Density functional theory–based design of a Pt-skinned PtNi catalyst for the oxygen reduction reaction in fuel cells
Dong Yun Shin, Yeon-Jeong Shin, Minsu Kim, Jeong An Kwon, Dong‐Hee Lim
Topics & Concepts
CatalysisDensity functional theoryAdsorptionPlatinumDissociation (chemistry)MetalTransition metalOxygen reduction reactionChemistryOxygenMaterials scienceChemical engineeringInorganic chemistryPhysical chemistryElectrochemistryComputational chemistryMetallurgyElectrodeOrganic chemistryEngineeringElectrocatalysts for Energy ConversionFuel Cells and Related MaterialsAdvanced Memory and Neural Computing