iterations/neb0_image05_iter75_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     0.422732148131E+04    0.42273E+04   -0.23876E+05  2901   0.117E+03 
DAV:   2    -0.428422842953E+03   -0.46557E+04   -0.45595E+04  3357   0.329E+02 
DAV:   3    -0.942456281068E+03   -0.51403E+03   -0.51177E+03  3120   0.117E+02 
DAV:   4    -0.954789269540E+03   -0.12333E+02   -0.12286E+02  3192   0.196E+01 
DAV:   5    -0.955195616026E+03   -0.40635E+00   -0.40581E+00  3201   0.321E+00    0.811E+01
DAV:   6    -0.847199415446E+03    0.10800E+03   -0.46975E+02  3057   0.347E+01    0.375E+01
DAV:   7    -0.846675939588E+03    0.52348E+00   -0.14707E+01  3552   0.627E+00    0.146E+01
DAV:   8    -0.846342029892E+03    0.33391E+00   -0.16388E+00  3390   0.308E+00    0.613E+00
DAV:   9    -0.846212660704E+03    0.12937E+00   -0.55793E-01  3300   0.190E+00    0.142E+00
DAV:  10    -0.846224081755E+03   -0.11421E-01   -0.21641E-01  3336   0.167E+00    0.149E+00
DAV:  11    -0.846184953206E+03    0.39129E-01   -0.15504E-01  3417   0.934E-01    0.119E+00
DAV:  12    -0.846174859100E+03    0.10094E-01   -0.62769E-02  3129   0.426E-01    0.655E-01
DAV:  13    -0.846170012169E+03    0.48469E-02   -0.16690E-02  3120   0.381E-01    0.471E-01
DAV:  14    -0.846168043530E+03    0.19686E-02   -0.23604E-02  3813   0.365E-01    0.409E-01
DAV:  15    -0.846164875256E+03    0.31683E-02   -0.12294E-02  3354   0.406E-01    0.380E-01
DAV:  16    -0.846163943581E+03    0.93167E-03   -0.69847E-03  3165   0.160E-01    0.192E-01
DAV:  17    -0.846165026587E+03   -0.10830E-02   -0.24498E-03  3012   0.156E-01    0.145E-01
DAV:  18    -0.846168280698E+03   -0.32541E-02   -0.29179E-03  3201   0.176E-01    0.113E-01
DAV:  19    -0.846171098772E+03   -0.28181E-02   -0.21383E-03  3102   0.137E-01    0.107E-01
DAV:  20    -0.846173078994E+03   -0.19802E-02   -0.76358E-04  3129   0.670E-02    0.681E-02
DAV:  21    -0.846174582924E+03   -0.15039E-02   -0.31967E-04  3102   0.412E-02    0.361E-02
DAV:  22    -0.846175752445E+03   -0.11695E-02   -0.13991E-04  3111   0.271E-02    0.244E-02
DAV:  23    -0.846176464615E+03   -0.71217E-03   -0.57727E-05  2481   0.232E-02    0.321E-02
DAV:  24    -0.846176850510E+03   -0.38590E-03   -0.43667E-05  2571   0.171E-02    0.981E-03
DAV:  25    -0.846176986148E+03   -0.13564E-03   -0.11809E-05  2022   0.761E-03    0.109E-02
DAV:  26    -0.846177072438E+03   -0.86290E-04   -0.62967E-06  1950   0.766E-03    0.678E-03
DAV:  27    -0.846177168149E+03   -0.95711E-04   -0.76253E-06  2004   0.855E-03    0.342E-03
DAV:  28    -0.846177185625E+03   -0.17476E-04   -0.40038E-06  1995   0.457E-03    0.310E-03
DAV:  29    -0.846177191232E+03   -0.56068E-05   -0.11373E-06  2004   0.221E-03 
   1 F= -.84617719E+03 E0= -.84622251E+03  d E =0.135955E+00