iterations/neb0_image05_iter81_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     0.422730541821E+04    0.42273E+04   -0.23876E+05  2901   0.117E+03 
DAV:   2    -0.428579286564E+03   -0.46559E+04   -0.45593E+04  3366   0.329E+02 
DAV:   3    -0.942488491833E+03   -0.51391E+03   -0.51168E+03  3111   0.117E+02 
DAV:   4    -0.954810060371E+03   -0.12322E+02   -0.12274E+02  3192   0.196E+01 
DAV:   5    -0.955215851135E+03   -0.40579E+00   -0.40526E+00  3201   0.321E+00    0.811E+01
DAV:   6    -0.847202101433E+03    0.10801E+03   -0.46968E+02  3057   0.347E+01    0.375E+01
DAV:   7    -0.846717084184E+03    0.48502E+00   -0.14689E+01  3552   0.621E+00    0.146E+01
DAV:   8    -0.846355914273E+03    0.36117E+00   -0.17629E+00  3399   0.345E+00    0.621E+00
DAV:   9    -0.846266420974E+03    0.89493E-01   -0.71446E-01  3183   0.199E+00    0.116E+00
DAV:  10    -0.846251897785E+03    0.14523E-01   -0.14816E-01  3129   0.871E-01    0.810E-01
DAV:  11    -0.846239308121E+03    0.12590E-01   -0.30848E-02  3147   0.552E-01    0.459E-01
DAV:  12    -0.846232701228E+03    0.66069E-02   -0.94076E-03  3147   0.370E-01    0.346E-01
DAV:  13    -0.846231125769E+03    0.15755E-02   -0.64993E-03  3516   0.232E-01    0.238E-01
DAV:  14    -0.846228286802E+03    0.28390E-02   -0.29890E-03  3075   0.233E-01    0.116E-01
DAV:  15    -0.846229232795E+03   -0.94599E-03   -0.27146E-03  3084   0.159E-01    0.909E-02
DAV:  16    -0.846233214441E+03   -0.39816E-02   -0.15437E-03  3291   0.186E-01    0.529E-02
DAV:  17    -0.846236844809E+03   -0.36304E-02   -0.17577E-03  3075   0.120E-01    0.470E-02
DAV:  18    -0.846238012515E+03   -0.11677E-02   -0.27799E-04  3138   0.403E-02    0.408E-02
DAV:  19    -0.846239022446E+03   -0.10099E-02   -0.95940E-05  3075   0.237E-02    0.230E-02
DAV:  20    -0.846240250176E+03   -0.12277E-02   -0.45063E-05  2661   0.322E-02    0.153E-02
DAV:  21    -0.846240834343E+03   -0.58417E-03   -0.57787E-05  2850   0.374E-02    0.124E-02
DAV:  22    -0.846240993506E+03   -0.15916E-03   -0.48799E-05  2850   0.247E-02    0.106E-02
DAV:  23    -0.846241014812E+03   -0.21306E-04   -0.10501E-05  2040   0.784E-03    0.893E-03
DAV:  24    -0.846241076785E+03   -0.61973E-04   -0.51252E-07  1932   0.142E-02    0.694E-03
DAV:  25    -0.846241124133E+03   -0.47348E-04   -0.28450E-06  1986   0.270E-02    0.926E-03
DAV:  26    -0.846241143798E+03   -0.19666E-04   -0.17820E-06  2130   0.497E-02    0.138E-02
DAV:  27    -0.846241176179E+03   -0.32380E-04   -0.53911E-05  2949   0.346E-02    0.189E-02
DAV:  28    -0.846241178008E+03   -0.18298E-05   -0.28621E-05  2319   0.133E-02 
   1 F= -.84624118E+03 E0= -.84625547E+03  d E =0.428879E-01