Nonvolatile control of half-metallicity in -type antiferromagnetic bilayer
Phys. Rev. B 114, 065426 – Published 27 July, 2026
DOI: https://doi.org/10.1103/pb7x-kcwz
Abstract
The electronic and magnetic properties of two-dimensional bilayer are systematically investigated using first-principles calculations. We find that the metastable antialigned stacking bilayer exhibits sliding ferroelectricity, where reversible out-of-plane polarization is enabled by interlayer sliding. In contrast, the ground-state aligned AB-stacked bilayer is an -type antiferromagnetic (AFM) semiconductor. Upon applying a vertical electric field, this AFM semiconductor can be converted into a half-metal with 100% spin polarization. This transition is driven by the field-induced potential gradient, which triggers opposite energy shifts in the spin-resolved bands of the two layers. Furthermore, the conducting spin channel can be effectively switched by reversing the electric field direction. To achieve nonvolatile control, we propose a van der Waals heterostructure by integrating the bilayer with a ferroelectric bilayer. Our results demonstrate that half-metallicity with 100% spin-down polarization is realized when the polarization is upward (), while the system reverts to a semiconducting state upon polarization reversal (). Based on this polarization-dependent phase transition, a nonvolatile ferroelectric memory device is proposed, offering a promising platform for next-generation AFM spintronics.