Hydrogen adsorption on various transition metal (111) surfaces in water: a DFT forecast
Basil Raju Karimadom, Alina Sermiagin, Dan Meyerstein, Tomer Zidki, Amir Mizrahi, Ronen Bar‐Ziv, Haya Kornweitz
Abstract
The hydrogen adsorption and hydrogen evolution at the M(111), (M = Ag, Au Cu, Pt, Pd, Ni & Co) surfaces of various transition metals in aqueous suspensions were studied computationally using the DFT methods.
Topics & Concepts
AdsorptionHydrogenTafel equationTransition metalMetalDiffusionSurface diffusionChemistryInorganic chemistryAqueous solutionChemical physicsMaterials sciencePhysical chemistryCatalysisThermodynamicsElectrochemistryOrganic chemistryElectrodePhysicsCatalytic Processes in Materials ScienceAmmonia Synthesis and Nitrogen ReductionAdvanced Chemical Physics Studies