MoireStudio: A Universal Twisted Electronic Structure Calculation Package

Fuente: arXiv
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Auteurs principaux: Yu, Junxi, Liu, Yichen, Liu, Cheng-Cheng
Format: Preprint
Publié: 2026
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author Yu, Junxi
Liu, Yichen
Liu, Cheng-Cheng
author_facet Yu, Junxi
Liu, Yichen
Liu, Cheng-Cheng
contents Twistronics is an emerging and captivating field in condensed matter physics and material science. However, accurately and efficiently calculating the electronic structures of twisted systems remains a significant challenge. To address this, we have developed MoireStudio, a universal Python-based computational package for twisted electronic structures. Its functionalities include commensurate structure search, structure generation, parameterization, and construction for tight-binding models and continuum models, and the precise incorporation of full relaxation effects. The package is applicable to arbitrary combinations of two-dimensional materials, including rectangular lattices and heterostructures. User-friendly and easy to use, MoireStudio supports parallel large-scale computations, provides visualization capabilities, and offers interfaces with third-party software. It is poised to become a convenient and powerful tool for researchers in twistronics fields.
format Preprint
id arxiv_https___arxiv_org_abs_2602_09739
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle MoireStudio: A Universal Twisted Electronic Structure Calculation Package
Yu, Junxi
Liu, Yichen
Liu, Cheng-Cheng
Materials Science
Twistronics is an emerging and captivating field in condensed matter physics and material science. However, accurately and efficiently calculating the electronic structures of twisted systems remains a significant challenge. To address this, we have developed MoireStudio, a universal Python-based computational package for twisted electronic structures. Its functionalities include commensurate structure search, structure generation, parameterization, and construction for tight-binding models and continuum models, and the precise incorporation of full relaxation effects. The package is applicable to arbitrary combinations of two-dimensional materials, including rectangular lattices and heterostructures. User-friendly and easy to use, MoireStudio supports parallel large-scale computations, provides visualization capabilities, and offers interfaces with third-party software. It is poised to become a convenient and powerful tool for researchers in twistronics fields.
title MoireStudio: A Universal Twisted Electronic Structure Calculation Package
topic Materials Science
url https://arxiv.org/abs/2602.09739