./iterations/neb0_image03_iter13_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     0.422719381019E+04    0.42272E+04   -0.23858E+05  2892   0.117E+03 
DAV:   2    -0.428421348759E+03   -0.46556E+04   -0.45584E+04  3357   0.329E+02 
DAV:   3    -0.942271694922E+03   -0.51385E+03   -0.51159E+03  3120   0.117E+02 
DAV:   4    -0.954609383528E+03   -0.12338E+02   -0.12291E+02  3201   0.196E+01 
DAV:   5    -0.955010287728E+03   -0.40090E+00   -0.40036E+00  3183   0.319E+00    0.811E+01
DAV:   6    -0.846754018502E+03    0.10826E+03   -0.47214E+02  3066   0.347E+01    0.375E+01
DAV:   7    -0.846304971422E+03    0.44905E+00   -0.14463E+01  3543   0.609E+00    0.146E+01
DAV:   8    -0.845980170334E+03    0.32480E+00   -0.97314E-01  3165   0.237E+00    0.596E+00
DAV:   9    -0.845940941576E+03    0.39229E-01   -0.42017E-01  3192   0.150E+00    0.860E-01
DAV:  10    -0.845947035658E+03   -0.60941E-02   -0.66682E-02  3165   0.573E-01    0.598E-01
DAV:  11    -0.845946616511E+03    0.41915E-03   -0.63746E-03  3147   0.207E-01    0.330E-01
DAV:  12    -0.845947213929E+03   -0.59742E-03   -0.66064E-03  3093   0.242E-01    0.113E-01
DAV:  13    -0.845949696973E+03   -0.24830E-02   -0.41472E-03  3147   0.207E-01    0.131E-01
DAV:  14    -0.845953125019E+03   -0.34280E-02   -0.24991E-03  3075   0.130E-01    0.902E-02
DAV:  15    -0.845957859166E+03   -0.47341E-02   -0.13093E-03  3048   0.944E-02    0.414E-02
DAV:  16    -0.845959757571E+03   -0.18984E-02   -0.39568E-04  3120   0.502E-02    0.371E-02
DAV:  17    -0.845960657452E+03   -0.89988E-03   -0.21312E-04  3111   0.334E-02    0.259E-02
DAV:  18    -0.845961386978E+03   -0.72953E-03   -0.30804E-05  2364   0.191E-02    0.123E-02
DAV:  19    -0.845961944091E+03   -0.55711E-03   -0.39291E-05  2670   0.213E-02    0.695E-03
DAV:  20    -0.845962048269E+03   -0.10418E-03   -0.33074E-05  2751   0.147E-02    0.693E-03
DAV:  21    -0.845962081278E+03   -0.33008E-04   -0.35232E-06  2022   0.419E-03    0.578E-03
DAV:  22    -0.845962102174E+03   -0.20897E-04   -0.17986E-06  1986   0.278E-03    0.282E-03
DAV:  23    -0.845962118358E+03   -0.16184E-04   -0.18564E-06  2004   0.345E-03    0.943E-04
DAV:  24    -0.845962120180E+03   -0.18216E-05   -0.67294E-07  2031   0.167E-03 
   1 F= -.84596212E+03 E0= -.84596599E+03  d E =0.115959E-01