./iterations/neb0_image06_iter60_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     0.423918589968E+04    0.42392E+04   -0.23862E+05  2892   0.117E+03 
DAV:   2    -0.428440366206E+03   -0.46676E+04   -0.45707E+04  3375   0.329E+02 
DAV:   3    -0.942461899783E+03   -0.51402E+03   -0.51178E+03  3120   0.117E+02 
DAV:   4    -0.954717265566E+03   -0.12255E+02   -0.12210E+02  3201   0.196E+01 
DAV:   5    -0.955113334431E+03   -0.39607E+00   -0.39553E+00  3183   0.318E+00    0.811E+01
DAV:   6    -0.847074848838E+03    0.10804E+03   -0.47006E+02  3057   0.347E+01    0.375E+01
DAV:   7    -0.846607885266E+03    0.46696E+00   -0.14615E+01  3525   0.609E+00    0.146E+01
DAV:   8    -0.846253607731E+03    0.35428E+00   -0.96557E-01  3156   0.233E+00    0.598E+00
DAV:   9    -0.846184653720E+03    0.68954E-01   -0.42473E-01  3174   0.147E+00    0.866E-01
DAV:  10    -0.846180940704E+03    0.37130E-02   -0.70464E-02  3102   0.587E-01    0.575E-01
DAV:  11    -0.846175483554E+03    0.54571E-02   -0.67972E-03  3156   0.226E-01    0.322E-01
DAV:  12    -0.846170456979E+03    0.50266E-02   -0.77871E-03  3093   0.272E-01    0.126E-01
DAV:  13    -0.846170456100E+03    0.87965E-06   -0.48368E-03  3093   0.230E-01    0.147E-01
DAV:  14    -0.846173538686E+03   -0.30826E-02   -0.33131E-03  3057   0.156E-01    0.103E-01
DAV:  15    -0.846178787578E+03   -0.52489E-02   -0.14201E-03  3120   0.121E-01    0.404E-02
DAV:  16    -0.846181059393E+03   -0.22718E-02   -0.62280E-04  3102   0.594E-02    0.382E-02
DAV:  17    -0.846182029889E+03   -0.97050E-03   -0.13929E-04  3138   0.259E-02    0.237E-02
DAV:  18    -0.846183143619E+03   -0.11137E-02   -0.48242E-05  2715   0.171E-02    0.108E-02
DAV:  19    -0.846183780010E+03   -0.63639E-03   -0.31430E-05  2490   0.177E-02    0.921E-03
DAV:  20    -0.846183921287E+03   -0.14128E-03   -0.27259E-05  2544   0.128E-02    0.693E-03
DAV:  21    -0.846183981783E+03   -0.60496E-04   -0.49552E-06  1986   0.656E-03    0.375E-03
DAV:  22    -0.846184035546E+03   -0.53763E-04   -0.43910E-06  1959   0.587E-03    0.240E-03
DAV:  23    -0.846184046346E+03   -0.10800E-04   -0.24145E-06  1995   0.380E-03    0.265E-03
DAV:  24    -0.846184049692E+03   -0.33460E-05   -0.11083E-06  1977   0.291E-03 
   1 F= -.84618405E+03 E0= -.84618792E+03  d E =0.116043E-01