iterations/neb0_image05_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     0.423825498193E+04    0.42383E+04   -0.23860E+05  2892   0.117E+03 
DAV:   2    -0.426352919626E+03   -0.46646E+04   -0.45696E+04  3360   0.329E+02 
DAV:   3    -0.941302044257E+03   -0.51495E+03   -0.51267E+03  3120   0.118E+02 
DAV:   4    -0.953648544911E+03   -0.12347E+02   -0.12300E+02  3183   0.196E+01 
DAV:   5    -0.954054008560E+03   -0.40546E+00   -0.40490E+00  3192   0.321E+00    0.811E+01
DAV:   6    -0.845911163414E+03    0.10814E+03   -0.47045E+02  3057   0.347E+01    0.375E+01
DAV:   7    -0.845466533283E+03    0.44463E+00   -0.14565E+01  3543   0.607E+00    0.146E+01
DAV:   8    -0.845122587611E+03    0.34395E+00   -0.96721E-01  3156   0.238E+00    0.596E+00
DAV:   9    -0.845056272739E+03    0.66315E-01   -0.42741E-01  3192   0.150E+00    0.861E-01
DAV:  10    -0.845052461397E+03    0.38113E-02   -0.67250E-02  3111   0.589E-01    0.574E-01
DAV:  11    -0.845046347429E+03    0.61140E-02   -0.70235E-03  3147   0.231E-01    0.317E-01
DAV:  12    -0.845040138350E+03    0.62091E-02   -0.69410E-03  3120   0.282E-01    0.130E-01
DAV:  13    -0.845038700173E+03    0.14382E-02   -0.60108E-03  3120   0.296E-01    0.185E-01
DAV:  14    -0.845038657366E+03    0.42808E-04   -0.38357E-03  3129   0.141E-01    0.214E-01
DAV:  15    -0.845038964184E+03   -0.30682E-03   -0.35142E-04  3111   0.389E-02    0.210E-01
DAV:  16    -0.845041090270E+03   -0.21261E-02   -0.11046E-03  4209   0.126E-01    0.206E-01
DAV:  17    -0.845043527207E+03   -0.24369E-02   -0.17700E-03  3840   0.139E-01    0.207E-01
DAV:  18    -0.845047342027E+03   -0.38148E-02   -0.17034E-03  4200   0.212E-01    0.197E-01
DAV:  19    -0.845055720005E+03   -0.83780E-02   -0.88046E-03  4749   0.499E-01    0.324E-01
DAV:  20    -0.845050746172E+03    0.49738E-02   -0.79295E-03  3732   0.413E-01    0.190E-01
DAV:  21    -0.845049721532E+03    0.10246E-02   -0.49962E-03  4272   0.235E-01    0.117E-01
DAV:  22    -0.845050521971E+03   -0.80044E-03   -0.17460E-03  3255   0.128E-01    0.126E-01
DAV:  23    -0.845045558188E+03    0.49638E-02   -0.38411E-03  4848   0.353E-01    0.310E-01
DAV:  24    -0.845045080097E+03    0.47809E-03   -0.26586E-03  3102   0.770E-02    0.274E-01
DAV:  25    -0.845045324230E+03   -0.24413E-03   -0.55525E-05  3111   0.197E-02    0.281E-01
DAV:  26    -0.845045318383E+03    0.58468E-05   -0.81171E-06  2049   0.643E-03 
   1 F= -.84504532E+03 E0= -.84505485E+03  d E =0.286070E-01