GSTDTAP  > 资源环境科学
DOI10.1038/s41467-018-05313-2
Competition between proton transfer and intermolecular Coulombic decay in water
Richter, Clemens1; Hollas, Daniel2; Saak, Clara-Magdalena3; Foerstel, Marko4,7; Miteva, Tsveta5; Mucke, Melanie3; Bjorneholm, Olle3; Sisourat, Nicolas5; Slavicek, Petr2; Hergenhahn, Uwe1,6
2018-11-26
发表期刊NATURE COMMUNICATIONS
ISSN2041-1723
出版年2018
卷号9
文章类型Article
语种英语
国家Germany; Czech Republic; Sweden; France
英文摘要

Intermolecular Coulombic decay (ICD) is a ubiquitous relaxation channel of electronically excited states in weakly bound systems, ranging from dimers to liquids. As it is driven by electron correlation, it was assumed that it will dominate over more established energy loss mechanisms, for example fluorescence. Here, we use electron-electron coincidence spectroscopy to determine the efficiency of the ICD process after 2a(1) ionization in water clusters. We show that this efficiency is surprisingly low for small water clusters and that it gradually increases to 40-50% for clusters with hundreds of water units. Ab initio molecular dynamics simulations reveal that proton transfer between neighboring water molecules proceeds on the same timescale as ICD and leads to a configuration in which the ICD channel is closed. This conclusion is further supported by experimental results from deuterated water. Combining experiment and theory, we infer an intrinsic ICD lifetime of 12-52 fs for small water clusters.


领域资源环境
收录类别SCI-E
WOS记录号WOS:000451176100013
WOS关键词GAUSSIAN-BASIS SETS ; RELAXATION PROCESSES ; LIQUID WATER ; ELECTRON ; FRAGMENTATION ; IONIZATION ; DYNAMICS ; AMMONIA ; PHOTOEMISSION
WOS类目Multidisciplinary Sciences
WOS研究方向Science & Technology - Other Topics
URL查看原文
引用统计
文献类型期刊论文
条目标识符http://119.78.100.173/C666/handle/2XK7JSWQ/203887
专题资源环境科学
作者单位1.Leibniz Inst Surface Engn IOM, Permoserstr 15, D-04318 Leipzig, Germany;
2.Univ Chem & Technol Prague, Dept Phys Chem, Tech 5, Prague 16628 6, Czech Republic;
3.Uppsala Univ, Dept Phys & Astron, Box 516751 20, Uppsala, Sweden;
4.Max Planck Inst Plasma Phys, Boltzmannstr 2, D-85748 Garching, Germany;
5.Sorbonne Univ, Lab Chim Phys Matiere & Rayonnement, CNRS, UMR 7614, F-75005 Paris, France;
6.Max Planck Inst Plasma Phys, Wendelsteinstr 1, D-17491 Greifswald, Germany;
7.Tech Univ Berlin, Inst Opt & Atom Phys, Hardenbergstr 36, D-10623 Berlin, Germany
推荐引用方式
GB/T 7714
Richter, Clemens,Hollas, Daniel,Saak, Clara-Magdalena,et al. Competition between proton transfer and intermolecular Coulombic decay in water[J]. NATURE COMMUNICATIONS,2018,9.
APA Richter, Clemens.,Hollas, Daniel.,Saak, Clara-Magdalena.,Foerstel, Marko.,Miteva, Tsveta.,...&Hergenhahn, Uwe.(2018).Competition between proton transfer and intermolecular Coulombic decay in water.NATURE COMMUNICATIONS,9.
MLA Richter, Clemens,et al."Competition between proton transfer and intermolecular Coulombic decay in water".NATURE COMMUNICATIONS 9(2018).
条目包含的文件
条目无相关文件。
个性服务
推荐该条目
保存到收藏夹
查看访问统计
导出为Endnote文件
谷歌学术
谷歌学术中相似的文章
[Richter, Clemens]的文章
[Hollas, Daniel]的文章
[Saak, Clara-Magdalena]的文章
百度学术
百度学术中相似的文章
[Richter, Clemens]的文章
[Hollas, Daniel]的文章
[Saak, Clara-Magdalena]的文章
必应学术
必应学术中相似的文章
[Richter, Clemens]的文章
[Hollas, Daniel]的文章
[Saak, Clara-Magdalena]的文章
相关权益政策
暂无数据
收藏/分享
所有评论 (0)
暂无评论
 

除非特别说明,本系统中所有内容都受版权保护,并保留所有权利。