Reaction Mechanisms of Well-Defined Metal-N-4 Sites in Electrocatalytic CO2 Reduction
文献类型：期刊论文
| 作者 | Zhang, Z; Xiao, JP; Chen, XJ; Yu, S; Yu, L; Si, R; Wang, Y; Wang, SH; Meng, XG; Wang, Y |
| 刊名 | ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
 |
| 出版日期 | 2018 |
| 卷号 | 57期号:50页码:16339-16342 |
| 关键词 | ELECTROREDUCTION PHTHALOCYANINE CONVERSION CATALYSIS PORPHYRIN METHANE |
| ISSN号 | 1433-7851 |
| DOI | 10.1002/anie.201808593 |
| 文献子类 | 期刊论文 |
| 英文摘要 | Electrocatalytic CO2 reduction to CO emerges as a potential route of utilizing emitted CO2. Metal-N-C hybrid structures have shown unique activities, however, the active centers and reaction mechanisms remain unclear because of the ambiguity in true atomic structures for the prepared catalysts. Herein, combining density-functional theory calculations and experimental studies, the reaction mechanisms for well-defined metal-N-4 sites were explored using metal phthalocyanines as model catalysts. The theoretical calculations reveal that cobalt phthalocyanine exhibits the optimum activity for CO2 reduction to CO because of the moderate *CO binding energy at the Co site, which accommodates the *COOH formation and the *CO desorption. It is further confirmed by experimental studies, where cobalt phthalocyanine delivers the best performance, with a maximal CO Faradaic efficiency reaching 99%, and maintains stable performance for over 60 hours. |
| 语种 | 英语 |
| 源URL | [http://ir.sinap.ac.cn/handle/331007/31084]  |
| 专题 | 上海应用物理研究所_中科院上海应用物理研究所2011-2017年 |
| 作者单位 | 1.Chinese Acad Sci, Dalian Inst Chem Phys, Collaborat Innovat Ctr Chem Energy Mat iChEM, State Key Lab Catalysis, Dalian 116023, Peoples R China 2.Xiamen Univ, Coll Chem & Chem Engn, Collaborat Innovat Ctr Chem Energy Mat iChEM, State Key Lab Phys Chem Solid Surfaces, Xiamen 361005, Peoples R China 3.Westlake Univ, Sch Sci, Westlake Inst Adv Study, Inst Nat Sci, Hangzhou 310024, Zhejiang, Peoples R China 4.Chinese Acad Sci, Shanghai Inst Appl Phys, Shanghai Synchrotron Radiat Facil, Shanghai 201204, Peoples R China |
| 推荐引用方式 GB/T 7714 | Zhang, Z,Xiao, JP,Chen, XJ,et al. Reaction Mechanisms of Well-Defined Metal-N-4 Sites in Electrocatalytic CO2 Reduction[J]. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION,2018,57(50):16339-16342. |
| APA | Zhang, Z.,Xiao, JP.,Chen, XJ.,Yu, S.,Yu, L.,...&Deng, DH.(2018).Reaction Mechanisms of Well-Defined Metal-N-4 Sites in Electrocatalytic CO2 Reduction.ANGEWANDTE CHEMIE-INTERNATIONAL EDITION,57(50),16339-16342. |
| MLA | Zhang, Z,et al."Reaction Mechanisms of Well-Defined Metal-N-4 Sites in Electrocatalytic CO2 Reduction".ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 57.50(2018):16339-16342. |
入库方式： OAI收割
来源：上海应用物理研究所
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