The determination of point groups from imprecise molecular geometries

DOI10.1007/s10910-021-01302-xzbMath1482.92127OpenAlexW3213686083WikidataQ114225649 ScholiaQ114225649MaRDI QIDQ2072222

Peter J. Knowles

Publication date: 26 January 2022

Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1007/s10910-021-01302-x

zbMATH Keywords

symmetrymolecular structurepoint group

Mathematics Subject Classification ID

Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

Related Items (1)

Might molecular symmetry operations exist ``partially?

Uses Software

• MOLPRO
• Symmetrizer

Cites Work

• Unnamed Item
• Generalized chirality and symmetry deficiency
• Continuous symmetry measures: A note in proof of the folding/unfolding method
• Continuous symmetry measures. VI: The relations between polyhedral point-group/subgroup symmetries

This page was built for publication: The determination of point groups from imprecise molecular geometries