MathemaTB: a \textit{Mathematica} package for tight-binding calculations

DOI10.1016/J.CPC.2019.06.003OpenAlexW2949786487MaRDI QIDQ2696546

Peter H. Jacobse

Publication date: 14 April 2023

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

Full work available at URL: https://doi.org/10.1016/j.cpc.2019.06.003

zbMATH Keywords

quantum chemistryelectronic structureband structureHückel methodtight-binding

Mathematics Subject Classification ID

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

Related Items (2)

\texttt{TBPLaS}: a tight-binding package for large-scale simulation ⋮ MathemaTB

Uses Software

• Unnamed Item
• PythTB

Cites Work

• Unnamed Item
• The Band Theory of Graphite
• Simplified LCAO Method for the Periodic Potential Problem

This page was built for publication: MathemaTB: a \textit{Mathematica} package for tight-binding calculations