iterations/neb0_image09_iter44_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     0.423671618835E+04    0.42367E+04   -0.23863E+05  2892   0.117E+03 
DAV:   2    -0.427751261855E+03   -0.46645E+04   -0.45645E+04  3366   0.329E+02 
DAV:   3    -0.942925899966E+03   -0.51517E+03   -0.51301E+03  3120   0.118E+02 
DAV:   4    -0.955225397543E+03   -0.12299E+02   -0.12254E+02  3183   0.196E+01 
DAV:   5    -0.955629716030E+03   -0.40432E+00   -0.40379E+00  3192   0.321E+00    0.813E+01
DAV:   6    -0.847626704079E+03    0.10800E+03   -0.47141E+02  3048   0.348E+01    0.376E+01
DAV:   7    -0.847070823474E+03    0.55588E+00   -0.14648E+01  3516   0.623E+00    0.148E+01
DAV:   8    -0.846729069369E+03    0.34175E+00   -0.17679E+00  3255   0.358E+00    0.609E+00
DAV:   9    -0.846650716674E+03    0.78353E-01   -0.71102E-01  3246   0.208E+00    0.158E+00
DAV:  10    -0.846630253151E+03    0.20464E-01   -0.15752E-01  3552   0.122E+00    0.119E+00
DAV:  11    -0.846599859477E+03    0.30394E-01   -0.66310E-02  3435   0.780E-01    0.834E-01
DAV:  12    -0.846594908085E+03    0.49514E-02   -0.16883E-01  4110   0.100E+00    0.126E+00
DAV:  13    -0.846577831094E+03    0.17077E-01   -0.75822E-02  3534   0.576E-01    0.435E-01
DAV:  14    -0.846574076815E+03    0.37543E-02   -0.16375E-02  3075   0.334E-01    0.306E-01
DAV:  15    -0.846571764895E+03    0.23119E-02   -0.13472E-02  3336   0.415E-01    0.285E-01
DAV:  16    -0.846572382128E+03   -0.61723E-03   -0.73774E-03  3057   0.204E-01    0.357E-01
DAV:  17    -0.846571971235E+03    0.41089E-03   -0.48147E-03  3336   0.158E-01    0.198E-01
DAV:  18    -0.846573462375E+03   -0.14911E-02   -0.27803E-03  3066   0.116E-01    0.131E-01
DAV:  19    -0.846576121859E+03   -0.26595E-02   -0.15885E-03  3066   0.101E-01    0.754E-02
DAV:  20    -0.846579473951E+03   -0.33521E-02   -0.10962E-03  3120   0.108E-01    0.606E-02
DAV:  21    -0.846581574474E+03   -0.21005E-02   -0.97834E-04  3111   0.651E-02    0.508E-02
DAV:  22    -0.846582543639E+03   -0.96916E-03   -0.21837E-04  3102   0.304E-02    0.285E-02
DAV:  23    -0.846583515120E+03   -0.97148E-03   -0.10201E-04  2994   0.272E-02    0.163E-02
DAV:  24    -0.846584056548E+03   -0.54143E-03   -0.43414E-05  2544   0.185E-02    0.138E-02
DAV:  25    -0.846584319907E+03   -0.26336E-03   -0.25507E-05  1968   0.161E-02    0.115E-02
DAV:  26    -0.846584490833E+03   -0.17093E-03   -0.13666E-05  1986   0.926E-03    0.469E-03
DAV:  27    -0.846584574751E+03   -0.83918E-04   -0.61344E-06  1968   0.693E-03    0.398E-03
DAV:  28    -0.846584607149E+03   -0.32398E-04   -0.56890E-06  1986   0.777E-03    0.290E-03
DAV:  29    -0.846584616042E+03   -0.88930E-05   -0.28353E-06  2004   0.359E-03 
   1 F= -.84658462E+03 E0= -.84663431E+03  d E =0.149070E+00