| アイテムタイプ |
学術雑誌論文 = Journal Article(1) |
| 公開日 |
2024-04-12 |
| 資源タイプ |
|
|
資源タイプ識別子 |
http://purl.org/coar/resource_type/c_6501 |
|
資源タイプ |
journal article |
| タイトル |
|
|
タイトル |
Density Functional Theory Study of CuAg Bimetal Electrocatalyst for CO2RR to Produce CH3OH |
|
言語 |
en |
| その他のタイトル |
|
|
その他のタイトル |
Density Functional Theory Study of CuAg Bimetal Electrocatalyst for CO<inf>2</inf>RR to Produce CH<inf>3</inf>OH |
|
言語 |
en |
| 言語 |
|
|
言語 |
eng |
| 著者 |
Xue, Sensen
Liang, Xingyou
Zhang, Qing
Ren, Xuefeng
Gao, Liguo
馬, 廷麗
Liu, Anmin
|
| 抄録 |
|
|
内容記述タイプ |
Abstract |
|
内容記述 |
Converting superfluous CO2 into value-added chemicals is regarded as a practical approach for alleviating the global warming problem. Powered by renewable electricity, CO2 reduction reactions (CO2RR) have attracted intense interest owing to their favorable efficiency. Metal catalysts exhibit high catalytic efficiency for CO2 reduction. However, the reaction mechanisms have yet to be investigated. In this study, CO2RR to CH3OH catalyzed by CuAg bimetal is theoretically investigated. The configurations and stability of the catalysts and the reaction pathway are studied. The results unveil the mechanisms of the catalysis process and prove the feasibility of CuAg clusters as efficient CO2RR catalysts, serving as guidance for further experimental exploration. This study provides guidance and a reference for future work in the design of mixed-metal catalysts with high CO2RR performance. |
|
言語 |
en |
| 書誌情報 |
en : Catalysts
巻 14,
号 1,
p. 7,
発行日 2023-12-20
|
| 出版社 |
|
|
出版者 |
MDPI |
| DOI |
|
|
関連タイプ |
isIdenticalTo |
|
|
識別子タイプ |
DOI |
|
|
関連識別子 |
https://doi.org/10.3390/catal14010007 |
| ISSN |
|
|
収録物識別子タイプ |
EISSN |
|
収録物識別子 |
2073-4344 |
| 著作権関連情報 |
|
|
権利情報Resource |
https://creativecommons.org/licenses/by/4.0/ |
|
権利情報 |
Copyright (c) 2023 by the authors. Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license. |
| キーワード |
|
|
主題Scheme |
Other |
|
主題 |
CuAg bimetal |
| キーワード |
|
|
主題Scheme |
Other |
|
主題 |
CO2RR |
| キーワード |
|
|
主題Scheme |
Other |
|
主題 |
pathway |
| キーワード |
|
|
主題Scheme |
Other |
|
主題 |
theoretical study |
| 出版タイプ |
|
|
出版タイプ |
VoR |
|
出版タイプResource |
http://purl.org/coar/version/c_970fb48d4fbd8a85 |
| 査読の有無 |
|
|
値 |
yes |
| 研究者情報 |
|
|
URL |
https://hyokadb02.jimu.kyutech.ac.jp/html/100000666_ja.html |
| 論文ID（連携） |
|
|
値 |
10429573 |
| 連携ID |
|
|
値 |
12056 |
10429573.pdf (1.4 MB)
