The holographic principle for latent molecular properties

DOI10.1023/A:1015123710889zbMath1007.92504MaRDI QIDQ1600667

Paul G. Mezey

Publication date: 16 June 2002

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

zbMATH Keywords

reactivityholographic electron density theoremconformational variationselectronic excited statestransition structuresbiochemical activityenergy of activationlatent molecular propertiespotential surfaces

Mathematics Subject Classification ID

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

Related Items (7)

Charge-conserving electron density averaging for a set of nuclear configurations ⋮ Development of molecular fragment interaction method for designing organic ferromagnets ⋮ Function extended spaces ⋮ Unexpected expectation values for latent molecular properties ⋮ Molecular fragment shape variation index for functional groups and the holographic properties of electron density ⋮ A close-up to the bond-breaking and bond-forming using information theory ⋮ Mathematical aspects of the LCAO MO first order density function. IV: A discussion on the connection of Taylor series expansion of electronic density (TSED) function with the holographic electron density theorem (HEDT) and the Hohenberg-Kohn theorem (HKT)

This page was built for publication: The holographic principle for latent molecular properties