./iterations/neb0_image06_iter41_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     0.424028818956E+04    0.42403E+04   -0.23863E+05  2892   0.117E+03 
DAV:   2    -0.428267021237E+03   -0.46686E+04   -0.45722E+04  3366   0.329E+02 
DAV:   3    -0.942379179962E+03   -0.51411E+03   -0.51187E+03  3120   0.117E+02 
DAV:   4    -0.954641999307E+03   -0.12263E+02   -0.12217E+02  3183   0.196E+01 
DAV:   5    -0.955044042300E+03   -0.40204E+00   -0.40149E+00  3183   0.321E+00    0.811E+01
DAV:   6    -0.846954833263E+03    0.10809E+03   -0.47023E+02  3057   0.347E+01    0.375E+01
DAV:   7    -0.846488400330E+03    0.46643E+00   -0.14641E+01  3534   0.607E+00    0.146E+01
DAV:   8    -0.846131678549E+03    0.35672E+00   -0.96805E-01  3156   0.235E+00    0.596E+00
DAV:   9    -0.846058919685E+03    0.72759E-01   -0.42753E-01  3183   0.149E+00    0.868E-01
DAV:  10    -0.846053907972E+03    0.50117E-02   -0.70696E-02  3120   0.593E-01    0.576E-01
DAV:  11    -0.846047578004E+03    0.63300E-02   -0.66914E-03  3138   0.228E-01    0.320E-01
DAV:  12    -0.846041522654E+03    0.60553E-02   -0.78591E-03  3093   0.283E-01    0.126E-01
DAV:  13    -0.846041160521E+03    0.36213E-03   -0.53246E-03  3084   0.249E-01    0.150E-01
DAV:  14    -0.846044286326E+03   -0.31258E-02   -0.36069E-03  3057   0.164E-01    0.104E-01
DAV:  15    -0.846049625738E+03   -0.53394E-02   -0.16257E-03  3120   0.127E-01    0.454E-02
DAV:  16    -0.846051922130E+03   -0.22964E-02   -0.61831E-04  3102   0.645E-02    0.398E-02
DAV:  17    -0.846052907152E+03   -0.98502E-03   -0.20463E-04  3129   0.302E-02    0.258E-02
DAV:  18    -0.846053860647E+03   -0.95349E-03   -0.36031E-05  2571   0.165E-02    0.112E-02
DAV:  19    -0.846054647140E+03   -0.78649E-03   -0.43250E-05  2733   0.201E-02    0.914E-03
DAV:  20    -0.846054745242E+03   -0.98101E-04   -0.29740E-05  2724   0.124E-02    0.675E-03
DAV:  21    -0.846054794416E+03   -0.49175E-04   -0.29229E-06  1959   0.476E-03    0.459E-03
DAV:  22    -0.846054874534E+03   -0.80117E-04   -0.65786E-06  1950   0.729E-03    0.283E-03
DAV:  23    -0.846054886381E+03   -0.11848E-04   -0.37616E-06  1995   0.482E-03    0.283E-03
DAV:  24    -0.846054888281E+03   -0.18996E-05   -0.14009E-06  2022   0.331E-03 
   1 F= -.84605489E+03 E0= -.84605928E+03  d E =0.131830E-01