./iterations/neb0_image03_iter12_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     0.422671773099E+04    0.42267E+04   -0.23857E+05  2892   0.117E+03 
DAV:   2    -0.428342879003E+03   -0.46551E+04   -0.45579E+04  3357   0.329E+02 
DAV:   3    -0.942171097527E+03   -0.51383E+03   -0.51157E+03  3120   0.117E+02 
DAV:   4    -0.954505845158E+03   -0.12335E+02   -0.12288E+02  3192   0.196E+01 
DAV:   5    -0.954913158638E+03   -0.40731E+00   -0.40677E+00  3192   0.321E+00    0.811E+01
DAV:   6    -0.846680530346E+03    0.10823E+03   -0.47211E+02  3066   0.347E+01    0.375E+01
DAV:   7    -0.846231063762E+03    0.44947E+00   -0.14444E+01  3543   0.610E+00    0.146E+01
DAV:   8    -0.845908205624E+03    0.32286E+00   -0.97084E-01  3165   0.236E+00    0.596E+00
DAV:   9    -0.845869870636E+03    0.38335E-01   -0.41892E-01  3192   0.149E+00    0.861E-01
DAV:  10    -0.845875977764E+03   -0.61071E-02   -0.65255E-02  3174   0.569E-01    0.598E-01
DAV:  11    -0.845875655419E+03    0.32234E-03   -0.65090E-03  3129   0.209E-01    0.326E-01
DAV:  12    -0.845876280250E+03   -0.62483E-03   -0.62919E-03  3075   0.236E-01    0.112E-01
DAV:  13    -0.845878790509E+03   -0.25103E-02   -0.40966E-03  3138   0.207E-01    0.129E-01
DAV:  14    -0.845882307240E+03   -0.35167E-02   -0.24851E-03  3066   0.130E-01    0.878E-02
DAV:  15    -0.845886922568E+03   -0.46153E-02   -0.12797E-03  3075   0.912E-02    0.403E-02
DAV:  16    -0.845888820869E+03   -0.18983E-02   -0.38417E-04  3111   0.503E-02    0.365E-02
DAV:  17    -0.845889714102E+03   -0.89323E-03   -0.21434E-04  3111   0.338E-02    0.259E-02
DAV:  18    -0.845890431513E+03   -0.71741E-03   -0.31619E-05  2436   0.193E-02    0.122E-02
DAV:  19    -0.845890973428E+03   -0.54191E-03   -0.39578E-05  2661   0.212E-02    0.671E-03
DAV:  20    -0.845891079211E+03   -0.10578E-03   -0.31250E-05  2688   0.144E-02    0.670E-03
DAV:  21    -0.845891112680E+03   -0.33469E-04   -0.35319E-06  2022   0.414E-03    0.574E-03
DAV:  22    -0.845891133240E+03   -0.20560E-04   -0.17676E-06  2022   0.274E-03    0.283E-03
DAV:  23    -0.845891148261E+03   -0.15021E-04   -0.17091E-06  2013   0.324E-03    0.900E-04
DAV:  24    -0.845891150166E+03   -0.19051E-05   -0.63258E-07  2031   0.165E-03 
   1 F= -.84589115E+03 E0= -.84589502E+03  d E =0.115959E-01