./iterations/neb0_image03_iter62_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     0.423638730349E+04    0.42364E+04   -0.23868E+05  2892   0.117E+03 
DAV:   2    -0.431282780019E+03   -0.46677E+04   -0.45684E+04  3372   0.329E+02 
DAV:   3    -0.943226813518E+03   -0.51194E+03   -0.50976E+03  3120   0.117E+02 
DAV:   4    -0.955385950571E+03   -0.12159E+02   -0.12114E+02  3183   0.195E+01 
DAV:   5    -0.955785355418E+03   -0.39940E+00   -0.39888E+00  3210   0.319E+00    0.813E+01
DAV:   6    -0.847711748604E+03    0.10807E+03   -0.47045E+02  3057   0.347E+01    0.377E+01
DAV:   7    -0.847247078979E+03    0.46467E+00   -0.14488E+01  3534   0.611E+00    0.146E+01
DAV:   8    -0.846913962199E+03    0.33312E+00   -0.96728E-01  3165   0.237E+00    0.593E+00
DAV:   9    -0.846867994198E+03    0.45968E-01   -0.40677E-01  3192   0.152E+00    0.854E-01
DAV:  10    -0.846874704849E+03   -0.67107E-02   -0.74038E-02  3120   0.609E-01    0.597E-01
DAV:  11    -0.846874628785E+03    0.76064E-04   -0.67025E-03  3120   0.208E-01    0.342E-01
DAV:  12    -0.846876084590E+03   -0.14558E-02   -0.70052E-03  3066   0.241E-01    0.119E-01
DAV:  13    -0.846879772817E+03   -0.36882E-02   -0.44663E-03  3237   0.211E-01    0.136E-01
DAV:  14    -0.846884139316E+03   -0.43665E-02   -0.29647E-03  3075   0.143E-01    0.948E-02
DAV:  15    -0.846888808758E+03   -0.46694E-02   -0.10909E-03  3156   0.819E-02    0.335E-02
DAV:  16    -0.846891363758E+03   -0.25550E-02   -0.46137E-04  3093   0.498E-02    0.370E-02
DAV:  17    -0.846892453503E+03   -0.10897E-02   -0.21237E-04  3129   0.369E-02    0.252E-02
DAV:  18    -0.846893130580E+03   -0.67708E-03   -0.31077E-05  2427   0.194E-02    0.136E-02
DAV:  19    -0.846893704932E+03   -0.57435E-03   -0.39878E-05  2661   0.218E-02    0.686E-03
DAV:  20    -0.846893816048E+03   -0.11112E-03   -0.31417E-05  2688   0.143E-02    0.649E-03
DAV:  21    -0.846893857053E+03   -0.41005E-04   -0.33148E-06  1995   0.453E-03    0.571E-03
DAV:  22    -0.846893878431E+03   -0.21378E-04   -0.21637E-06  1995   0.337E-03    0.254E-03
DAV:  23    -0.846893887199E+03   -0.87681E-05   -0.15529E-06  1986   0.304E-03 
   1 F= -.84689389E+03 E0= -.84689775E+03  d E =0.115959E-01