Enhanced Fe 3d delocalization and moderate spin polarization in Fe Ni atomic pairs for bifunctional ORR and OER electrocatalysis
Hongguan Li, Jing Wang, Ruijuan Qi, Yongfeng Hu, Jing Zhang, Hongbin Zhao, Jiujun Zhang, Yufeng Zhao
Topics & Concepts
BifunctionalDelocalized electronSpin polarizationElectronDensity functional theoryPolarization (electrochemistry)Spin (aerodynamics)Condensed matter physicsElectrocatalystMagnetic momentCharge (physics)Materials scienceCatalysisChemistryComputational chemistryPhysicsPhysical chemistryQuantum mechanicsElectrochemistryElectrodeBiochemistryThermodynamicsOrganic chemistryElectrocatalysts for Energy ConversionAdvancements in Battery MaterialsAdvanced battery technologies research