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Quantum mechanical basis for Mulliken population analysis

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Publication:703965
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DOI10.1023/B:JOMC.0000044221.23647.20zbMath1056.81086OpenAlexW2055528457WikidataQ62511346 ScholiaQ62511346MaRDI QIDQ703965

Ramon Carbó-Dorca, Patrick Bultinck

Publication date: 12 January 2005

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

Full work available at URL: https://doi.org/10.1023/b:jomc.0000044221.23647.20


zbMATH Keywords

density functionelectron densityatomic chargeLCAO MOMulliken population analysis


Mathematics Subject Classification ID

Closed and approximate solutions to the Schrödinger, Dirac, Klein-Gordon and other equations of quantum mechanics (81Q05) NLS equations (nonlinear Schrödinger equations) (35Q55) Molecular physics (81V55)


Related Items (2)

On the nature of the collective quantum mechanical description of molecular atoms and bonds ⋮ On density function coordinate matrix






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