./iterations/neb0_image07_iter24_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     0.423394435500E+04    0.42339E+04   -0.23857E+05  2892   0.117E+03 
DAV:   2    -0.425221628000E+03   -0.46592E+04   -0.45614E+04  3348   0.329E+02 
DAV:   3    -0.942196883968E+03   -0.51698E+03   -0.51470E+03  3120   0.118E+02 
DAV:   4    -0.954626692838E+03   -0.12430E+02   -0.12383E+02  3201   0.196E+01 
DAV:   5    -0.955025090730E+03   -0.39840E+00   -0.39785E+00  3192   0.319E+00    0.810E+01
DAV:   6    -0.847020882141E+03    0.10800E+03   -0.47055E+02  3057   0.347E+01    0.375E+01
DAV:   7    -0.846600379980E+03    0.42050E+00   -0.14429E+01  3552   0.637E+00    0.147E+01
DAV:   8    -0.846189769489E+03    0.41061E+00   -0.12841E+00  3444   0.323E+00    0.620E+00
DAV:   9    -0.846121597957E+03    0.68172E-01   -0.65813E-01  3174   0.187E+00    0.126E+00
DAV:  10    -0.846107630631E+03    0.13967E-01   -0.13894E-01  3165   0.811E-01    0.719E-01
DAV:  11    -0.846096899782E+03    0.10731E-01   -0.21579E-02  3138   0.417E-01    0.450E-01
DAV:  12    -0.846093038724E+03    0.38611E-02   -0.19254E-02  4398   0.522E-01    0.791E-01
DAV:  13    -0.846085721502E+03    0.73172E-02   -0.82751E-03  3498   0.237E-01    0.213E-01
DAV:  14    -0.846084926187E+03    0.79532E-03   -0.44806E-03  3057   0.204E-01    0.304E-01
DAV:  15    -0.846082513206E+03    0.24130E-02   -0.33628E-03  3804   0.275E-01    0.264E-01
DAV:  16    -0.846084012555E+03   -0.14993E-02   -0.13252E-03  3174   0.172E-01    0.155E-01
DAV:  17    -0.846086206286E+03   -0.21937E-02   -0.15903E-03  2976   0.101E-01    0.283E-01
DAV:  18    -0.846090847593E+03   -0.46413E-02   -0.27624E-03  3183   0.161E-01    0.161E-01
DAV:  19    -0.846092884214E+03   -0.20366E-02   -0.89628E-04  3138   0.920E-02    0.123E-01
DAV:  20    -0.846094387377E+03   -0.15032E-02   -0.91404E-05  3165   0.868E-02    0.868E-02
DAV:  21    -0.846097298643E+03   -0.29113E-02   -0.12894E-04  3921   0.175E-01    0.459E-02
DAV:  22    -0.846098245684E+03   -0.94704E-03   -0.50841E-04  3525   0.141E-01    0.469E-02
DAV:  23    -0.846098609600E+03   -0.36392E-03   -0.45049E-04  3156   0.919E-02    0.618E-02
DAV:  24    -0.846098738415E+03   -0.12882E-03   -0.16345E-04  3147   0.492E-02    0.614E-02
DAV:  25    -0.846098863009E+03   -0.12459E-03   -0.75324E-06  2085   0.484E-02    0.599E-02
DAV:  26    -0.846099381393E+03   -0.51838E-03   -0.16477E-04  3984   0.193E-01    0.633E-02
DAV:  27    -0.846099537689E+03   -0.15630E-03   -0.38989E-04  3129   0.527E-02    0.756E-02
DAV:  28    -0.846099451369E+03    0.86320E-04   -0.83901E-05  3102   0.368E-02    0.813E-02
DAV:  29    -0.846099450932E+03    0.43642E-06   -0.77493E-06  1968   0.482E-03 
   1 F= -.84609945E+03 E0= -.84610815E+03  d E =0.261000E-01