Physical review. B./Physical review. B · 2021 · 24 citations · 46 references
Natural SciencesMaterials SciencePhysicsCondensed Matter PhysicsNanotechnologySemiconductor MaterialsExchange InteractionsFerromagnetismMagnetic Properties Of SolidsMagnetism In SolidsSpintronicsTwo-dimensional SemiconductorsElectric-field Control Of MagnetismFirst-principles MagnetismMagnetic SemiconductorsMagnetism In Two-dimensional SemiconductorsSuperexchangeSuperexchange MechanismTwo-dimensional Magnetic MaterialsTwo-dimensional Magnetism
Electrical control of magnetism in a two-dimensional (2D) semiconductor is of great interest for emerging nanoscale low-dissipation spintronic devices. Here, we propose a general approach of tuning magnetic coupling and anisotropy of a van der Waals (vdW) 2D magnetic semiconductor via a built-in electric field generated by the adsorption of superatomic ions. Using first-principles calculations, we predict a significant enhancement of ferromagnetic coupling and a great change of magnetic anisotropy in 2D semiconductors when they are sandwiched between superatomic cations and anions. The magnetic coupling is directly affected by the built-in electric field, which lifts the energy levels of mediated ligands' orbitals and enhances the superexchange interactions. These findings will be of interest for ionic gating controlled ferromagnets and magnetoelectronics based on vdW 2D semiconductors.
46
Generalized Gradient Approximation Made Simple
John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text
Natural Sciences, Chemistry, Physics +16
Projector augmented-wave method
Peter E. Blöchl · Physical review. B, Condensed matter · 1994 · 90.8K citations
Natural Sciences, Chemistry, Physics +17
<i>Ab initio</i>molecular dynamics for liquid metals
Georg Kresse, J. Häfner · Physical review. B, Condensed matter · 1993 · 44.9K citations
Natural Sciences, Chemistry, Physics +17