Wird geladen...

First Principles Study on the CO Oxidation on Mn-Embedded Divacancy Graphene

The CO oxidation mechanism on graphene with divacancy (DG) embedded with transition metal from Sc to Zn has been studied by using first principles calculations. The results indicate that O(2) molecule is preferentially adsorbed on Sc, Ti, V, Cr, Mn, and Fe-DG, which can avoid the CO poisoning proble...

Ausführliche Beschreibung

Gespeichert in:
Bibliographische Detailangaben
Veröffentlicht in:Front Chem
Hauptverfasser: Jiang, Quanguo, Zhang, Jianfeng, Ao, Zhimin, Huang, Huajie, He, Haiyan, Wu, Yuping
Format: Artigo
Sprache:Inglês
Veröffentlicht: Frontiers Media S.A. 2018
Schlagworte:
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC5992397/
https://ncbi.nlm.nih.gov/pubmed/29911100
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3389/fchem.2018.00187
Tags: Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!