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Theoretical study on NO(x) adsorption properties over the α-MnO(2)(110) surface

Herein, α-MnO(2) was studied as an adsorbent for the removal of NO(x) (NO, NO(2)) derived from flue gas. First-principles calculations based on the density functional theory (DFT) were performed to investigate the NO(x) adsorption properties over the α-MnO(2)(110) surface. NO strongly adsorbed over...

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Detalles Bibliográficos
Autores principales: Hao, Xingguang, Song, Xin, Li, Kai, Wang, Chi, Li, Kunlin, Li, Yuan, Sun, Xin, Ning, Ping
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/PMC9050150/
https://www.ncbi.nlm.nih.gov/pubmed/35497226
http://dx.doi.org/10.1039/c9ra09455e