Photoinduced phase transitions and lattice deformation in 2D NbOX$_{2}$ (X=Cl, Br, I)

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Auteurs principaux: Dansou, Carmel, Paillard, Charles, Bellaiche, Laurent
Format: Preprint
Publié: 2025
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author Dansou, Carmel
Paillard, Charles
Bellaiche, Laurent
author_facet Dansou, Carmel
Paillard, Charles
Bellaiche, Laurent
contents We present a comprehensive investigation of light-induced phase transitions and strain in two-dimensional NbOX$_{2}$ (X = Cl, Br, I) using first-principles calculations. In particular, we identify a light-induced ferroelectric-to-paraelectric phase transition in these 2D systems. Furthermore, we demonstrate the possibility of inducing an antiferroelectric-to-paraelectric transition under illumination. Additionally, we find that these 2D systems exhibit significant photostrictive behavior, adding a new functionality to their already notable optical properties. The ability to control and manipulate ferroelectric order in these nanoscale materials through external stimuli, such as light, holds considerable promise for the development of next-generation electronic and optoelectronic devices.
format Preprint
id arxiv_https___arxiv_org_abs_2503_16787
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Photoinduced phase transitions and lattice deformation in 2D NbOX$_{2}$ (X=Cl, Br, I)
Dansou, Carmel
Paillard, Charles
Bellaiche, Laurent
Materials Science
Mesoscale and Nanoscale Physics
We present a comprehensive investigation of light-induced phase transitions and strain in two-dimensional NbOX$_{2}$ (X = Cl, Br, I) using first-principles calculations. In particular, we identify a light-induced ferroelectric-to-paraelectric phase transition in these 2D systems. Furthermore, we demonstrate the possibility of inducing an antiferroelectric-to-paraelectric transition under illumination. Additionally, we find that these 2D systems exhibit significant photostrictive behavior, adding a new functionality to their already notable optical properties. The ability to control and manipulate ferroelectric order in these nanoscale materials through external stimuli, such as light, holds considerable promise for the development of next-generation electronic and optoelectronic devices.
title Photoinduced phase transitions and lattice deformation in 2D NbOX$_{2}$ (X=Cl, Br, I)
topic Materials Science
Mesoscale and Nanoscale Physics
url https://arxiv.org/abs/2503.16787