Elementary mechanism for the electrocatalytic reduction of nitrobenzene on late-transition-metal surfaces from density functional theory
Andrew Jark-Wah Wong, Joshua L. Miller, Michael J. Janik
Topics & Concepts
NitrobenzeneElectrocatalystDensity functional theoryTransition metalAnilineChemistryReduction (mathematics)MetalInorganic chemistryMaterials scienceCatalysisComputational chemistryCombinatorial chemistryPhysical chemistryElectrochemistryOrganic chemistryElectrodeGeometryMathematicsAmmonia Synthesis and Nitrogen ReductionNanomaterials for catalytic reactionsElectrocatalysts for Energy Conversion