./iterations/neb0_image08_iter29_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     0.423579635622E+04    0.42358E+04   -0.23862E+05  2892   0.117E+03 
DAV:   2    -0.428219242297E+03   -0.46640E+04   -0.45650E+04  3366   0.329E+02 
DAV:   3    -0.942831622020E+03   -0.51461E+03   -0.51240E+03  3120   0.118E+02 
DAV:   4    -0.955095650867E+03   -0.12264E+02   -0.12218E+02  3183   0.196E+01 
DAV:   5    -0.955498645640E+03   -0.40299E+00   -0.40246E+00  3192   0.321E+00    0.812E+01
DAV:   6    -0.847404002407E+03    0.10809E+03   -0.47101E+02  3066   0.347E+01    0.376E+01
DAV:   7    -0.846885922486E+03    0.51808E+00   -0.14674E+01  3516   0.627E+00    0.147E+01
DAV:   8    -0.846525045954E+03    0.36088E+00   -0.96729E-01  3192   0.265E+00    0.607E+00
DAV:   9    -0.846476621787E+03    0.48424E-01   -0.58475E-01  3894   0.307E+00    0.166E+00
DAV:  10    -0.846447432818E+03    0.29189E-01   -0.30788E-01  3354   0.127E+00    0.143E+00
DAV:  11    -0.846427645002E+03    0.19788E-01   -0.10135E-01  3147   0.632E-01    0.124E+00
DAV:  12    -0.846413350632E+03    0.14294E-01   -0.80801E-02  3732   0.646E-01    0.116E+00
DAV:  13    -0.846391956884E+03    0.21394E-01   -0.38945E-02  3489   0.589E-01    0.815E-01
DAV:  14    -0.846382572355E+03    0.93845E-02   -0.28110E-02  3624   0.457E-01    0.426E-01
DAV:  15    -0.846379562284E+03    0.30101E-02   -0.15713E-02  3183   0.321E-01    0.439E-01
DAV:  16    -0.846379770805E+03   -0.20852E-03   -0.21955E-02  3894   0.357E-01    0.598E-01
DAV:  17    -0.846376620133E+03    0.31507E-02   -0.16298E-02  3804   0.320E-01    0.214E-01
DAV:  18    -0.846377395690E+03   -0.77556E-03   -0.58992E-03  3012   0.180E-01    0.217E-01
DAV:  19    -0.846378045098E+03   -0.64941E-03   -0.38474E-03  3228   0.155E-01    0.135E-01
DAV:  20    -0.846381703023E+03   -0.36579E-02   -0.58566E-03  3543   0.194E-01    0.302E-01
DAV:  21    -0.846383537097E+03   -0.18341E-02   -0.37297E-03  3309   0.131E-01    0.183E-01
DAV:  22    -0.846385536243E+03   -0.19991E-02   -0.84780E-04  3102   0.743E-02    0.810E-02
DAV:  23    -0.846387047297E+03   -0.15111E-02   -0.55372E-04  3399   0.633E-02    0.528E-02
DAV:  24    -0.846388064057E+03   -0.10168E-02   -0.26254E-04  3102   0.435E-02    0.294E-02
DAV:  25    -0.846388779575E+03   -0.71552E-03   -0.79758E-05  2724   0.232E-02    0.140E-02
DAV:  26    -0.846389088487E+03   -0.30891E-03   -0.22740E-05  2202   0.136E-02    0.966E-03
DAV:  27    -0.846389319651E+03   -0.23116E-03   -0.29467E-05  2292   0.162E-02    0.740E-03
DAV:  28    -0.846389363822E+03   -0.44170E-04   -0.94826E-06  1995   0.721E-03    0.688E-03
DAV:  29    -0.846389372398E+03   -0.85767E-05   -0.22831E-06  2031   0.325E-03 
   1 F= -.84638937E+03 E0= -.84643591E+03  d E =0.139615E+00