./iterations/neb0_image02_iter6_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 0.422632092139E+04 0.42263E+04 -0.23857E+05 2892 0.117E+03 DAV: 2 -0.431068645323E+03 -0.46574E+04 -0.45571E+04 3375 0.329E+02 DAV: 3 -0.942446388017E+03 -0.51138E+03 -0.50917E+03 3120 0.117E+02 DAV: 4 -0.954641805561E+03 -0.12195E+02 -0.12151E+02 3174 0.195E+01 DAV: 5 -0.955043680222E+03 -0.40187E+00 -0.40134E+00 3201 0.320E+00 0.812E+01 DAV: 6 -0.846912463837E+03 0.10813E+03 -0.47188E+02 3057 0.347E+01 0.376E+01 DAV: 7 -0.846444502246E+03 0.46796E+00 -0.14327E+01 3552 0.605E+00 0.146E+01 DAV: 8 -0.846111414532E+03 0.33309E+00 -0.95539E-01 3156 0.237E+00 0.593E+00 DAV: 9 -0.846068780934E+03 0.42634E-01 -0.41852E-01 3192 0.151E+00 0.868E-01 DAV: 10 -0.846074469714E+03 -0.56888E-02 -0.67041E-02 3111 0.579E-01 0.593E-01 DAV: 11 -0.846073751682E+03 0.71803E-03 -0.66581E-03 3120 0.210E-01 0.323E-01 DAV: 12 -0.846074448767E+03 -0.69708E-03 -0.70467E-03 3102 0.248E-01 0.115E-01 DAV: 13 -0.846077434242E+03 -0.29855E-02 -0.44258E-03 3138 0.212E-01 0.132E-01 DAV: 14 -0.846081318312E+03 -0.38841E-02 -0.26797E-03 3093 0.133E-01 0.894E-02 DAV: 15 -0.846086335245E+03 -0.50169E-02 -0.13856E-03 3057 0.974E-02 0.408E-02 DAV: 16 -0.846088296100E+03 -0.19609E-02 -0.39069E-04 3138 0.480E-02 0.371E-02 DAV: 17 -0.846089216179E+03 -0.92008E-03 -0.20247E-04 3120 0.330E-02 0.252E-02 DAV: 18 -0.846089949847E+03 -0.73367E-03 -0.30008E-05 2436 0.183E-02 0.137E-02 DAV: 19 -0.846090513775E+03 -0.56393E-03 -0.40932E-05 2688 0.217E-02 0.767E-03 DAV: 20 -0.846090603471E+03 -0.89696E-04 -0.35889E-05 2760 0.151E-02 0.722E-03 DAV: 21 -0.846090638266E+03 -0.34795E-04 -0.37245E-06 1995 0.429E-03 0.567E-03 DAV: 22 -0.846090662081E+03 -0.23815E-04 -0.24853E-06 2013 0.325E-03 0.238E-03 DAV: 23 -0.846090676336E+03 -0.14254E-04 -0.16295E-06 2022 0.333E-03 0.101E-03 DAV: 24 -0.846090679094E+03 -0.27587E-05 -0.69579E-07 2004 0.185E-03 1 F= -.84609068E+03 E0= -.84609454E+03 d E =0.115959E-01