ML-guided design and screening of chalcogenide catalysts for hydrogen evolution reaction
Linnan Tu, Yingju Yang, Jing Liu
Topics & Concepts
ChalcogenideCatalysisTafel equationDensity functional theoryAtom (system on chip)Transition metalHydrogenChemistryAdsorptionHydrogen atomNanotechnologyChemical engineeringMetalMaterials scienceElectrochemistryComputational chemistryPhysical chemistryComputer scienceOrganic chemistryElectrodeEmbedded systemAlkylEngineeringElectrocatalysts for Energy ConversionAdvanced Photocatalysis TechniquesMachine Learning in Materials Science