A wavefunction model to chemical bonding

In this paper we give a brief survey on some specific aspects of a wavefunction model for chemical bonding which are connected to or have been motivated in part by the work of the late István Mayer and colleagues. After a brief description of the early wavefunction models as reflected in Mayer'...

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Veröffentlicht in:	International journal of quantum chemistry 2022-04, Vol.122 (8), p.n/a
Hauptverfasser:	Náray‐Szabó, Gábor, Mezey, Paul G.
Format:	Artikel
Sprache:	eng
Schlagworte:	chemical bond Chemical bonds chemical Hamiltonian Chemistry embedding linear scaling localized orbitals Molecular orbitals Physical chemistry Quantum physics transferability Wave functions
Online-Zugang:	Volltext
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