First-principles investigation of adsorption behaviors of small molecules on penta-graphene

The gas-adsorption behaviors of small molecules CO, H(2)O, H(2)S, NH(3), SO(2), and NO on pristine penta-graphene (PG) were investigated using first-principles calculations to explore their potential for use as advanced gas-sensing materials. Results show that, except for CO, H(2)O, H(2)S, NH(3), an...

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Detalles Bibliográficos
Autores principales: Qin, Hongbo, Feng, Chuang, Luan, Xinghe, Yang, Daoguo
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer US 2018
Materias:
Nano Express
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6120855/
https://www.ncbi.nlm.nih.gov/pubmed/30178213
http://dx.doi.org/10.1186/s11671-018-2687-y

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6120855/
https://www.ncbi.nlm.nih.gov/pubmed/30178213
http://dx.doi.org/10.1186/s11671-018-2687-y

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