\texttt{IrRep}: symmetry eigenvalues and irreducible representations of \textit{ab initio} band structures

DOI10.1016/J.CPC.2021.108226arXiv2009.01764OpenAlexW3214696817MaRDI QIDQ6102000

Barry Bradlyn, Matthew K. Horton, Titus Neupert, Juan L. Mañes, Stepan S. Tsirkin, Mikel Iraola, Maia G. Vergniory

Publication date: 20 June 2023

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://arxiv.org/abs/2009.01764

zbMATH Keywords

symmetrytopologyirreducible representationsDFTbandstructure

Mathematics Subject Classification ID

Quantum theory (81-XX) Statistical mechanics, structure of matter (82-XX)

Related Items (2)

\textsf{MSGCorep}: a package for corepresentations of magnetic space groups ⋮ \textsf{MagneticKP}: a package for quickly constructing \(\boldsymbol{k}\cdot\boldsymbol{p}\) models of magnetic and non-magnetic crystals

Cites Work

• Beyond Dirac and Weyl fermions: Unconventional quasiparticles in conventional crystals
• Theory of Brillouin Zones and Symmetry Properties of Wave Functions in Crystals
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