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Complexes of HXeY with HX (Y, X = F, Cl, Br, I): Symmetry-Adapted Perturbation Theory Study and Anharmonic Vibrational Analysis

A comprehensive analysis of the intermolecular interaction energy and anharmonic vibrations of 41 structures of the HXeY⋯HX (X, Y = F, Cl, Br, I) family of noble-gas-compound complexes for all possible combinations of Y and X was conducted. New structures were identified, and their interaction energ...

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Detalles Bibliográficos
Autores principales: Dzięcioł, Bartosz, Osadchuk, Irina, Cukras, Janusz, Lundell, Jan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10343308/
https://www.ncbi.nlm.nih.gov/pubmed/37446809
http://dx.doi.org/10.3390/molecules28135148