iterations/neb0_image08_iter31_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     0.423628109252E+04    0.42363E+04   -0.23862E+05  2892   0.117E+03 
DAV:   2    -0.428226790227E+03   -0.46645E+04   -0.45655E+04  3366   0.329E+02 
DAV:   3    -0.942866566338E+03   -0.51464E+03   -0.51243E+03  3120   0.118E+02 
DAV:   4    -0.955129787741E+03   -0.12263E+02   -0.12218E+02  3183   0.196E+01 
DAV:   5    -0.955532413650E+03   -0.40263E+00   -0.40208E+00  3183   0.321E+00    0.812E+01
DAV:   6    -0.847467253868E+03    0.10807E+03   -0.47108E+02  3084   0.347E+01    0.376E+01
DAV:   7    -0.846886382658E+03    0.58087E+00   -0.14734E+01  3507   0.638E+00    0.147E+01
DAV:   8    -0.846547821105E+03    0.33856E+00   -0.12865E+00  3201   0.291E+00    0.604E+00
DAV:   9    -0.846460137176E+03    0.87684E-01   -0.62495E-01  3300   0.235E+00    0.131E+00
DAV:  10    -0.846434227795E+03    0.25909E-01   -0.16299E-01  3138   0.870E-01    0.128E+00
DAV:  11    -0.846422514091E+03    0.11714E-01   -0.61046E-02  3165   0.378E-01    0.105E+00
DAV:  12    -0.846425694504E+03   -0.31804E-02   -0.16920E-01  4155   0.694E-01    0.106E+00
DAV:  13    -0.846409614566E+03    0.16080E-01   -0.49703E-02  3444   0.554E-01    0.664E-01
DAV:  14    -0.846405475886E+03    0.41387E-02   -0.27987E-02  3417   0.348E-01    0.392E-01
DAV:  15    -0.846403423506E+03    0.20524E-02   -0.10089E-02  3354   0.270E-01    0.262E-01
DAV:  16    -0.846402167688E+03    0.12558E-02   -0.43318E-03  3075   0.197E-01    0.213E-01
DAV:  17    -0.846402908505E+03   -0.74082E-03   -0.34549E-03  3057   0.175E-01    0.151E-01
DAV:  18    -0.846404607738E+03   -0.16992E-02   -0.20852E-03  3075   0.121E-01    0.120E-01
DAV:  19    -0.846408248820E+03   -0.36411E-02   -0.12638E-03  3057   0.113E-01    0.684E-02
DAV:  20    -0.846411542503E+03   -0.32937E-02   -0.95890E-04  3093   0.688E-02    0.636E-02
DAV:  21    -0.846413164174E+03   -0.16217E-02   -0.22092E-04  3156   0.349E-02    0.416E-02
DAV:  22    -0.846414497412E+03   -0.13332E-02   -0.10320E-04  3066   0.278E-02    0.174E-02
DAV:  23    -0.846415369987E+03   -0.87257E-03   -0.56859E-05  2706   0.191E-02    0.142E-02
DAV:  24    -0.846415696406E+03   -0.32642E-03   -0.23518E-05  2031   0.142E-02    0.198E-02
DAV:  25    -0.846415924519E+03   -0.22811E-03   -0.36444E-05  2040   0.124E-02    0.203E-02
DAV:  26    -0.846416003824E+03   -0.79304E-04   -0.10482E-05  1995   0.870E-03    0.121E-02
DAV:  27    -0.846416047436E+03   -0.43612E-04   -0.13353E-05  2022   0.934E-03    0.585E-03
DAV:  28    -0.846416086730E+03   -0.39294E-04   -0.49311E-06  1959   0.586E-03    0.708E-03
DAV:  29    -0.846416094812E+03   -0.80827E-05   -0.20467E-06  1995   0.298E-03 
   1 F= -.84641609E+03 E0= -.84646303E+03  d E =0.140809E+00