Abstract
A combination of experimental surface science techniques and density functional theory calculations has been employed to understand the adsorption and surface chemistry of a variety of C4 cyclic oxygenates on the (111) surface of Pd. These C4 cyclic oxygenates represent important probe molecules for production of chemicals from biomass-derived carbohydrates. The surface level studies of these intermediates reveal that adsorption and reactivity trends are determined by ring size/strain, degree of unsaturation, nature of the oxygenate function, and composition of the metal surface.
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Research support from the National Science Foundation (CBET-0828767) is gratefully acknowledged.
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Medlin, J.W., Horiuchi, C.M. & Rangan, M. Effects of Ring Structure on the Reaction Pathways of Cyclic Esters and Ethers on Pd(111). Top Catal 53, 1179–1184 (2010). https://doi.org/10.1007/s11244-010-9558-9
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DOI: https://doi.org/10.1007/s11244-010-9558-9