AB-Initio Methods in Calculations of Intermolecular Interaction Energies

Kołos, Włodzimierz

doi:10.1007/978-94-009-7950-5_17

Włodzimierz Kołos³

Part of the book series: International Academy of Quantum Molecular Science ((QUCH,volume 4))

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Abstract

A general formulation of the perturbation theory approach to intermolecular interactions is presented and recent progress in computations of various interaction energy components, mostly for model systems, is discussed. In the second part a review is given of the recent work on the nonadditivity of interactions between closed-shell systems.

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Quantum Chemistry Laboratory, Department of Chemistry, University of Warsaw, 02-093, Warsaw, Poland
Włodzimierz Kołos

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Włodzimierz Kołos
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Department of Quantum Chemistry, Uppsala University, Uppsala, Sweden
Per-Olov Löwdin
Institut de Biologie Physico-Chimique, Paris, France
Bernard Pullman

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Kołos, W. (1983). AB-Initio Methods in Calculations of Intermolecular Interaction Energies. In: Löwdin, PO., Pullman, B. (eds) New Horizons of Quantum Chemistry. International Academy of Quantum Molecular Science, vol 4. Springer, Dordrecht. https://doi.org/10.1007/978-94-009-7950-5_17

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DOI: https://doi.org/10.1007/978-94-009-7950-5_17
Publisher Name: Springer, Dordrecht
Print ISBN: 978-94-009-7952-9
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