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Probing the Structural, Electronic, and Magnetic Properties of Ag(n)V (n = 1–12) Clusters

The structural, electronic, and magnetic properties of Ag(n)V (n = 1–12) clusters have been studied using density functional theory and CALYPSO structure searching method. Geometry optimizations manifest that a vanadium atom in low-energy Ag(n)V clusters favors the most highly coordinated location....

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Detalles Bibliográficos
Autores principales: Xiong, Ran, Die, Dong, Xiao, Lu, Xu, Yong-Gen, Shen, Xu-Ying
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer US 2017
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5732125/
https://www.ncbi.nlm.nih.gov/pubmed/29247393
http://dx.doi.org/10.1186/s11671-017-2394-0

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