A Novel Cobalt(III) Complex with Macrocyclic Triamine Ligand for High Capacity Hydrogen Adsorption
文献类型：期刊论文
| 作者 | Zhu Hai-Yan1,2; Guo Hui3; Li Sai4 |
| 刊名 | CHINESE JOURNAL OF STRUCTURAL CHEMISTRY
 |
| 出版日期 | 2012 |
| 卷号 | 31页码:1322-1328 |
| 关键词 | Hydrogen Adsorption First-principles Calculations Macrocyclic Triamine Ligand Co Complex |
| ISSN号 | 0254-5861 |
| 文献子类 | Article |
| 英文摘要 | The coordination complex of Co(III) based on a macrocyclic triamine ligand 1,4-diacetate-1,4,7-triazacyclodecane (L) has been synthesized and characterized. The metal cation is bonded with three nitrogen atoms and two oxygen atoms of L and one chloride ion to form a distorted octahedral geometry. This complex coordinated with macrocyclic ligand possesses large pore volume that will be contributed to observe high H-2 adsorption. With respect to the first-principles electronic structure calculations, the feasibility to store hydrogen in the complex is explored. Indeed, the complex has shown a very high total H-2 adsorption of 7.2 wt% (wt% = (weight of adsorbed H-2)/(weight of host material)), with a binding energy of 0.03 eV/H-2. |
| WOS关键词 | METAL-ORGANIC FRAMEWORKS ; STORAGE ; ENERGY ; PHYSISORPTION ; MOLECULES ; DENSITY ; CARBON ; ATOMS ; SET |
| 语种 | 英语 |
| WOS记录号 | WOS:000310182900014 |
| 出版者 | CHINESE JOURNAL STRUCTURAL CHEMISTRY |
| 源URL | [http://119.78.100.186/handle/113462/49137]  |
| 专题 | 中国科学院近代物理研究所 |
| 通讯作者 | Zhu Hai-Yan |
| 作者单位 | 1.NW Univ Xian, Inst Modern Phys, Xian 710069, Peoples R China 2.Weinan Teachers Univ, Dept Chem & Chem Engn, Weinan 714000, Peoples R China 3.Shaanxi Univ Chinese Med, Coll Pharm, Xianyang 712046, Peoples R China 4.Xi An Jiao Tong Univ, Sch Mat Sci & Engn, State Key Lab Mech Behav Mat, Xian 710049, Peoples R China |
| 推荐引用方式 GB/T 7714 | Zhu Hai-Yan,Guo Hui,Li Sai. A Novel Cobalt(III) Complex with Macrocyclic Triamine Ligand for High Capacity Hydrogen Adsorption[J]. CHINESE JOURNAL OF STRUCTURAL CHEMISTRY,2012,31:1322-1328. |
| APA | Zhu Hai-Yan,Guo Hui,&Li Sai.(2012).A Novel Cobalt(III) Complex with Macrocyclic Triamine Ligand for High Capacity Hydrogen Adsorption.CHINESE JOURNAL OF STRUCTURAL CHEMISTRY,31,1322-1328. |
| MLA | Zhu Hai-Yan,et al."A Novel Cobalt(III) Complex with Macrocyclic Triamine Ligand for High Capacity Hydrogen Adsorption".CHINESE JOURNAL OF STRUCTURAL CHEMISTRY 31(2012):1322-1328. |
入库方式： OAI收割
来源：近代物理研究所
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