Magnetization reversal of perpendicular magnetic anisotropy regulated by ferroelectric polarization in CoFe3N/BaTiO3 heterostructures: first-principles calculations

Abstract

Exploring the electric-field switching of perpendicular magnetic anisotropy (PMA) in multiferroic heterostructures has important physical significance, which attracts great interest due to its promising application for energy-efficient information storage. Herewith, we investigate the effect of ferroelectric polarization on magnetic anisotropy in CoFe₃N/BaTiO₃ heterostructures using first-principles calculations. The calculations reveal that the magnetic anisotropy of CoFe₃N can be regulated by ferroelectric polarization of BaTiO₃. When the ferroelectric polarization reverses, the PMA of FeCo–TiO₂ and FeN–BaO configurations remains, but in the FeN–TiO₂ and FeCo–BaO cases, magnetic anisotropy inverses between out-of-plane and in-plane direction. Further orbital-resolved analysis indicates that the transition of magnetic anisotropy is mainly attributed to the orbital hybridization of interfacial Fe/Co atoms with O atoms induced by the magnetoelectric effect. This study may open an effective approach toward modulating PMA and lays a foundation to the development of low energy consumption memory devices.