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Resonant Ionic, Covalent Bond, and Steric Characteristics Present in (1)Σ(u)(+) States of Li(2)

The molecular bonding in the excited states of the alkali dimers involves the resonant ionic, covalent bond and steric interactions. We show here the case of the (1)Σ(u)(+) states of Li(2) by ab initio calculation. These interactions as functions of the internuclear distance lead to complex potentia...

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Detalles Bibliográficos
Autores principales: Ahn Furudate, Michiko, Hagebaum-Reignier, Denis, Kim, Jin-Tae, Jeung, Gwang-Hi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9182501/
https://www.ncbi.nlm.nih.gov/pubmed/35684453
http://dx.doi.org/10.3390/molecules27113514