期刊
CHEMICAL PHYSICS LETTERS
卷 764, 期 -, 页码 -出版社
ELSEVIER
DOI: 10.1016/j.cplett.2020.138241
关键词
C24N24 fullerene; Open-circuit voltage; Alkali metal-ion batteries; Alkali earth metal-ion batteries; DFT calculations
资金
- Shahid Chamran University of Ahvaz, Ahvaz, Iran [SCU.SC98.285]
DFT calculations indicate that C24N24 cavernous nitride fullerene shows promising potential as an anode material for metal-ion batteries, with high storage capacities and suitability for alkali and alkali earth metal-ion batteries.
DFT calculations were carried out to determine the potential application of C24N24 cavernous nitride fullerene for the anode electrode for (Li/Na/K/Mg/Ca)-ion batteries (MIBs). Calculated results suggest the C24N24 fullerene as a promising anode material for all these metal-ion batteries. Furthermore, all six cavities of C24N24 fullerene can be decorated by metals, and the storage capacities of 516 and 258 mAh g(-1) are obtained for this fullerene. Consequently, both high cell voltages an storage capacity suggest the C24N24 fullerene as an appropriate anode material for alkali and alkali earth metal-ion batteries.
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