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First-principles study of two dimensional C(3)N and its derivatives

Here we have performed a comprehensive first-principles study for electronic and mechanical properties of newly synthesized C(3)N and its derivatives. The C(3)N monolayer is evaluated to be an indirect semiconductor with a HSE06 level bandgap of 1.09 eV, which can be effectively tuned by the number...

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Detalles Bibliográficos
Autores principales: Chen, Zhao, Wang, Haidi, Li, ZhongJun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9056723/
https://www.ncbi.nlm.nih.gov/pubmed/35515052
http://dx.doi.org/10.1039/d0ra06534j