Abstract
Different adsorption sites for molecular and atomic oxygen on a silver surface and the epoxidation of ethylene have been studied by use of extended Hueckel calculations. Several types of adsorbed molecular oxygen on an Ag(110) surface have been considered, and end-on adsorption on top of silver, a peroxidic adsorbed molecular oxygen, either adsorbed on a silver atom on the surface or bound to one in the second layer, and finally molecular oxygen located in the grooves along the (110) and (001) directions. For atomic adsorbed oxygen four types of geometries have been considered.
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