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Published on: March 27, 2018
Sliding ferroelectricity of multilayer h-BN.
Zijun Li1, Le Fang1,2, Hui Zhang1
1Physics Department, Materials Genome Institute, Shanghai Engineering Research Center for Integrated Circuits and Advanced Display Materials, State Key Laboratory of Advanced Refractories, Institute for Quantum Science and Technology, International Centre of Quantum and Molecular Structures, Shanghai University, Shanghai 200444, China. hzhang23@shu.edu.cn.
Interlayer sliding in hexagonal boron nitride (h-BN) multilayers creates switchable ferroelectric ordering. Specific stacking strategies can enhance electric dipoles for advanced electronics.
Area of Science:
- Materials Science
- Condensed Matter Physics
- Nanotechnology
Background:
- Two-dimensional (2D) ferroelectrics are crucial for next-generation electronics.
- Hexagonal boron nitride (h-BN) exhibits out-of-plane ferroelectricity through interlayer sliding.
Purpose of the Study:
- To systematically investigate stacking-dependent ferroelectric ordering in multilayer h-BN.
- To explore design principles for enhancing ferroelectric properties in h-BN.
Main Methods:
- First principles calculations.
- Modern theory of polarization.
- Symmetry analysis of stacking configurations.
Main Results:
- Trilayer h-BN with interlayer slip shows non-centrosymmetric stacking and switchable dipoles.
- 30 out of 36 distinct trilayer stacking orders exhibit ferroelectricity.
- Strategies like AB stacking and AA' antiparallel stacking enhance dipole moments in thicker h-BN.
Conclusions:
- Interlayer sliding is a key mechanism for ferroelectricity in h-BN multilayers.
- Stacking sequence critically influences ferroelectric properties.
- Findings provide a foundation for designing novel ultracompact ferroelectric devices.
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