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Coordination Numbers For Unraveling Intrinsic Size Effects In Gold-catalyzed CO Oxidation

Siwen Wang, Noushin Omidvar, Emily Marx, Hongliang Xin

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Geometry-based reactivity descriptors, e.g., regular, generalized, and orbitalwise coordination numbers, were used for unraveling intrinsic size effects of Au nanocatalysts towards CO oxidation.