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A Systemic Insight into Exohedral Actinides and Endohedral Borospherenes: An&B(m) and An@B(n) (An=U, Np, Pu; m = 28, 32, 34, 36, 38, 40; n = 36, 38, 40)
A series of exohedral actinide borospherenes, An&B(m), and endohedral borospherenes, An@B(n) (An=U, Np, Pu; m = 28, 32, 34, 36, 38, 40; n = 36, 38, 40), have been characterized by density functional theory calculations. The electronic structures, chemical bond topological properties and spectra...
Autores principales: | , , , , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9500945/ https://www.ncbi.nlm.nih.gov/pubmed/36144778 http://dx.doi.org/10.3390/molecules27186047 |