./iterations/neb0_image03_iter4_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     0.422698575859E+04    0.42270E+04   -0.23857E+05  2892   0.117E+03 
DAV:   2    -0.426621864926E+03   -0.46536E+04   -0.45557E+04  3360   0.329E+02 
DAV:   3    -0.940792792897E+03   -0.51417E+03   -0.51184E+03  3120   0.118E+02 
DAV:   4    -0.953145196454E+03   -0.12352E+02   -0.12306E+02  3183   0.196E+01 
DAV:   5    -0.953554497820E+03   -0.40930E+00   -0.40878E+00  3210   0.322E+00    0.814E+01
DAV:   6    -0.845015905257E+03    0.10854E+03   -0.47332E+02  3057   0.347E+01    0.377E+01
DAV:   7    -0.844498862167E+03    0.51704E+00   -0.14381E+01  3534   0.610E+00    0.146E+01
DAV:   8    -0.844151354477E+03    0.34751E+00   -0.95667E-01  3147   0.241E+00    0.596E+00
DAV:   9    -0.844103285143E+03    0.48069E-01   -0.42759E-01  3165   0.157E+00    0.895E-01
DAV:  10    -0.844107575004E+03   -0.42899E-02   -0.73415E-02  3156   0.609E-01    0.587E-01
DAV:  11    -0.844105969806E+03    0.16052E-02   -0.78090E-03  3138   0.220E-01    0.324E-01
DAV:  12    -0.844105676488E+03    0.29332E-03   -0.68506E-03  3165   0.246E-01    0.120E-01
DAV:  13    -0.844108099950E+03   -0.24235E-02   -0.47326E-03  3120   0.229E-01    0.134E-01
DAV:  14    -0.844112230591E+03   -0.41306E-02   -0.34470E-03  3120   0.151E-01    0.887E-02
DAV:  15    -0.844115446266E+03   -0.32157E-02   -0.75504E-04  3084   0.705E-02    0.405E-02
DAV:  16    -0.844118773106E+03   -0.33268E-02   -0.60988E-04  3084   0.521E-02    0.366E-02
DAV:  17    -0.844119850368E+03   -0.10773E-02   -0.20737E-04  3111   0.355E-02    0.252E-02
DAV:  18    -0.844120581863E+03   -0.73149E-03   -0.40298E-05  2751   0.168E-02    0.179E-02
DAV:  19    -0.844121268279E+03   -0.68642E-03   -0.42333E-05  2634   0.222E-02    0.829E-03
DAV:  20    -0.844121436030E+03   -0.16775E-03   -0.45769E-05  2787   0.181E-02    0.791E-03
DAV:  21    -0.844121472824E+03   -0.36794E-04   -0.62052E-06  2004   0.597E-03    0.618E-03
DAV:  22    -0.844121494142E+03   -0.21318E-04   -0.22262E-06  2004   0.291E-03    0.363E-03
DAV:  23    -0.844121511272E+03   -0.17130E-04   -0.31723E-06  2004   0.350E-03    0.156E-03
DAV:  24    -0.844121513888E+03   -0.26159E-05   -0.65826E-07  2004   0.179E-03 
   1 F= -.84412151E+03 E0= -.84412540E+03  d E =0.116662E-01