./iterations/neb0_image07_iter36_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 0.423757332053E+04 0.42376E+04 -0.23862E+05 2892 0.117E+03 DAV: 2 -0.425345339001E+03 -0.46629E+04 -0.45649E+04 3345 0.329E+02 DAV: 3 -0.942527836185E+03 -0.51718E+03 -0.51493E+03 3120 0.118E+02 DAV: 4 -0.954946073073E+03 -0.12418E+02 -0.12371E+02 3192 0.196E+01 DAV: 5 -0.955349397932E+03 -0.40332E+00 -0.40279E+00 3201 0.320E+00 0.812E+01 DAV: 6 -0.847304303626E+03 0.10805E+03 -0.47075E+02 3075 0.347E+01 0.376E+01 DAV: 7 -0.846760251130E+03 0.54405E+00 -0.14801E+01 3534 0.638E+00 0.147E+01 DAV: 8 -0.846429672421E+03 0.33058E+00 -0.94110E-01 3201 0.274E+00 0.603E+00 DAV: 9 -0.846367018359E+03 0.62654E-01 -0.62120E-01 3957 0.322E+00 0.175E+00 DAV: 10 -0.846360507482E+03 0.65109E-02 -0.39937E-01 3255 0.144E+00 0.152E+00 DAV: 11 -0.846323279558E+03 0.37228E-01 -0.10312E-01 3507 0.819E-01 0.116E+00 DAV: 12 -0.846301396046E+03 0.21884E-01 -0.52206E-02 3354 0.607E-01 0.816E-01 DAV: 13 -0.846291658251E+03 0.97378E-02 -0.10891E-01 4137 0.675E-01 0.762E-01 DAV: 14 -0.846288784353E+03 0.28739E-02 -0.88264E-02 3741 0.435E-01 0.922E-01 DAV: 15 -0.846280544925E+03 0.82394E-02 -0.19887E-02 3300 0.271E-01 0.274E-01 DAV: 16 -0.846280528885E+03 0.16040E-04 -0.17823E-02 3552 0.468E-01 0.486E-01 DAV: 17 -0.846277529415E+03 0.29995E-02 -0.64376E-03 3174 0.291E-01 0.177E-01 DAV: 18 -0.846278809281E+03 -0.12799E-02 -0.52049E-03 3048 0.201E-01 0.150E-01 DAV: 19 -0.846280606500E+03 -0.17972E-02 -0.24426E-03 3111 0.132E-01 0.107E-01 DAV: 20 -0.846283377805E+03 -0.27713E-02 -0.15412E-03 3147 0.117E-01 0.717E-02 DAV: 21 -0.846286100531E+03 -0.27227E-02 -0.97802E-04 3120 0.773E-02 0.140E-01 DAV: 22 -0.846287176064E+03 -0.10755E-02 -0.63372E-04 3264 0.695E-02 0.723E-02 DAV: 23 -0.846288046280E+03 -0.87022E-03 -0.39694E-04 3444 0.519E-02 0.496E-02 DAV: 24 -0.846288742650E+03 -0.69637E-03 -0.21088E-04 3057 0.378E-02 0.331E-02 DAV: 25 -0.846289415436E+03 -0.67279E-03 -0.85840E-05 2976 0.218E-02 0.256E-02 DAV: 26 -0.846289593329E+03 -0.17789E-03 -0.43730E-05 2094 0.154E-02 0.132E-02 DAV: 27 -0.846289715902E+03 -0.12257E-03 -0.24879E-05 2202 0.112E-02 0.242E-02 DAV: 28 -0.846289787702E+03 -0.71800E-04 -0.10870E-05 1977 0.925E-03 0.102E-02 DAV: 29 -0.846289819787E+03 -0.32085E-04 -0.84689E-06 2022 0.781E-03 0.302E-03 DAV: 30 -0.846289827517E+03 -0.77299E-05 -0.28622E-06 2004 0.391E-03 1 F= -.84628983E+03 E0= -.84633857E+03 d E =0.146226E+00