6533b830fe1ef96bd1297d61

RESEARCH PRODUCT

Globally Optimized Equilibrium Shapes of Zirconia-Supported Rh and Pt Nanoclusters: Insights into Site Assembly and Reactivity

Andrey S. BazhenovKaroliina Honkala

subject

Materials science02 engineering and technology010402 general chemistry01 natural sciencesCatalysisNanoclustersTurn (biochemistry)nanorakenteetnanostructuresReactivity (chemistry)Cubic zirconiaPhysical and Theoretical ChemistryStructured modelta116ta114biologysite assemblyActive site021001 nanoscience & nanotechnology0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsreactivityGeneral EnergyChemical engineeringbiology.protein0210 nano-technology

description

Metal–support interfaces form an active site for many important catalytic reactions. The modeling of these interfacial sites calls for approximations to set up a structure model, which in turn may ...

https://doi.org/10.1021/acs.jpcc.9b00272