Unexpected expectation values for latent molecular properties

DOI10.1007/S10910-011-9928-YzbMath1243.92058OpenAlexW2082915472MaRDI QIDQ427464

Paul G. Mezey

Publication date: 13 June 2012

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

Full work available at URL: https://doi.org/10.1007/s10910-011-9928-y

zbMATH Keywords

reactivityholographic electron density theoremconformational variationselectronic excited statespotential energy surface extrapolationtransition structures

Mathematics Subject Classification ID

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

Cites Work

• The holographic principle for latent molecular properties
• Unnamed Item

This page was built for publication: Unexpected expectation values for latent molecular properties