./iterations/neb0_image03_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     0.422532506638E+04    0.42253E+04   -0.23854E+05  2892   0.117E+03 
DAV:   2    -0.425665007644E+03   -0.46510E+04   -0.45530E+04  3351   0.329E+02 
DAV:   3    -0.940742948154E+03   -0.51508E+03   -0.51275E+03  3120   0.118E+02 
DAV:   4    -0.953174292643E+03   -0.12431E+02   -0.12384E+02  3174   0.197E+01 
DAV:   5    -0.953586481240E+03   -0.41219E+00   -0.41165E+00  3192   0.323E+00    0.813E+01
DAV:   6    -0.845294098320E+03    0.10829E+03   -0.47271E+02  3057   0.347E+01    0.376E+01
DAV:   7    -0.844794993158E+03    0.49911E+00   -0.14328E+01  3534   0.609E+00    0.146E+01
DAV:   8    -0.844455611039E+03    0.33938E+00   -0.95664E-01  3138   0.240E+00    0.594E+00
DAV:   9    -0.844411458217E+03    0.44153E-01   -0.42007E-01  3174   0.154E+00    0.878E-01
DAV:  10    -0.844416324983E+03   -0.48668E-02   -0.70494E-02  3129   0.598E-01    0.587E-01
DAV:  11    -0.844415061012E+03    0.12640E-02   -0.70938E-03  3147   0.214E-01    0.325E-01
DAV:  12    -0.844415083450E+03   -0.22438E-04   -0.72326E-03  3147   0.251E-01    0.118E-01
DAV:  13    -0.844417558383E+03   -0.24749E-02   -0.45324E-03  3192   0.218E-01    0.134E-01
DAV:  14    -0.844421499907E+03   -0.39415E-02   -0.30965E-03  3102   0.146E-01    0.904E-02
DAV:  15    -0.844426242521E+03   -0.47426E-02   -0.14365E-03  3102   0.102E-01    0.424E-02
DAV:  16    -0.844428319749E+03   -0.20772E-02   -0.38992E-04  3120   0.485E-02    0.367E-02
DAV:  17    -0.844429305490E+03   -0.98574E-03   -0.23714E-04  3102   0.351E-02    0.262E-02
DAV:  18    -0.844430037396E+03   -0.73191E-03   -0.33668E-05  2544   0.195E-02    0.141E-02
DAV:  19    -0.844430640716E+03   -0.60332E-03   -0.43090E-05  2715   0.216E-02    0.738E-03
DAV:  20    -0.844430724685E+03   -0.83969E-04   -0.31355E-05  2715   0.133E-02    0.678E-03
DAV:  21    -0.844430772084E+03   -0.47398E-04   -0.31339E-06  1977   0.388E-03    0.522E-03
DAV:  22    -0.844430806418E+03   -0.34335E-04   -0.37093E-06  2022   0.389E-03    0.188E-03
DAV:  23    -0.844430819023E+03   -0.12604E-04   -0.14777E-06  2013   0.319E-03    0.131E-03
DAV:  24    -0.844430821363E+03   -0.23405E-05   -0.74249E-07  1995   0.211E-03 
   1 F= -.84443082E+03 E0= -.84443469E+03  d E =0.116043E-01