iterations/neb0_image08_iter76_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     0.423699667594E+04    0.42370E+04   -0.23864E+05  2892   0.117E+03 
DAV:   2    -0.430019519640E+03   -0.46670E+04   -0.45685E+04  3378   0.329E+02 
DAV:   3    -0.943015561262E+03   -0.51300E+03   -0.51085E+03  3120   0.117E+02 
DAV:   4    -0.955187104325E+03   -0.12172E+02   -0.12127E+02  3183   0.195E+01 
DAV:   5    -0.955586361797E+03   -0.39926E+00   -0.39873E+00  3210   0.319E+00    0.813E+01
DAV:   6    -0.847566700673E+03    0.10802E+03   -0.47169E+02  3066   0.348E+01    0.376E+01
DAV:   7    -0.847001335297E+03    0.56537E+00   -0.14779E+01  3525   0.631E+00    0.148E+01
DAV:   8    -0.846663896380E+03    0.33744E+00   -0.15662E+00  3183   0.333E+00    0.602E+00
DAV:   9    -0.846576752680E+03    0.87144E-01   -0.69582E-01  3309   0.210E+00    0.145E+00
DAV:  10    -0.846534131788E+03    0.42621E-01   -0.15496E-01  3516   0.129E+00    0.131E+00
DAV:  11    -0.846523603134E+03    0.10529E-01   -0.13379E-01  3633   0.827E-01    0.926E-01
DAV:  12    -0.846515889956E+03    0.77132E-02   -0.67918E-02  3210   0.477E-01    0.747E-01
DAV:  13    -0.846516121097E+03   -0.23114E-03   -0.98660E-02  3975   0.580E-01    0.808E-01
DAV:  14    -0.846511990803E+03    0.41303E-02   -0.63936E-02  3552   0.485E-01    0.574E-01
DAV:  15    -0.846504915220E+03    0.70756E-02   -0.28827E-02  3408   0.439E-01    0.367E-01
DAV:  16    -0.846503523297E+03    0.13919E-02   -0.90408E-03  3075   0.203E-01    0.211E-01
DAV:  17    -0.846504706784E+03   -0.11835E-02   -0.26410E-03  3093   0.133E-01    0.131E-01
DAV:  18    -0.846506577796E+03   -0.18710E-02   -0.12947E-03  3174   0.105E-01    0.999E-02
DAV:  19    -0.846509935961E+03   -0.33582E-02   -0.13597E-03  3093   0.103E-01    0.614E-02
DAV:  20    -0.846513175363E+03   -0.32394E-02   -0.75831E-04  3102   0.732E-02    0.629E-02
DAV:  21    -0.846514942795E+03   -0.17674E-02   -0.31385E-04  3129   0.452E-02    0.372E-02
DAV:  22    -0.846515843368E+03   -0.90057E-03   -0.87188E-05  3102   0.222E-02    0.305E-02
DAV:  23    -0.846516586161E+03   -0.74279E-03   -0.85245E-05  2751   0.209E-02    0.138E-02
DAV:  24    -0.846516929780E+03   -0.34362E-03   -0.23738E-05  2256   0.132E-02    0.872E-03
DAV:  25    -0.846517126219E+03   -0.19644E-03   -0.78984E-06  1968   0.919E-03    0.529E-03
DAV:  26    -0.846517251960E+03   -0.12574E-03   -0.71532E-06  1968   0.883E-03    0.257E-03
DAV:  27    -0.846517283671E+03   -0.31710E-04   -0.51946E-06  1986   0.568E-03    0.279E-03
DAV:  28    -0.846517287822E+03   -0.41509E-05   -0.14453E-06  2022   0.234E-03 
   1 F= -.84651729E+03 E0= -.84656694E+03  d E =0.148969E+00