   -0.23863E+05  2892   0.117E+03 
DAV:   2    -0.428874131798E+03   -0.46669E+04   -0.45688E+04  3369   0.329E+02 
DAV:   3    -0.942794406382E+03   -0.51392E+03   -0.51171E+03  3120   0.117E+02 
DAV:   4    -0.955040874137E+03   -0.12246E+02   -0.12201E+02  3192   0.195E+01 
DAV:   5    -0.955436412203E+03   -0.39554E+00   -0.39500E+00  3192   0.318E+00    0.812E+01
DAV:   6    -0.847501073271E+03    0.10794E+03   -0.47079E+02  3102   0.348E+01    0.376E+01
DAV:   7    -0.846833243016E+03    0.66783E+00   -0.14837E+01  3525   0.656E+00    0.148E+01
DAV:   8    -0.846529810440E+03    0.30343E+00   -0.10929E+00  3201   0.297E+00    0.594E+00
DAV:   9    -0.846436902618E+03    0.92908E-01   -0.62142E-01  3426   0.232E+00    0.154E+00
DAV:  10    -0.846424201774E+03    0.12701E-01   -0.33507E-01  3264   0.111E+00    0.148E+00
DAV:  11    -0.846396305118E+03    0.27897E-01   -0.55409E-02  3201   0.570E-01    0.918E-01
DAV:  12    -0.846400778458E+03   -0.44733E-02   -0.11595E-01  3507   0.576E-01    0.145E+00
DAV:  13    -0.846390132261E+03    0.10646E-01   -0.19476E-02  3966   0.446E-01    0.842E-01
DAV:  14    -0.846383545704E+03    0.65866E-02   -0.37785E-02  3435   0.330E-01    0.351E-01
DAV:  15    -0.846381527034E+03    0.20187E-02   -0.63634E-03  3084   0.225E-01    0.229E-01
DAV:  16    -0.846381502724E+03    0.24310E-04   -0.49076E-03  3219   0.176E-01    0.159E-01
DAV:  17    -0.846383085496E+03   -0.15828E-02   -0.49129E-03  3291   0.137E-01    0.242E-01
DAV:  18    -0.846385425826E+03   -0.23403E-02   -0.87517E-03  3237   0.160E-01    0.235E-01
DAV:  19    -0.846388772085E+03   -0.33463E-02   -0.17107E-03  3066   0.978E-02    0.116E-01
DAV:  20    -0.846391105105E+03   -0.23330E-02   -0.69107E-04  3102   0.593E-02    0.855E-02
DAV:  21    -0.846392826638E+03   -0.17215E-02   -0.92406E-04  3471   0.518E-02    0.930E-02
DAV:  22    -0.846393980325E+03   -0.11537E-02   -0.19699E-04  3102   0.315E-02    0.650E-02
DAV:  23    -0.846394287740E+03   -0.30741E-03   -0.61251E-05  2931   0.163E-02    0.382E-02
DAV:  24    -0.846394625769E+03   -0.33803E-03   -0.49487E-05  2076   0.131E-02    0.113E-02
DAV:  25    -0.846394845585E+03   -0.21982E-03   -0.19488E-05  2139   0.111E-02    0.723E-03
DAV:  26    -0.846394905687E+03   -0.60102E-04   -0.56265E-06  1977   0.636E-03    0.471E-03
DAV:  27    -0.846394964175E+03   -0.58488E-04   -0.38026E-06  1959   0.548E-03    0.451E-03
DAV:  28    -0.846394989949E+03   -0.25774E-04   -0.21691E-06  1977   0.389E-03    0.407E-03
DAV:  29    -0.846394995193E+03   -0.52437E-05   -0.14330E-06  2004   0.288E-03 
   1 F= -.84639500E+03 E0= -.84644380E+03  d E =0.146412E+00