Bounds on molecular properties of systems: first-order properties

DOI10.46793/MATCH.92-2.371FMaRDI QIDQ6562220FDOQ6562220

Authors: Patrick W. Fowler, Barry T. Pickup 

Publication date: 26 June 2024

Published in: MATCH - Communications in Mathematical and in Computer Chemistry (Search for Journal in Brave)

zbMATH Keywords

boundsmolecular properties

Mathematics Subject Classification ID

Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10) Chemical graph theory (05C92)

Cites Work

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• The electronic structure of conjugated systems II. Unsaturated hydrocarbons and their hetero-derivatives
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• What is the meaning of the graph energy after all?
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• The electronic structure of conjugated systems. VI
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• Graph theory and the Jahn–Teller theorem

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