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Effect of Stone–Wales defects and transition-metal dopants on arsenene: a DFT study

The structural, electronic, and magnetic properties of 3d transition metal (TM) atom (Sc, V, Cr, Mn, Co, and Cu) doped Stone–Wales (SW) defect arsenene were systematically investigated by density functional theory (DFT). The results indicated that the properties of arsenene were effectively changed...

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Detalles Bibliográficos
Autores principales: Li, Jialin, Zhou, Qingxiao, Ju, Weiwei, Zhang, Qian, Liu, Yanling
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9064895/
https://www.ncbi.nlm.nih.gov/pubmed/35516850
http://dx.doi.org/10.1039/c9ra03721g