Improper-proper ferroelectric competition as a mechanism for multistate polarisation and ferrielectric-like behaviour

Fuente: arXiv
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Main Authors: Scott, Cameron A. M, Morrison, Finlay D., Bristowe, Nicholas. C.
Format: Preprint
Published: 2025
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author Scott, Cameron A. M
Morrison, Finlay D.
Bristowe, Nicholas. C.
author_facet Scott, Cameron A. M
Morrison, Finlay D.
Bristowe, Nicholas. C.
contents In this paper, we re-explore a simple textbook Landau model describing improper ferroelectricity and show that in the limit where both proper and improper instabilities exist and compete, improper ferroelectrics can display switching between multiple polarisation states. Using first principles calculations we highlight how the hexagonal tungsten bronze materials may be an archetypal case, with the possibility to switch between improper and proper phases. The resulting functional characteristics are akin to "ferrielectrics", with switching behaviour in the form of a triple hysteresis loop. Such functionality could be ideal for creating non-volatile multistate systems for use in memory devices or as a backbone for neuromorphic computing.
format Preprint
id arxiv_https___arxiv_org_abs_2510_02604
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Improper-proper ferroelectric competition as a mechanism for multistate polarisation and ferrielectric-like behaviour
Scott, Cameron A. M
Morrison, Finlay D.
Bristowe, Nicholas. C.
Materials Science
Computational Physics
In this paper, we re-explore a simple textbook Landau model describing improper ferroelectricity and show that in the limit where both proper and improper instabilities exist and compete, improper ferroelectrics can display switching between multiple polarisation states. Using first principles calculations we highlight how the hexagonal tungsten bronze materials may be an archetypal case, with the possibility to switch between improper and proper phases. The resulting functional characteristics are akin to "ferrielectrics", with switching behaviour in the form of a triple hysteresis loop. Such functionality could be ideal for creating non-volatile multistate systems for use in memory devices or as a backbone for neuromorphic computing.
title Improper-proper ferroelectric competition as a mechanism for multistate polarisation and ferrielectric-like behaviour
topic Materials Science
Computational Physics
url https://arxiv.org/abs/2510.02604