On the Quantum Chemical Nature of Lead(II) “Lone Pair”

We study the quantum chemical nature of the Lead(II) valence basins, sometimes called the lead “lone pair”. Using various chemical interpretation tools, such as molecular orbital analysis, natural bond orbitals (NBO), natural population analysis (NPA) and electron localization function (ELF) topolog...

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Bibliographic Details
Main Authors: Christophe Gourlaouen, Jean-Philip Piquemal
Format: Article
Language:English
Published: MDPI AG 2021-12-01
Series:Molecules
Subjects:
Online Access:https://www.mdpi.com/1420-3049/27/1/27

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