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Reversible Hydrogen Storage Media by g-CN Monolayer Decorated with NLi(4): A First-Principles Study

A two-dimensional graphene-like carbon nitride (g-CN) monolayer decorated with the superatomic cluster NLi(4) was studied for reversible hydrogen storage by first-principles calculations. Molecular dynamics simulations show that the g-CN monolayer has good thermal stability at room temperature. The...

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Detalles Bibliográficos
Autores principales:	Chen, Xihao, Hou, Wenjie, Zhai, Fuqiang, Cheng, Jiang, Yuan, Shuang, Li, Yihan, Wang, Ning, Zhang, Liang, Ren, Jie
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2023
Materias:	Communication
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9964983/ https://www.ncbi.nlm.nih.gov/pubmed/36839015 http://dx.doi.org/10.3390/nano13040647

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