./iterations/neb0_image01_iter28_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     0.423119792968E+04    0.42312E+04   -0.23864E+05  2892   0.117E+03 
DAV:   2    -0.430891559653E+03   -0.46621E+04   -0.45589E+04  3360   0.329E+02 
DAV:   3    -0.943513451996E+03   -0.51262E+03   -0.51042E+03  3120   0.117E+02 
DAV:   4    -0.955717320585E+03   -0.12204E+02   -0.12158E+02  3183   0.195E+01 
DAV:   5    -0.956118754257E+03   -0.40143E+00   -0.40089E+00  3201   0.320E+00    0.812E+01
DAV:   6    -0.848001283569E+03    0.10812E+03   -0.47122E+02  3066   0.347E+01    0.376E+01
DAV:   7    -0.847530873129E+03    0.47041E+00   -0.14417E+01  3543   0.608E+00    0.146E+01
DAV:   8    -0.847196096314E+03    0.33478E+00   -0.96235E-01  3156   0.237E+00    0.593E+00
DAV:   9    -0.847151552851E+03    0.44543E-01   -0.41040E-01  3192   0.150E+00    0.857E-01
DAV:  10    -0.847158305201E+03   -0.67524E-02   -0.70362E-02  3129   0.595E-01    0.588E-01
DAV:  11    -0.847158275699E+03    0.29503E-04   -0.64766E-03  3120   0.209E-01    0.332E-01
DAV:  12    -0.847159872115E+03   -0.15964E-02   -0.69661E-03  3039   0.242E-01    0.117E-01
DAV:  13    -0.847163242213E+03   -0.33701E-02   -0.42054E-03  3183   0.205E-01    0.133E-01
DAV:  14    -0.847167158795E+03   -0.39166E-02   -0.27686E-03  3129   0.137E-01    0.931E-02
DAV:  15    -0.847172056088E+03   -0.48973E-02   -0.12245E-03  3066   0.895E-02    0.363E-02
DAV:  16    -0.847174209584E+03   -0.21535E-02   -0.41078E-04  3120   0.474E-02    0.358E-02
DAV:  17    -0.847175232621E+03   -0.10230E-02   -0.16864E-04  3075   0.316E-02    0.238E-02
DAV:  18    -0.847175980312E+03   -0.74769E-03   -0.26296E-05  2337   0.177E-02    0.131E-02
DAV:  19    -0.847176509754E+03   -0.52944E-03   -0.35508E-05  2634   0.202E-02    0.735E-03
DAV:  20    -0.847176611595E+03   -0.10184E-03   -0.34100E-05  2724   0.152E-02    0.699E-03
DAV:  21    -0.847176642219E+03   -0.30624E-04   -0.37797E-06  2004   0.463E-03    0.606E-03
DAV:  22    -0.847176660032E+03   -0.17813E-04   -0.20182E-06  1995   0.336E-03    0.299E-03
DAV:  23    -0.847176668453E+03   -0.84211E-05   -0.15884E-06  1977   0.306E-03 
   1 F= -.84717667E+03 E0= -.84718053E+03  d E =0.115958E-01