./iterations/neb0_image05_iter5_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     0.422548889704E+04    0.42255E+04   -0.23849E+05  2892   0.117E+03 
DAV:   2    -0.423629093531E+03   -0.46491E+04   -0.45515E+04  3351   0.329E+02 
DAV:   3    -0.938110512906E+03   -0.51448E+03   -0.51209E+03  3129   0.118E+02 
DAV:   4    -0.950491711944E+03   -0.12381E+02   -0.12336E+02  3201   0.196E+01 
DAV:   5    -0.950887096658E+03   -0.39538E+00   -0.39487E+00  3183   0.318E+00    0.813E+01
DAV:   6    -0.842306747493E+03    0.10858E+03   -0.47424E+02  3048   0.348E+01    0.376E+01
DAV:   7    -0.841786285006E+03    0.52046E+00   -0.14588E+01  3480   0.622E+00    0.147E+01
DAV:   8    -0.841439468127E+03    0.34682E+00   -0.99763E-01  3183   0.239E+00    0.602E+00
DAV:   9    -0.841401840405E+03    0.37628E-01   -0.42881E-01  3147   0.155E+00    0.987E-01
DAV:  10    -0.841397767227E+03    0.40732E-02   -0.78963E-02  3192   0.583E-01    0.679E-01
DAV:  11    -0.841396102269E+03    0.16650E-02   -0.10689E-02  3102   0.247E-01    0.332E-01
DAV:  12    -0.841394377827E+03    0.17244E-02   -0.60951E-03  3246   0.257E-01    0.129E-01
DAV:  13    -0.841395548568E+03   -0.11707E-02   -0.48297E-03  3084   0.222E-01    0.127E-01
DAV:  14    -0.841398372843E+03   -0.28243E-02   -0.21925E-03  3075   0.115E-01    0.925E-02
DAV:  15    -0.841401230109E+03   -0.28573E-02   -0.51156E-04  3093   0.514E-02    0.458E-02
DAV:  16    -0.841405499637E+03   -0.42695E-02   -0.96432E-04  3057   0.719E-02    0.392E-02
DAV:  17    -0.841406650192E+03   -0.11506E-02   -0.34293E-04  3093   0.388E-02    0.247E-02
DAV:  18    -0.841407537782E+03   -0.88759E-03   -0.34951E-05  2607   0.175E-02    0.164E-02
DAV:  19    -0.841408302778E+03   -0.76500E-03   -0.58449E-05  2787   0.250E-02    0.706E-03
DAV:  20    -0.841408465278E+03   -0.16250E-03   -0.31927E-05  2706   0.141E-02    0.671E-03
DAV:  21    -0.841408518839E+03   -0.53561E-04   -0.42663E-06  2040   0.457E-03    0.432E-03
DAV:  22    -0.841408550881E+03   -0.32042E-04   -0.24218E-06  1977   0.305E-03    0.233E-03
DAV:  23    -0.841408568363E+03   -0.17483E-04   -0.14175E-06  2031   0.371E-03    0.102E-03
DAV:  24    -0.841408571307E+03   -0.29441E-05   -0.10852E-06  2004   0.240E-03 
   1 F= -.84140857E+03 E0= -.84141458E+03  d E =0.180201E-01