Topology-based machine learning for predicting curvature effects in metal-nitrogen-carbon single-atom catalysts
Ge-Hao Liang, Heng-Su Liu, Ximing Zhang, Jianfeng Li, Shisheng Zheng
Topics & Concepts
CurvatureCatalysisNitrogen atomAtom (system on chip)Carbon fibersMetalTopology (electrical circuits)NitrogenCarbon atomMaterials scienceChemistryComputer scienceMathematicsMetallurgyCombinatoricsGeometryParallel computingOrganic chemistryComposite materialComposite numberAlkylGroup (periodic table)Machine Learning in Materials ScienceCatalysis and Oxidation ReactionsSurface Chemistry and Catalysis