DESIGNING SUPERHARD MATERIALS BY INCORPORATING BORON INTO HEAVY TRANSITION METALS | |
Liang, YC ; Li, AH ; Zhao, JZ ; Zhang, WQ | |
刊名 | MODERN PHYSICS LETTERS B |
2009 | |
卷号 | 23期号:10页码:1281 |
关键词 | HIGH-PRESSURE OSMIUM DIBORIDE 1ST PRINCIPLES HARD MATERIAL PSEUDOPOTENTIALS NITRIDES RHENIUM |
ISSN号 | 0217-9849 |
通讯作者 | Liang, YC: Shanghai Ocean Univ, Coll Engn Sci & Technol, Shanghai 200090, Peoples R China. |
中文摘要 | A new cyclic guanidinium ionic liquid OGI (1,3-dimethyl-2-N ''-methyl-N ''-octylimidazoguanidinium iodide) has been used as a quasi-solid-state electrolyte for dye-sensitized solar cells (DSCs), and 6.38% conversion efficiency was achieved at AM 1.5 simulated sunlight (9.81 mW cm(-2)). Further gelation with SiO(2) nanoparticles afforded the solid-state electrolyte, which presented overall conversion efficiency of 5.85%. The diffusion properties of these OGI-based electrolytes were investigated. In the meantime, the optimal structure and ion-pairing interaction in OGI have been proposed by density functional theoretical calculation (DFT) at the B3LYP/6-21G(d,p) level. In view of the experimental and theoretical calculation results, it is suggested that high asymmetry and good charge delocalization of the cyclic guanidinium cation can well restrain the recombination reaction between the injected electrons in the TiO(2) conduction band and I(3)(-) ions through its flexible hydrocarbon group, thus giving relatively high efficiency. |
收录类别 | SCI |
语种 | 英语 |
公开日期 | 2013-09-17 |
内容类型 | 期刊论文 |
源URL | [http://ir.iphy.ac.cn/handle/311004/35798] |
专题 | 物理研究所_物理所公开发表论文_物理所公开发表论文_期刊论文 |
推荐引用方式 GB/T 7714 | Liang, YC,Li, AH,Zhao, JZ,et al. DESIGNING SUPERHARD MATERIALS BY INCORPORATING BORON INTO HEAVY TRANSITION METALS[J]. MODERN PHYSICS LETTERS B,2009,23(10):1281. |
APA | Liang, YC,Li, AH,Zhao, JZ,&Zhang, WQ.(2009).DESIGNING SUPERHARD MATERIALS BY INCORPORATING BORON INTO HEAVY TRANSITION METALS.MODERN PHYSICS LETTERS B,23(10),1281. |
MLA | Liang, YC,et al."DESIGNING SUPERHARD MATERIALS BY INCORPORATING BORON INTO HEAVY TRANSITION METALS".MODERN PHYSICS LETTERS B 23.10(2009):1281. |
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