./iterations/neb0_image04_iter8_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     0.422235113411E+04    0.42224E+04   -0.23846E+05  2892   0.117E+03 
DAV:   2    -0.426594682967E+03   -0.46489E+04   -0.45530E+04  3360   0.329E+02 
DAV:   3    -0.939273019452E+03   -0.51268E+03   -0.51034E+03  3120   0.117E+02 
DAV:   4    -0.951599518012E+03   -0.12326E+02   -0.12279E+02  3192   0.196E+01 
DAV:   5    -0.952007353819E+03   -0.40784E+00   -0.40730E+00  3201   0.321E+00    0.811E+01
DAV:   6    -0.843830373583E+03    0.10818E+03   -0.47270E+02  3057   0.347E+01    0.376E+01
DAV:   7    -0.843349374851E+03    0.48100E+00   -0.14330E+01  3507   0.613E+00    0.146E+01
DAV:   8    -0.843021988475E+03    0.32739E+00   -0.95320E-01  3156   0.236E+00    0.597E+00
DAV:   9    -0.842986074852E+03    0.35914E-01   -0.40598E-01  3165   0.152E+00    0.865E-01
DAV:  10    -0.842990973836E+03   -0.48990E-02   -0.69184E-02  3147   0.588E-01    0.589E-01
DAV:  11    -0.842989883477E+03    0.10904E-02   -0.67856E-03  3111   0.212E-01    0.329E-01
DAV:  12    -0.842989596527E+03    0.28695E-03   -0.69751E-03  3156   0.240E-01    0.117E-01
DAV:  13    -0.842991546875E+03   -0.19503E-02   -0.41096E-03  3138   0.211E-01    0.134E-01
DAV:  14    -0.842995152421E+03   -0.36055E-02   -0.29667E-03  3102   0.144E-01    0.900E-02
DAV:  15    -0.842999481928E+03   -0.43295E-02   -0.11464E-03  3066   0.899E-02    0.378E-02
DAV:  16    -0.843001784255E+03   -0.23023E-02   -0.43838E-04  3084   0.493E-02    0.363E-02
DAV:  17    -0.843002740658E+03   -0.95640E-03   -0.19118E-04  3120   0.336E-02    0.249E-02
DAV:  18    -0.843003395660E+03   -0.65500E-03   -0.28004E-05  2382   0.165E-02    0.142E-02
DAV:  19    -0.843004040817E+03   -0.64516E-03   -0.40241E-05  2535   0.200E-02    0.754E-03
DAV:  20    -0.843004156505E+03   -0.11569E-03   -0.29080E-05  2625   0.139E-02    0.520E-03
DAV:  21    -0.843004213537E+03   -0.57033E-04   -0.37512E-06  1995   0.495E-03    0.488E-03
DAV:  22    -0.843004244522E+03   -0.30985E-04   -0.22445E-06  2031   0.354E-03    0.233E-03
DAV:  23    -0.843004256255E+03   -0.11733E-04   -0.15870E-06  1977   0.289E-03    0.112E-03
DAV:  24    -0.843004258096E+03   -0.18416E-05   -0.44500E-07  2013   0.135E-03 
   1 F= -.84300426E+03 E0= -.84300881E+03  d E =0.136545E-01