期刊
JOURNAL OF PHYSICAL CHEMISTRY C
卷 122, 期 5, 页码 2624-2631出版社
AMER CHEMICAL SOC
DOI: 10.1021/acs.jpcc.7b12156
关键词
-
资金
- EU through the European Regional Development Fund [TK141, 2020.4.01.15-0011]
- Estonian Research Council [IUT20-13]
- Estonian Personal Research Project [PUT1107]
- short-term scientific missions - COST actions [MP1303, CM1206]
- Graduate School of Functional materials and technologies - European Regional Development Fund at the University of Tartu, Estonia
- EPSRC [EP/K000586/1]
- Comunidad de Madrid [LIQUOR-GAS-S2013/MAE-2800]
Carbon materials have a range of properties such as high electrical conductivity, high specific surface area, and mechanical flexibility are relevant for electrochemical applications. Carbon materials are utilized in energy conversion-and-storage devices along with electrolytes of complementary properties. In this work, we study the interaction of highly concentrated electrolytes (ionic liquids) at a model carbon surface (circum-coronene) using density functional theory methods. Our results indicate the decisive role of the dispersion interactions that noticeably strengthen the circumcoronene-ion interaction. Also, we focus on the adsorption of halide anions as the electrolytes containing these ions are promising for practical use in supercapacitors and solar cells.
作者
我是这篇论文的作者
点击您的名字以认领此论文并将其添加到您的个人资料中。
推荐
暂无数据