Exploring the Non-Covalent Bonding in Water Clusters

Exploring the Non-Covalent Bonding in Water Clusters

QTAIM and source function analysis were used to explore the non-covalent bonding in twelve different water clusters (H<sub>2</sub>O)<i><sub>n</sub></i> obtained by considering <i>n</i> = 2–7 and various geometrical arrangements. A total of seventy-seve...

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Bibliographic Details
Main Authors:	Luis E. Seijas, Cesar H. Zambrano, Rafael Almeida, Jorge Alí-Torres, Luis Rincón, Fernando Javier Torres
Format:	Article
Language:	English
Published:	MDPI AG 2023-03-01
Series:	International Journal of Molecular Sciences
Subjects:	non-covalent interactions hydrogen bonds QTAIM source function
Online Access:	https://www.mdpi.com/1422-0067/24/6/5271

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