Vortices and antivortices in antiferroelectric PbZrO3

Fuente: arXiv
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Autores principales: Liu, Ying, Zhang, Huazhang, Shapovalov, Konstantin, Niu, Ranming, Cairney, Julie M., Liao, Xiaozhou, Roleder, Krystian, Majchrowski, Andrzej, Arbiol, Jordi, Ghosez, Philippe, Catalan, Gustau
Formato: Preprint
Publicado: 2025
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author Liu, Ying
Zhang, Huazhang
Shapovalov, Konstantin
Niu, Ranming
Cairney, Julie M.
Liao, Xiaozhou
Roleder, Krystian
Majchrowski, Andrzej
Arbiol, Jordi
Ghosez, Philippe
Catalan, Gustau
author_facet Liu, Ying
Zhang, Huazhang
Shapovalov, Konstantin
Niu, Ranming
Cairney, Julie M.
Liao, Xiaozhou
Roleder, Krystian
Majchrowski, Andrzej
Arbiol, Jordi
Ghosez, Philippe
Catalan, Gustau
contents Although ferroelectric materials are characterised by their parallel arrangement of electric dipoles, in the right boundary conditions these dipoles can reorganize themselves into vortices, antivortices and other non-trivial topological structures. By contrast, little is known about how (or whether) antiferroelectrics, which are materials showing an antiparallel arrangement of electric dipoles, can exhibit vortices or antivortices. In this study, using advanced aberration-corrected scanning transmission electron microscopy, we uncover the existence of atomic-scale (anti)vorticity in ferroelastic domain walls of the archetypal antiferroelectric phase of PbZrO3. The finding is supported, and its underlying physics is explained, using both second-principles simulations based on a deep-learning interatomic potential, and continuum field modelling. This discovery expands the field of chiral topologies into antiferroelectrics.
format Preprint
id arxiv_https___arxiv_org_abs_2502_05852
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Vortices and antivortices in antiferroelectric PbZrO3
Liu, Ying
Zhang, Huazhang
Shapovalov, Konstantin
Niu, Ranming
Cairney, Julie M.
Liao, Xiaozhou
Roleder, Krystian
Majchrowski, Andrzej
Arbiol, Jordi
Ghosez, Philippe
Catalan, Gustau
Materials Science
Although ferroelectric materials are characterised by their parallel arrangement of electric dipoles, in the right boundary conditions these dipoles can reorganize themselves into vortices, antivortices and other non-trivial topological structures. By contrast, little is known about how (or whether) antiferroelectrics, which are materials showing an antiparallel arrangement of electric dipoles, can exhibit vortices or antivortices. In this study, using advanced aberration-corrected scanning transmission electron microscopy, we uncover the existence of atomic-scale (anti)vorticity in ferroelastic domain walls of the archetypal antiferroelectric phase of PbZrO3. The finding is supported, and its underlying physics is explained, using both second-principles simulations based on a deep-learning interatomic potential, and continuum field modelling. This discovery expands the field of chiral topologies into antiferroelectrics.
title Vortices and antivortices in antiferroelectric PbZrO3
topic Materials Science
url https://arxiv.org/abs/2502.05852