Structural Evolution of AlN Nanoclusters and the Elemental Chemisorption Characteristics: Atomistic Insight

A theoretical insight into the structural evolution of AlN atomic clusters and the chemisorption of several common alloying elements on a large cluster has been performed in the framework of state-of-the-art density functional theory calculations. We report the findings that the longitudinal growth...

Descripción completa

Detalles Bibliográficos
Autores principales: Nie, Xi, Qian, Zhao, Du, Wenzheng, Lu, Zhansheng, Li, Hu, Ahuja, Rajeev, Liu, Xiangfa
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2019
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6835681/
https://www.ncbi.nlm.nih.gov/pubmed/31590310
http://dx.doi.org/10.3390/nano9101420

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6835681/
https://www.ncbi.nlm.nih.gov/pubmed/31590310
http://dx.doi.org/10.3390/nano9101420

Ejemplares similares