Toward Fundamentals of Confined Catalysis in Carbon Nanotubes
文献类型：期刊论文
| 作者 | Xiao, Jianping; Pan, Xiulian; Guo, Shujing; Ren, Pengju; Bao, Xinhe |
| 刊名 | journal of the american chemical society
 |
| 出版日期 | 2015-01-14 |
| 卷号 | 137期号:1页码:477-482 |
| 英文摘要 | an increasing number of experimental studies have demonstrated that metal or metal oxide nanoparticles confined inside carbon nanotubes (cnts) exhibit different catalytic activities with respect to the same metals deposited on the cnt exterior walls, with some reactions enhanced and others hindered. in this article, we describe the concept of confinement energy, which enables prediction of confinement effects on catalytic activities in different reactions. combining density functional theory calculations and experiments by taking typical transition metals such as fe, feco, rhmn, and ru as models, we observed stronger strains and deformations within the cnt channels due to different electronic structures and spatial confinement. this leads to downshifted d-band states, and consequently the adsorption of molecules such as co, n-2, and o-2 is weakened. thus, the confined space of cnts provides essentially a unique microenvironment due to the electronic effects, which shifts the volcano curve of the catalytic activities toward the metals with higher binding energies. the extent of the shift depends on the specific metals and the cnt diameters. this concept generalizes the diverse effects observed in experiments for different reactions, and it is anticipated to be applicable to an even broader range of reactions other than redox of metal species, co hydrogenation, ammonia synthesis and decomposition discussed here. |
| WOS标题词 | science & technology ; physical sciences |
| 类目[WOS] | chemistry, multidisciplinary |
| 研究领域[WOS] | chemistry |
| 关键词[WOS] | metal-organic framework ; evans-polanyi relation ; heterogeneous catalysis ; ru nanoparticles ; volcano curve ; co ; activation ; iron ; dissociation ; electrodes |
| 收录类别 | SCI |
| 语种 | 英语 |
| WOS记录号 | WOS:000348483500078 |
| 公开日期 | 2016-05-09 |
| 源URL | [http://cas-ir.dicp.ac.cn/handle/321008/145937]  |
| 专题 | 大连化学物理研究所_中国科学院大连化学物理研究所 |
| 作者单位 | Chinese Acad Sci, Dalian Inst Chem Phys, State Key Lab Catalysis, Dalian 116023, Peoples R China |
| 推荐引用方式 GB/T 7714 | Xiao, Jianping,Pan, Xiulian,Guo, Shujing,et al. Toward Fundamentals of Confined Catalysis in Carbon Nanotubes[J]. journal of the american chemical society,2015,137(1):477-482. |
| APA | Xiao, Jianping,Pan, Xiulian,Guo, Shujing,Ren, Pengju,&Bao, Xinhe.(2015).Toward Fundamentals of Confined Catalysis in Carbon Nanotubes.journal of the american chemical society,137(1),477-482. |
| MLA | Xiao, Jianping,et al."Toward Fundamentals of Confined Catalysis in Carbon Nanotubes".journal of the american chemical society 137.1(2015):477-482. |
入库方式： OAI收割
来源：大连化学物理研究所
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