./iterations/neb0_image04_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     0.423663527867E+04    0.42366E+04   -0.23866E+05  2892   0.117E+03 
DAV:   2    -0.427160944450E+03   -0.46638E+04   -0.45688E+04  3351   0.329E+02 
DAV:   3    -0.942427511687E+03   -0.51527E+03   -0.51300E+03  3120   0.118E+02 
DAV:   4    -0.954786739403E+03   -0.12359E+02   -0.12312E+02  3183   0.196E+01 
DAV:   5    -0.955193848782E+03   -0.40711E+00   -0.40653E+00  3201   0.321E+00    0.813E+01
DAV:   6    -0.846885365402E+03    0.10831E+03   -0.47096E+02  3057   0.347E+01    0.376E+01
DAV:   7    -0.846414168131E+03    0.47120E+00   -0.14448E+01  3534   0.611E+00    0.146E+01
DAV:   8    -0.846083503033E+03    0.33067E+00   -0.96903E-01  3165   0.238E+00    0.596E+00
DAV:   9    -0.846039706620E+03    0.43796E-01   -0.41414E-01  3192   0.153E+00    0.860E-01
DAV:  10    -0.846045380544E+03   -0.56739E-02   -0.74006E-02  3102   0.609E-01    0.604E-01
DAV:  11    -0.846044550425E+03    0.83012E-03   -0.66085E-03  3111   0.209E-01    0.350E-01
DAV:  12    -0.846044700665E+03   -0.15024E-03   -0.70767E-03  3048   0.249E-01    0.120E-01
DAV:  13    -0.846047308297E+03   -0.26076E-02   -0.44552E-03  3192   0.216E-01    0.136E-01
DAV:  14    -0.846051015518E+03   -0.37072E-02   -0.30426E-03  3066   0.147E-01    0.975E-02
DAV:  15    -0.846055497542E+03   -0.44820E-02   -0.11143E-03  3084   0.891E-02    0.355E-02
DAV:  16    -0.846058025692E+03   -0.25281E-02   -0.47494E-04  3093   0.527E-02    0.388E-02
DAV:  17    -0.846059147094E+03   -0.11214E-02   -0.24853E-04  3111   0.396E-02    0.257E-02
DAV:  18    -0.846059799221E+03   -0.65213E-03   -0.33491E-05  2526   0.194E-02    0.139E-02
DAV:  19    -0.846060414859E+03   -0.61564E-03   -0.40213E-05  2670   0.215E-02    0.717E-03
DAV:  20    -0.846060517225E+03   -0.10237E-03   -0.29396E-05  2670   0.134E-02    0.594E-03
DAV:  21    -0.846060565759E+03   -0.48534E-04   -0.30334E-06  1968   0.456E-03    0.524E-03
DAV:  22    -0.846060593104E+03   -0.27345E-04   -0.22670E-06  1986   0.365E-03    0.235E-03
DAV:  23    -0.846060601539E+03   -0.84348E-05   -0.15474E-06  1995   0.292E-03 
   1 F= -.84606060E+03 E0= -.84606447E+03  d E =0.115959E-01