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Anomalous ferroelectricity and double-negative effects in bilayer hexagonal boron nitride

Physical Review B(2022)

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Abstract
Recently, the presence of an out-of-plane ferroelectric polarization was experimentally confirmed in bilayer two-dimensional (2D) hexagonal boron nitride (h-BN). In this work, we employ first-principles computations to reveal that (i) such slidetronic ferroelectricity is electronic in nature and arises from in-plane interlayer translation, which is distinctive among 2D slidetronic ferroelectric materials; and (ii) there is a coexistence of a negative longitudinal piezoelectric effect and an out-of-plane negative Poisson's ratio in the ferroelectric state of bilayer h-BN, which we refer to as anomalous double-negative effects.
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Key words
anomalous ferroelectricity,boron,double-negative
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