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Fundamental Insights into the Structure and Dynamics of Confined Substrates inside Silica Nanostructures, using a combination of Molecular Dynamics and Grand Canonical Monte Carlo Simulations
DownloadFall 2021
Condensed phase reactions in the presence of heterogeneous catalysts are widely performed for the conversion of biomass into useful intermediates and value-added products. Specifically, nanoporous catalysts have garnered interest for liquid-phase oxidation, hydrogenation, dehydrogenation and/or...
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