./iterations/neb0_image06_iter40_OSZICAR.out output for 745: 733-->741: H2O near HO-Si on SiO2 surface --> H-OSi + OH-Si on SiO2 surface (TSS)
Status: runningN E dE d eps ncg rms rms(c) DAV: 1 0.424056097679E+04 0.42406E+04 -0.23864E+05 2892 0.117E+03 DAV: 2 -0.428185107170E+03 -0.46687E+04 -0.45726E+04 3366 0.329E+02 DAV: 3 -0.942397733920E+03 -0.51421E+03 -0.51197E+03 3120 0.117E+02 DAV: 4 -0.954663781465E+03 -0.12266E+02 -0.12220E+02 3183 0.196E+01 DAV: 5 -0.955066339368E+03 -0.40256E+00 -0.40202E+00 3192 0.321E+00 0.812E+01 DAV: 6 -0.846933823512E+03 0.10813E+03 -0.47034E+02 3057 0.347E+01 0.375E+01 DAV: 7 -0.846468298017E+03 0.46553E+00 -0.14666E+01 3534 0.607E+00 0.146E+01 DAV: 8 -0.846109591881E+03 0.35871E+00 -0.97152E-01 3156 0.236E+00 0.596E+00 DAV: 9 -0.846035932658E+03 0.73659E-01 -0.42897E-01 3183 0.150E+00 0.869E-01 DAV: 10 -0.846030881655E+03 0.50510E-02 -0.71897E-02 3120 0.595E-01 0.577E-01 DAV: 11 -0.846024623632E+03 0.62580E-02 -0.66462E-03 3147 0.226E-01 0.325E-01 DAV: 12 -0.846018450171E+03 0.61735E-02 -0.81951E-03 3093 0.286E-01 0.128E-01 DAV: 13 -0.846018073966E+03 0.37621E-03 -0.53448E-03 3093 0.246E-01 0.151E-01 DAV: 14 -0.846021068670E+03 -0.29947E-02 -0.35695E-03 3075 0.161E-01 0.107E-01 DAV: 15 -0.846026527966E+03 -0.54593E-02 -0.15977E-03 3129 0.126E-01 0.450E-02 DAV: 16 -0.846028883736E+03 -0.23558E-02 -0.62686E-04 3102 0.607E-02 0.405E-02 DAV: 17 -0.846029854629E+03 -0.97089E-03 -0.16784E-04 3129 0.279E-02 0.253E-02 DAV: 18 -0.846030894340E+03 -0.10397E-02 -0.40715E-05 2652 0.158E-02 0.115E-02 DAV: 19 -0.846031665276E+03 -0.77094E-03 -0.38363E-05 2661 0.197E-02 0.945E-03 DAV: 20 -0.846031784437E+03 -0.11916E-03 -0.30451E-05 2679 0.132E-02 0.750E-03 DAV: 21 -0.846031834369E+03 -0.49931E-04 -0.38465E-06 1977 0.560E-03 0.464E-03 DAV: 22 -0.846031906358E+03 -0.71990E-04 -0.55296E-06 1950 0.631E-03 0.254E-03 DAV: 23 -0.846031922377E+03 -0.16019E-04 -0.34030E-06 1986 0.462E-03 0.292E-03 DAV: 24 -0.846031924642E+03 -0.22655E-05 -0.13061E-06 2040 0.313E-03 1 F= -.84603192E+03 E0= -.84603590E+03 d E =0.119265E-01