Investigation on the demetallation of Fe-N-C for oxygen reduction reaction: The influence of structure and structural evolution of active site
Xinlong Xu, Xiaoming Zhang, Zhichong Kuang, Zhangxun Xia, Alexandre I. Rykov, Shansheng Yu, Junhu Wang, Suli Wang, Gongquan Sun
Topics & Concepts
ChemistryActive siteCatalysisOxygen reduction reactionMolecular dynamicsOxygenReaction mechanismDensity functional theoryAb initioComputational chemistryPhysical chemistryElectrodeOrganic chemistryElectrochemistryElectrocatalysts for Energy ConversionFuel Cells and Related MaterialsCatalysis and Hydrodesulfurization Studies