iterations/neb0_image09_iter51_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     0.423681499396E+04    0.42368E+04   -0.23864E+05  2892   0.117E+03 
DAV:   2    -0.427779250950E+03   -0.46646E+04   -0.45646E+04  3366   0.329E+02 
DAV:   3    -0.942961098253E+03   -0.51518E+03   -0.51301E+03  3120   0.118E+02 
DAV:   4    -0.955257885704E+03   -0.12297E+02   -0.12252E+02  3183   0.196E+01 
DAV:   5    -0.955662027557E+03   -0.40414E+00   -0.40361E+00  3192   0.321E+00    0.813E+01
DAV:   6    -0.847654180199E+03    0.10801E+03   -0.47154E+02  3066   0.348E+01    0.376E+01
DAV:   7    -0.847072172968E+03    0.58201E+00   -0.14691E+01  3507   0.629E+00    0.148E+01
DAV:   8    -0.846729826675E+03    0.34235E+00   -0.17836E+00  3210   0.359E+00    0.604E+00
DAV:   9    -0.846633093992E+03    0.96733E-01   -0.66541E-01  3201   0.196E+00    0.137E+00
DAV:  10    -0.846620783867E+03    0.12310E-01   -0.16363E-01  3354   0.120E+00    0.142E+00
DAV:  11    -0.846591475593E+03    0.29308E-01   -0.68317E-02  3633   0.833E-01    0.969E-01
DAV:  12    -0.846587099266E+03    0.43763E-02   -0.74075E-02  3624   0.546E-01    0.653E-01
DAV:  13    -0.846586329785E+03    0.76948E-03   -0.10449E-01  3606   0.769E-01    0.994E-01
DAV:  14    -0.846573657934E+03    0.12672E-01   -0.77655E-02  3633   0.497E-01    0.308E-01
DAV:  15    -0.846574321139E+03   -0.66321E-03   -0.24792E-02  3048   0.447E-01    0.470E-01
DAV:  16    -0.846571325654E+03    0.29955E-02   -0.76798E-03  3273   0.197E-01    0.239E-01
DAV:  17    -0.846571945525E+03   -0.61987E-03   -0.28689E-03  3021   0.135E-01    0.138E-01
DAV:  18    -0.846574119227E+03   -0.21737E-02   -0.18700E-03  3075   0.137E-01    0.883E-02
DAV:  19    -0.846578099474E+03   -0.39802E-02   -0.18200E-03  3066   0.112E-01    0.697E-02
DAV:  20    -0.846580561589E+03   -0.24621E-02   -0.59145E-04  3147   0.638E-02    0.575E-02
DAV:  21    -0.846582015439E+03   -0.14539E-02   -0.22640E-04  3084   0.313E-02    0.410E-02
DAV:  22    -0.846583637987E+03   -0.16225E-02   -0.12642E-04  2859   0.273E-02    0.168E-02
DAV:  23    -0.846584395675E+03   -0.75769E-03   -0.64409E-05  2796   0.245E-02    0.136E-02
DAV:  24    -0.846584622685E+03   -0.22701E-03   -0.30834E-05  2040   0.165E-02    0.158E-02
DAV:  25    -0.846584808717E+03   -0.18603E-03   -0.13265E-05  1968   0.783E-03    0.115E-02
DAV:  26    -0.846584956250E+03   -0.14753E-03   -0.11446E-05  1968   0.920E-03    0.530E-03
DAV:  27    -0.846585025844E+03   -0.69593E-04   -0.69853E-06  1968   0.892E-03    0.292E-03
DAV:  28    -0.846585050334E+03   -0.24490E-04   -0.50080E-06  2004   0.559E-03    0.208E-03
DAV:  29    -0.846585056345E+03   -0.60111E-05   -0.12982E-06  2004   0.234E-03 
   1 F= -.84658506E+03 E0= -.84663500E+03  d E =0.149844E+00