English

Giant electro-optic and elasto-optic effects in ferroelectric NbOI$_{2}$

Materials Science 2024-09-10 v1

Abstract

First-principles calculations are performed to investigate the electro-optic (EO) and elasto-optic effects of the three-dimensional (bulk) and two-dimensional (monolayer) ferroelectric NbOI2_{2}. Remarkably large linear EO and elasto-optic coefficients are discovered in both systems, when under stress-free conditions. We further found that the EO responses of bulk and monolayer NbOI2_{2} can be further enhanced with epitaxial strain, because of a strain-driven ferroelectric-to-paraelectric transition that originates from the softening of some polar optical modes. Our findings thus point out that NbOI2_{2}, as well as other niobium oxide dihalides are highly promising for paving the way for potentially efficient nonlinear optical device applications.

Keywords

Cite

@article{arxiv.2408.04225,
  title  = {Giant electro-optic and elasto-optic effects in ferroelectric NbOI$_{2}$},
  author = {Zhenlong Zhang and Xuehan Di and Charles Paillard and Laurent Bellaiche and Zhijun Jiang},
  journal= {arXiv preprint arXiv:2408.04225},
  year   = {2024}
}

Comments

6 pages, 3 figures

R2 v1 2026-06-28T18:07:19.499Z