./iterations/neb0_image02_iter1_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 0.423201179359E+04 0.42320E+04 -0.23866E+05 2892 0.117E+03 DAV: 2 -0.429540283610E+03 -0.46616E+04 -0.45616E+04 3366 0.329E+02 DAV: 3 -0.941678662154E+03 -0.51214E+03 -0.50990E+03 3120 0.117E+02 DAV: 4 -0.953894765269E+03 -0.12216E+02 -0.12171E+02 3183 0.195E+01 DAV: 5 -0.954290804202E+03 -0.39604E+00 -0.39553E+00 3201 0.318E+00 0.816E+01 DAV: 6 -0.845205524241E+03 0.10909E+03 -0.47405E+02 3057 0.348E+01 0.378E+01 DAV: 7 -0.844670210443E+03 0.53531E+00 -0.14503E+01 3516 0.612E+00 0.147E+01 DAV: 8 -0.844311108630E+03 0.35910E+00 -0.96423E-01 3156 0.240E+00 0.599E+00 DAV: 9 -0.844254539423E+03 0.56569E-01 -0.43957E-01 3192 0.159E+00 0.889E-01 DAV: 10 -0.844258142795E+03 -0.36034E-02 -0.72002E-02 3129 0.600E-01 0.603E-01 DAV: 11 -0.844256206421E+03 0.19364E-02 -0.81471E-03 3120 0.222E-01 0.325E-01 DAV: 12 -0.844255555504E+03 0.65092E-03 -0.64680E-03 3228 0.249E-01 0.120E-01 DAV: 13 -0.844258146959E+03 -0.25915E-02 -0.54436E-03 3111 0.248E-01 0.132E-01 DAV: 14 -0.844262522892E+03 -0.43759E-02 -0.36384E-03 3120 0.151E-01 0.871E-02 DAV: 15 -0.844265249990E+03 -0.27271E-02 -0.61738E-04 3084 0.607E-02 0.437E-02 DAV: 16 -0.844268902259E+03 -0.36523E-02 -0.63369E-04 3084 0.521E-02 0.353E-02 DAV: 17 -0.844269913035E+03 -0.10108E-02 -0.18523E-04 3075 0.315E-02 0.263E-02 DAV: 18 -0.844270790135E+03 -0.87710E-03 -0.50446E-05 3012 0.169E-02 0.183E-02 DAV: 19 -0.844271493946E+03 -0.70381E-03 -0.39505E-05 2643 0.224E-02 0.928E-03 DAV: 20 -0.844271661196E+03 -0.16725E-03 -0.47034E-05 2769 0.185E-02 0.754E-03 DAV: 21 -0.844271696599E+03 -0.35403E-04 -0.64167E-06 2004 0.595E-03 0.568E-03 DAV: 22 -0.844271717149E+03 -0.20551E-04 -0.18793E-06 2004 0.278E-03 0.344E-03 DAV: 23 -0.844271734400E+03 -0.17251E-04 -0.28428E-06 2004 0.323E-03 0.143E-03 DAV: 24 -0.844271736346E+03 -0.19459E-05 -0.62727E-07 2022 0.164E-03 1 F= -.84427174E+03 E0= -.84427560E+03 d E =0.115959E-01