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Photoelectron Imaging and Theoretical Study on Nascent Hydrogen Bond Network in Microsolvated Clusters of Au-(CH3OH)(n) (n=1-5)
文献类型：期刊论文
| 作者 | Qin, Zhengbo; Cong, Ran; Xie, Hua; Liu, Zhiling; Wu, Xia; Tang, Zichao; Jiang, Ling; Fan, Hongjun |
| 刊名 | journal of physical chemistry a
 |
| 出版日期 | 2014-05-15 |
| 卷号 | 118期号:19页码:3402-3409 |
| 英文摘要 | we first demonstrate the photoelectron spectroscopic evidence of the transition of two competitive solvation patterns in the au-(ch3oh)(n) (n = 1-5) clusters. quantum chemical calculations have been carried out to characterize the geometric structures, energy properties and hydrogen-bonded patterns, and to aid the spectral assignment. it has been found that the nonconventional hydrogen bonds dominate the small clusters (n = 1 and 2), whereas the conventional hydrogen bonds play more and more important role from n = 2 to n = 5. this finding provides concrete hydrogen bond network evolution of au- surrounded by methanol molecules. |
| WOS标题词 | science & technology ; physical sciences |
| 类目[WOS] | chemistry, physical ; physics, atomic, molecular & chemical |
| 研究领域[WOS] | chemistry ; physics |
| 关键词[WOS] | ab-initio calculations ; cations infrared-spectroscopy ; metal-ion complexes ; gas-phase ; gold clusters ; basis-sets ; alkaline-earth ; atomic oxygen ; solvation ; water |
| 收录类别 | SCI |
| 语种 | 英语 |
| WOS记录号 | WOS:000336199500002 |
| 公开日期 | 2016-05-09 |
| 源URL | [http://cas-ir.dicp.ac.cn/handle/321008/145920]  |
| 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 Mol React Dynam, Dalian 116023, Peoples R China |
| 推荐引用方式 GB/T 7714 | Qin, Zhengbo,Cong, Ran,Xie, Hua,et al. Photoelectron Imaging and Theoretical Study on Nascent Hydrogen Bond Network in Microsolvated Clusters of Au-(CH3OH)(n) (n=1-5)[J]. journal of physical chemistry a,2014,118(19):3402-3409. |
| APA | Qin, Zhengbo.,Cong, Ran.,Xie, Hua.,Liu, Zhiling.,Wu, Xia.,...&Fan, Hongjun.(2014).Photoelectron Imaging and Theoretical Study on Nascent Hydrogen Bond Network in Microsolvated Clusters of Au-(CH3OH)(n) (n=1-5).journal of physical chemistry a,118(19),3402-3409. |
| MLA | Qin, Zhengbo,et al."Photoelectron Imaging and Theoretical Study on Nascent Hydrogen Bond Network in Microsolvated Clusters of Au-(CH3OH)(n) (n=1-5)".journal of physical chemistry a 118.19(2014):3402-3409. |
入库方式： OAI收割
来源：大连化学物理研究所
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