Use of Harriman's construction in determining molecular equilibrium states

DOI10.1007/s10910-012-0088-5zbMath1447.81221OpenAlexW2087745054MaRDI QIDQ1936984

Roman F. Nalewajski

Publication date: 11 February 2013

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

Full work available at URL: https://doi.org/10.1007/s10910-012-0088-5

zbMATH Keywords

electronic structure theorydensity-constrained principlesentropic principles for moleculesHarriman-Zumbach-Maschke constructioninformation equilibrium statesnonclassical information measures

Mathematics Subject Classification ID

Electromagnetic interaction; quantum electrodynamics (81V10) Lattice systems (Ising, dimer, Potts, etc.) and systems on graphs arising in equilibrium statistical mechanics (82B20) Molecular physics (81V55) Quantum information, communication, networks (quantum-theoretic aspects) (81P45) Quantum entropies (81P17)

Related Items (9)

Complex entropy and resultant information measures ⋮ 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 ⋮ Exploring molecular equilibria using quantum information measures ⋮ Entropic descriptors of quantum communications in molecules ⋮ 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

Cites Work

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• Local wave-vector, Shannon and Fisher information
• Entropic representation in the theory of molecular electronic structure
• Zur wellenmechanischen Behandlung von Vielkörperproblemen

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