Exploring the catalytic activity of graphene-based TM-N<sub><i>x</i></sub>C<sub>4-<i>x</i></sub>single atom catalysts for the oxygen reduction reaction<i>via</i>density functional theory calculation
Zhengwei Du, Kaiming Deng, Erjun Kan, Cheng Zhan
Abstract
SACs by tuning the coordination environment, which may have potential implication in the high-performance fuel cell development.
Topics & Concepts
CatalysisOverpotentialChemistryTransition metalDensity functional theoryGrapheneVanadiumOxygen reduction reactionInorganic chemistryNanotechnologyCrystallographyComputational chemistryPhysical chemistryMaterials scienceElectrochemistryElectrodeOrganic chemistryElectrocatalysts for Energy ConversionFuel Cells and Related MaterialsAdvanced battery technologies research