Cargando…

Pairwise Model Potential and DFT Study of Li(+)Ne(n) Clusters (n = 1–20): The Structural, Electronic, and Thermodynamic Properties

[Image: see text] The structural properties, relative stabilities, electronic, and thermodynamic properties, of Li(+)Ne(n) (n = 1–20) clusters have been studied based on a pairwise model and density functional theory (DFT) methods. In the pairwise method, the potential energy surface considered inte...

Descripción completa

Detalles Bibliográficos
Autores principales: Mabrouk, Nesrine, Dhiflaoui, Jamila, Bejaoui, Mohamed, Saidi, Samah, Berriche, Hamid
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10633865/
https://www.ncbi.nlm.nih.gov/pubmed/37970048
http://dx.doi.org/10.1021/acsomega.3c05238