Structures and magnetic properties of CrSin- (n=3-12) clusters: Photoelectron spectroscopy and density functional calculations
文献类型：期刊论文
| 作者 | Kong, Xiangyu; Xu, Hong-Guang; Zheng, Weijun |
| 刊名 | journal of chemical physics
 |
| 出版日期 | 2012-08-14 |
| 卷号 | 137期号:6 |
| 英文摘要 | chromium-doped silicon clusters, crsin-(n = 3-12), were investigated with anion photoelectron spectroscopy and density functional theory calculations. the combination of experimental measurement and theoretical calculations reveals that the onset of endohedral structure in crsin- clusters occurs at n = 10 and the magnetic properties of the crsin- clusters are correlated to their geometric structures. the most stable isomers of crsin- from n = 3 to 9 have exohedral structures with magnetic moments of 3-5 mu(b) while those of crsi10-, crsi11-, and crsi12- have endohedral structures and magnetic moments of 1 mu(b). (c) 2012 american institute of physics. [http://dx.doi.org/10.1063/1.4742065] |
| 类目[WOS] | physics, atomic, molecular & chemical |
| 研究领域[WOS] | physics |
| 关键词[WOS] | supersonic molecular-beam ; silicon clusters ; electronic-structures ; selective formation ; n=1-6 clusters ; si ; geometries ; cages ; stabilities ; resistors |
| 收录类别 | SCI |
| 语种 | 英语 |
| WOS记录号 | WOS:000308048700025 |
| 公开日期 | 2015-11-17 |
| 源URL | [http://159.226.238.44/handle/321008/142854]  |
| 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, Inst Chem, State Key Lab Mol React Dynam, Beijing Natl Lab Mol Sci, Beijing 100190, Peoples R China |
| 推荐引用方式 GB/T 7714 | Kong, Xiangyu,Xu, Hong-Guang,Zheng, Weijun. Structures and magnetic properties of CrSin- (n=3-12) clusters: Photoelectron spectroscopy and density functional calculations[J]. journal of chemical physics,2012,137(6). |
| APA | Kong, Xiangyu,Xu, Hong-Guang,&Zheng, Weijun.(2012).Structures and magnetic properties of CrSin- (n=3-12) clusters: Photoelectron spectroscopy and density functional calculations.journal of chemical physics,137(6). |
| MLA | Kong, Xiangyu,et al."Structures and magnetic properties of CrSin- (n=3-12) clusters: Photoelectron spectroscopy and density functional calculations".journal of chemical physics 137.6(2012). |
入库方式： OAI收割
来源：大连化学物理研究所
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