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The Adsorption Behavior of Gas Molecules on Co/N Co–Doped Graphene

Herein, we have used density functional theory (DFT) to investigate the adsorption behavior of gas molecules on Co/N(3) co–doped graphene (Co/N(3)–gra). We have investigated the geometric stability, electric properties, and magnetic properties comprehensively upon the interaction between Co/N(3)–gra...

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Detalles Bibliográficos
Autores principales:	Xie, Tingyue, Wang, Ping, Tian, Cuifeng, Zhao, Guozheng, Jia, Jianfeng, Zhao, Chenxu, Wu, Haishun
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2021
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8704436/ https://www.ncbi.nlm.nih.gov/pubmed/34946782 http://dx.doi.org/10.3390/molecules26247700

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