Computer-generated character tables and nuclear spin statistical weights: application to benzene dimer and methane dimer

2004/04/20 by Roman Schmied, Kevin K. Lehmann
Chemistry · Physics and Astronomy · #Advanced Chemical Physics Studies #Molecular Spectroscopy and Structure #Molecular spectroscopy and chirality #physics.chem-ph

paper · pdf · doi:10.1016/j.jms.2004.04.003

published as Journal of Molecular Spectroscopy 226 (2004) 201-202 · accepted for publication in the Journal of Molecular Spectroscopy

arxiv created 2004/04/20 · openalex publication_date 2004/05/13 · arxiv updated 2009/12/01 · openalex created_date 2025/10/10 · openalex updated_date 2026/07/28

Abstract

A short GAP computer program is presented for computing nuclear spin statistical weights of rovibronic symmetry species in polyatomic molecules. As examples, benzene dimer and methane dimer are discussed.

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