./iterations/neb0_image05_iter9_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     0.422147792046E+04    0.42215E+04   -0.23840E+05  2892   0.117E+03 
DAV:   2    -0.423640659865E+03   -0.46451E+04   -0.45486E+04  3360   0.328E+02 
DAV:   3    -0.938096086432E+03   -0.51446E+03   -0.51209E+03  3120   0.118E+02 
DAV:   4    -0.950556737588E+03   -0.12461E+02   -0.12416E+02  3219   0.196E+01 
DAV:   5    -0.950944356801E+03   -0.38762E+00   -0.38712E+00  3174   0.315E+00    0.809E+01
DAV:   6    -0.843068754232E+03    0.10788E+03   -0.47275E+02  3057   0.347E+01    0.375E+01
DAV:   7    -0.842606244655E+03    0.46251E+00   -0.14396E+01  3480   0.618E+00    0.146E+01
DAV:   8    -0.842281820820E+03    0.32442E+00   -0.94330E-01  3165   0.231E+00    0.601E+00
DAV:   9    -0.842247422566E+03    0.34398E-01   -0.39385E-01  3156   0.150E+00    0.872E-01
DAV:  10    -0.842248285074E+03   -0.86251E-03   -0.66292E-02  3147   0.559E-01    0.620E-01
DAV:  11    -0.842246194628E+03    0.20904E-02   -0.74701E-03  3129   0.221E-01    0.317E-01
DAV:  12    -0.842244101049E+03    0.20936E-02   -0.53639E-03  3120   0.237E-01    0.116E-01
DAV:  13    -0.842245364446E+03   -0.12634E-02   -0.44460E-03  3084   0.217E-01    0.132E-01
DAV:  14    -0.842248351492E+03   -0.29870E-02   -0.23661E-03  3084   0.120E-01    0.891E-02
DAV:  15    -0.842250850708E+03   -0.24992E-02   -0.44870E-04  3066   0.484E-02    0.462E-02
DAV:  16    -0.842254851866E+03   -0.40012E-02   -0.92045E-04  3066   0.672E-02    0.397E-02
DAV:  17    -0.842255781010E+03   -0.92914E-03   -0.24163E-04  3120   0.335E-02    0.273E-02
DAV:  18    -0.842256507681E+03   -0.72667E-03   -0.34563E-05  2607   0.165E-02    0.159E-02
DAV:  19    -0.842257220000E+03   -0.71232E-03   -0.39684E-05  2589   0.202E-02    0.897E-03
DAV:  20    -0.842257393208E+03   -0.17321E-03   -0.30721E-05  2535   0.157E-02    0.577E-03
DAV:  21    -0.842257438050E+03   -0.44842E-04   -0.65365E-06  2004   0.613E-03    0.564E-03
DAV:  22    -0.842257464519E+03   -0.26469E-04   -0.21501E-06  2004   0.327E-03    0.379E-03
DAV:  23    -0.842257476547E+03   -0.12028E-04   -0.18856E-06  1977   0.309E-03    0.188E-03
DAV:  24    -0.842257478344E+03   -0.17975E-05   -0.67757E-07  1986   0.166E-03 
   1 F= -.84225748E+03 E0= -.84226538E+03  d E =0.237074E-01