Slide and twist: manipulating polarization in multilayer hexagonal boron-nitride

Vizcaya, Sanber; Riffo, Felipe Perez; Florez, Juan M.; Morell, Eric Suarez

Abstract

This study explores the world of across-layer sliding ferroelectricity in multilayer hexagonal boron nitride (hBN), aiming to control out-of-plane polarization. By investigating the effects of sliding single or dual layers in various hBN stacking configurations, we uncover methods for reversing polarization with energy barriers between 5 and 30 meV per f.u., making these methods experimentally viable. Our results show that single-interface sliding is more energetically favorable, with lower barriers compared to multiple interfaces. Certain pathways reveal stable polarization plateaus, where polarization remains constant during specific sliding phases, promising robust polarization control. Moreover, rotated multilayer structures maintain consistent net out-of-plane polarization across different rotation angles. In trilayer ABT structures, rotating the top layer and sliding the bottom layer can reverse polarization, expanding device design possibilities. While the primary focus is on hBN, similar phenomena in hGaN suggest broader applicability for this class of polar materials. The identified energy barriers support the feasibility of fabricating devices based on these multilayer structures.

Más información

Título según WOS: ID WOS:001448558300001 Not found in local WOS DB
Título de la Revista: PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Volumen: 27
Número: 14
Editorial: ROYAL SOC CHEMISTRY
Fecha de publicación: 2025
Página de inicio: 7189
Página final: 7198
DOI:

10.1039/d5cp00375j

Notas: ISI