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On the Nature of the Bonding in Coinage Metal Halides

This article analyzes the nature of the chemical bond in coinage metal halides using high-level ab initio Valence Bond (VB) theory. It is shown that these bonds display a large Charge-Shift Bonding character, which is traced back to the large Pauli pressure arising from the interaction between the b...

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Detalles Bibliográficos
Autores principales: Đorđević, Slađana, Radenković, Slavko, Shaik, Sason, Braïda, Benoît
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8780489/
https://www.ncbi.nlm.nih.gov/pubmed/35056805
http://dx.doi.org/10.3390/molecules27020490