Matej Huš is studying ethylene epoxidation on different silver catalysts, promotor effects of various dopants and influence of hot electrons. By connecting DFT methods, microkinetics and KMC simulations coupled into a bottom-up multiscale approach, novel insights into the mechanism of action of different catalysts are sought. In his research career, he has worked on several important topics in heterogeneous catalysis, mostly carbon dioxide hydrogenation and biomass valorization, as well as conversion of atmospheric pollutants and coarse-grained water models.
Showing 7 publications
Hydrogenation and hydrodeoxygenation of aromatic lignin monomers over Cu/C, Ni/C, Pd/C, Pt/C, Rh/C and Ru/C catalysts: Mechanisms, reaction micro-kinetic modelling and quantitative structure-activity relationships
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