iterations/neb0_image07_iter84_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     0.423736955168E+04    0.42374E+04   -0.23863E+05  2892   0.117E+03 
DAV:   2    -0.428897732638E+03   -0.46663E+04   -0.45683E+04  3375   0.329E+02 
DAV:   3    -0.942762376318E+03   -0.51386E+03   -0.51165E+03  3120   0.117E+02 
DAV:   4    -0.955007420914E+03   -0.12245E+02   -0.12200E+02  3192   0.195E+01 
DAV:   5    -0.955402551622E+03   -0.39513E+00   -0.39460E+00  3183   0.318E+00    0.812E+01
DAV:   6    -0.847361845982E+03    0.10804E+03   -0.47049E+02  3066   0.347E+01    0.376E+01
DAV:   7    -0.846952709800E+03    0.40914E+00   -0.14460E+01  3543   0.633E+00    0.147E+01
DAV:   8    -0.846546195828E+03    0.40651E+00   -0.13795E+00  3489   0.317E+00    0.618E+00
DAV:   9    -0.846477176232E+03    0.69020E-01   -0.57056E-01  3174   0.172E+00    0.121E+00
DAV:  10    -0.846447691224E+03    0.29485E-01   -0.16323E-01  3174   0.915E-01    0.128E+00
DAV:  11    -0.846430497094E+03    0.17194E-01   -0.22848E-02  3552   0.622E-01    0.940E-01
DAV:  12    -0.846434776462E+03   -0.42794E-02   -0.65080E-02  3516   0.519E-01    0.121E+00
DAV:  13    -0.846427687183E+03    0.70893E-02   -0.16504E-01  3912   0.568E-01    0.113E+00
DAV:  14    -0.846415845469E+03    0.11842E-01   -0.13379E-02  3408   0.490E-01    0.723E-01
DAV:  15    -0.846415402527E+03    0.44294E-03   -0.16706E-02  3273   0.350E-01    0.737E-01
DAV:  16    -0.846411934366E+03    0.34682E-02   -0.73935E-03  3075   0.208E-01    0.578E-01
DAV:  17    -0.846411119251E+03    0.81511E-03   -0.39361E-03  3084   0.156E-01    0.343E-01
DAV:  18    -0.846412737086E+03   -0.16178E-02   -0.35725E-03  3246   0.141E-01    0.115E-01
DAV:  19    -0.846415506690E+03   -0.27696E-02   -0.12761E-03  3282   0.109E-01    0.161E-01
DAV:  20    -0.846417927506E+03   -0.24208E-02   -0.78278E-04  3120   0.781E-02    0.787E-02
DAV:  21    -0.846420041379E+03   -0.21139E-02   -0.41416E-04  3237   0.620E-02    0.701E-02
DAV:  22    -0.846421436964E+03   -0.13956E-02   -0.28118E-04  3129   0.448E-02    0.420E-02
DAV:  23    -0.846422499633E+03   -0.10627E-02   -0.11204E-04  3102   0.271E-02    0.246E-02
DAV:  24    -0.846422981740E+03   -0.48211E-03   -0.48878E-05  2607   0.162E-02    0.178E-02
DAV:  25    -0.846423248396E+03   -0.26666E-03   -0.20214E-05  2049   0.166E-02    0.676E-03
DAV:  26    -0.846423372469E+03   -0.12407E-03   -0.16010E-05  2085   0.112E-02    0.621E-03
DAV:  27    -0.846423415736E+03   -0.43267E-04   -0.61486E-06  1977   0.661E-03    0.419E-03
DAV:  28    -0.846423447688E+03   -0.31952E-04   -0.28380E-06  1986   0.505E-03    0.535E-03
DAV:  29    -0.846423455093E+03   -0.74047E-05   -0.17637E-06  2004   0.316E-03 
   1 F= -.84642346E+03 E0= -.84647059E+03  d E =0.141419E+00