Local information-distance thermodynamics of molecular fragments

DOI10.1002/andp.200310073zbMath1047.81577OpenAlexW1991102168MaRDI QIDQ3043965

Roman F. Nalewajski

Publication date: 10 August 2004

Published in: Annalen der Physik (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1002/andp.200310073

zbMATH Keywords

information theoryirreversible processesmolecular fragmentsElectronic structure theoryFisher information distanceentropy deficiencyHirshfeld atoms-in-moleculeslocal thermodynamics

Mathematics Subject Classification ID

Measures of information, entropy (94A17) Molecular physics (81V55) Irreversible thermodynamics, including Onsager-Machlup theory (82B35)

Related Items (10)

Use of non-additive information measures in exploring molecular electronic structure: Stockholder bonded atoms and role of kinetic energy in the chemical bond ⋮ Many-orbital probabilities and their entropy/information descriptors in orbital communication theory of the chemical bond ⋮ Information-theoretic multiplicities of chemical bond in Shull's model of \(H_2\) ⋮ On phases and interference of local communications in molecules ⋮ Communications in molecules: local and multi-configuration channels and their entropic descriptors of bond multiplicity and composition ⋮ Quantum information approach to electronic equilibria: molecular fragments and \textit{non}-equilibrium thermodynamic description ⋮ Quantum information descriptors in position and momentum spaces ⋮ On \textit{phase}-equilibria in molecules ⋮ Quantum information descriptors and communications in molecules ⋮ Resultant entropy/information, phase/entropy continuity and bond multiplicities in degenerate electronic states

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