Mechanistic insights into the catalytic transfer hydrogenation of furfural to furfuryl alcohol over a N-doped carbon-supported Ni single atom catalyst from first principles
Fan Yang, Wenzhen Lai
Abstract
First-principles calculations reveal the catalytic active sites and the reaction mechanism of the catalytic transfer hydrogenation of furfural to furfuryl alcohol over a N-doped carbon-supported Ni single atom catalyst.
Topics & Concepts
Furfuryl alcoholFurfuralChemistryCatalysisTransfer hydrogenationCarbon fibersAtom (system on chip)Carbon atomAlcoholOrganic chemistryAlkylRutheniumMaterials scienceComposite materialComposite numberEmbedded systemComputer scienceCatalysis for Biomass ConversionCatalysis and Hydrodesulfurization StudiesAsymmetric Hydrogenation and Catalysis