Efficient Band Structure Unfolding with Atom-centered Orbitals: General Theory and Application

Fuente: arXiv

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Bibliographic Details
Main Authors:	Quan, Jingkai, Rybin, Nikita, Scheffler, Matthias, Carbogno, Christian
Format:	Preprint
Published:	2025
Subjects:	Materials Science
Online Access:	Acceder al recurso
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Internet

https://arxiv.org/abs/2506.21089