SIC OpenIR
Design of Effective Graphene with the TM/O Moiety for the Oxygen Electrode Reaction
Xiao, BB; Liu, HY; Yang, L; Song, EH; Jiang, XB; Jiang, Q
2020
Source PublicationACS APPLIED ENERGY MATERIALS
ISSN2574-0962
Issue1Pages:260
SubtypeArticle
AbstractDevelopment of effective bifunctional electrocatalysts for the oxygen electrode reaction is desirable. In this work, the electrocatalytic performance of transition metals and oxygen (TM/O) codecorated graphene is evaluated by density functional theory calculations. The outstanding NiO2-pen moiety (a NiO2C2 structure with O atoms in the pentatomic ring) is screened out due to its low overpotential and good stability. Furthermore, the results indicate that the catalytic activity of TM/O sites is inversely correlated with the binding energy E-b. The enhanced E-b weakens the adsorption ability and decreases the corresponding overpotentials. Our finding provides a rational strategy to design functional carbonbased electrocatalysts.
DOI10.1021/acsaem.9b01457
WOS KeywordREDUCTION REACTION ; TRANSITION-METALS ; ELECTROCHEMICAL REDUCTION ; RATIONAL DESIGN ; COHESIVE ENERGY ; CATALYSTS ; EVOLUTION ; SURFACE ; SINGLE ; ELECTROCATALYSTS
Language英语
WOS Research AreaChemistry ; Energy & Fuels ; Materials Science
PublisherAMER CHEMICAL SOC
Citation statistics
Cited Times:4[WOS]   [WOS Record]     [Related Records in WOS]
Document Type期刊论文
Identifierhttp://ir.sic.ac.cn/handle/331005/28395
Collection中国科学院上海硅酸盐研究所
Recommended Citation
GB/T 7714
Xiao, BB,Liu, HY,Yang, L,et al. Design of Effective Graphene with the TM/O Moiety for the Oxygen Electrode Reaction[J]. ACS APPLIED ENERGY MATERIALS,2020(1):260.
APA Xiao, BB,Liu, HY,Yang, L,Song, EH,Jiang, XB,&Jiang, Q.(2020).Design of Effective Graphene with the TM/O Moiety for the Oxygen Electrode Reaction.ACS APPLIED ENERGY MATERIALS(1),260.
MLA Xiao, BB,et al."Design of Effective Graphene with the TM/O Moiety for the Oxygen Electrode Reaction".ACS APPLIED ENERGY MATERIALS .1(2020):260.
Files in This Item:
There are no files associated with this item.
Related Services
Recommend this item
Bookmark
Usage statistics
Export to Endnote
Google Scholar
Similar articles in Google Scholar
[Xiao, BB]'s Articles
[Liu, HY]'s Articles
[Yang, L]'s Articles
Baidu academic
Similar articles in Baidu academic
[Xiao, BB]'s Articles
[Liu, HY]'s Articles
[Yang, L]'s Articles
Bing Scholar
Similar articles in Bing Scholar
[Xiao, BB]'s Articles
[Liu, HY]'s Articles
[Yang, L]'s Articles
Terms of Use
No data!
Social Bookmark/Share
All comments (0)
No comment.
 

Items in the repository are protected by copyright, with all rights reserved, unless otherwise indicated.