Predicting the Electric Field Effect on the Lateral Interactions Between Adsorbates: O/Fe(100) from First Principles
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DOI: 10.1007/s11244-018-0944-z
Abstract: A density functional theory parameterized lattice gas cluster expansion of oxygen on an Fe(100) surface is developed in the presence and absence of an applied positive and negative external electric field, characterizing the heterogeneity in… read more here.
Keywords: field; interactions adsorbates; lateral interactions; effect ... See more keywords