iterations/neb0_image06_iter83_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     0.423830004873E+04    0.42383E+04   -0.23862E+05  2892   0.117E+03 
DAV:   2    -0.426846862211E+03   -0.46651E+04   -0.45672E+04  3366   0.329E+02 
DAV:   3    -0.942291318822E+03   -0.51544E+03   -0.51321E+03  3120   0.118E+02 
DAV:   4    -0.954621054400E+03   -0.12330E+02   -0.12283E+02  3192   0.196E+01 
DAV:   5    -0.955026901922E+03   -0.40585E+00   -0.40532E+00  3183   0.322E+00    0.811E+01
DAV:   6    -0.847302331891E+03    0.10772E+03   -0.47004E+02  3102   0.347E+01    0.375E+01
DAV:   7    -0.846684867789E+03    0.61746E+00   -0.14889E+01  3516   0.661E+00    0.148E+01
DAV:   8    -0.846382233110E+03    0.30263E+00   -0.90222E-01  3201   0.297E+00    0.595E+00
DAV:   9    -0.846290176149E+03    0.92057E-01   -0.78568E-01  3570   0.235E+00    0.158E+00
DAV:  10    -0.846281377517E+03    0.87986E-02   -0.15934E-01  3246   0.989E-01    0.140E+00
DAV:  11    -0.846255468126E+03    0.25909E-01   -0.67322E-02  3309   0.638E-01    0.899E-01
DAV:  12    -0.846256517044E+03   -0.10489E-02   -0.47905E-02  3300   0.417E-01    0.882E-01
DAV:  13    -0.846252061704E+03    0.44553E-02   -0.10728E-01  3804   0.371E-01    0.949E-01
DAV:  14    -0.846247544034E+03    0.45177E-02   -0.10347E-02  3633   0.364E-01    0.632E-01
DAV:  15    -0.846246468353E+03    0.10757E-02   -0.41719E-02  3471   0.273E-01    0.559E-01
DAV:  16    -0.846245129601E+03    0.13388E-02   -0.61495E-03  3048   0.260E-01    0.132E-01
DAV:  17    -0.846248054811E+03   -0.29252E-02   -0.41242E-03  3084   0.177E-01    0.192E-01
DAV:  18    -0.846250514419E+03   -0.24596E-02   -0.26749E-03  3462   0.124E-01    0.241E-01
DAV:  19    -0.846252514025E+03   -0.19996E-02   -0.84219E-04  3228   0.998E-02    0.652E-02
DAV:  20    -0.846254841867E+03   -0.23278E-02   -0.55468E-04  3102   0.524E-02    0.600E-02
DAV:  21    -0.846256352868E+03   -0.15110E-02   -0.19467E-04  3093   0.352E-02    0.320E-02
DAV:  22    -0.846257183515E+03   -0.83065E-03   -0.60993E-05  2931   0.289E-02    0.160E-02
DAV:  23    -0.846257732025E+03   -0.54851E-03   -0.47315E-05  2661   0.199E-02    0.210E-02
DAV:  24    -0.846257936784E+03   -0.20476E-03   -0.17391E-05  2022   0.113E-02    0.119E-02
DAV:  25    -0.846258071313E+03   -0.13453E-03   -0.72059E-06  1995   0.988E-03    0.939E-03
DAV:  26    -0.846258137284E+03   -0.65971E-04   -0.64344E-06  1977   0.740E-03    0.430E-03
DAV:  27    -0.846258151787E+03   -0.14503E-04   -0.31223E-06  1986   0.552E-03    0.196E-03
DAV:  28    -0.846258155324E+03   -0.35372E-05   -0.15876E-06  2031   0.262E-03 
   1 F= -.84625816E+03 E0= -.84629850E+03  d E =0.121019E+00