iterations/neb0_image05_iter36_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     0.424071127935E+04    0.42407E+04   -0.23863E+05  2892   0.117E+03 
DAV:   2    -0.426561569880E+03   -0.46673E+04   -0.45721E+04  3360   0.329E+02 
DAV:   3    -0.941669318211E+03   -0.51511E+03   -0.51284E+03  3120   0.118E+02 
DAV:   4    -0.954000642522E+03   -0.12331E+02   -0.12285E+02  3183   0.196E+01 
DAV:   5    -0.954405712683E+03   -0.40507E+00   -0.40452E+00  3192   0.321E+00    0.812E+01
DAV:   6    -0.846222590150E+03    0.10818E+03   -0.47038E+02  3048   0.347E+01    0.375E+01
DAV:   7    -0.845759899197E+03    0.46269E+00   -0.14562E+01  3552   0.608E+00    0.146E+01
DAV:   8    -0.845409391353E+03    0.35051E+00   -0.97422E-01  3156   0.238E+00    0.594E+00
DAV:   9    -0.845340635304E+03    0.68756E-01   -0.42865E-01  3183   0.150E+00    0.862E-01
DAV:  10    -0.845336905622E+03    0.37297E-02   -0.67306E-02  3138   0.588E-01    0.577E-01
DAV:  11    -0.845330970311E+03    0.59353E-02   -0.70247E-03  3147   0.231E-01    0.317E-01
DAV:  12    -0.845325358959E+03    0.56114E-02   -0.68035E-03  3129   0.266E-01    0.123E-01
DAV:  13    -0.845325074972E+03    0.28399E-03   -0.50636E-03  3075   0.250E-01    0.144E-01
DAV:  14    -0.845328566793E+03   -0.34918E-02   -0.37427E-03  3057   0.172E-01    0.977E-02
DAV:  15    -0.845333347320E+03   -0.47805E-02   -0.13820E-03  3120   0.113E-01    0.407E-02
DAV:  16    -0.845335757510E+03   -0.24102E-02   -0.56244E-04  3102   0.690E-02    0.376E-02
DAV:  17    -0.845336802446E+03   -0.10449E-02   -0.25986E-04  3111   0.362E-02    0.266E-02
DAV:  18    -0.845337567234E+03   -0.76479E-03   -0.27957E-05  2463   0.188E-02    0.129E-02
DAV:  19    -0.845338356138E+03   -0.78890E-03   -0.60776E-05  2967   0.294E-02    0.110E-02
DAV:  20    -0.845338421878E+03   -0.65740E-04   -0.46928E-05  3012   0.153E-02    0.972E-03
DAV:  21    -0.845338464324E+03   -0.42446E-04   -0.41825E-06  2049   0.641E-03    0.922E-03
DAV:  22    -0.845338493984E+03   -0.29660E-04   -0.25511E-06  1986   0.103E-02    0.996E-03
DAV:  23    -0.845338479896E+03    0.14087E-04   -0.29725E-06  1905   0.128E-02    0.895E-03
DAV:  24    -0.845338542792E+03   -0.62896E-04   -0.19341E-05  2301   0.148E-02    0.963E-03
DAV:  25    -0.845338590904E+03   -0.48112E-04   -0.42736E-05  2733   0.375E-02    0.120E-02
DAV:  26    -0.845338636095E+03   -0.45191E-04   -0.13635E-04  3615   0.520E-02    0.191E-02
DAV:  27    -0.845338619592E+03    0.16503E-04   -0.94755E-05  3246   0.407E-02    0.268E-02
DAV:  28    -0.845338617692E+03    0.19000E-05   -0.22867E-05  2625   0.830E-03 
   1 F= -.84533862E+03 E0= -.84534326E+03  d E =0.139264E-01