期刊
JOURNAL OF PHYSICAL CHEMISTRY A
卷 115, 期 26, 页码 7602-7609出版社
AMER CHEMICAL SOC
DOI: 10.1021/jp203501n
关键词
-
资金
- U.S. Department of Energy [DE-FG02-96ER14658]
- U.S. Department of Energy (DOE) [DE-FG02-96ER14658] Funding Source: U.S. Department of Energy (DOE)
Singly and doubly charged manganese water cations, and their mixed complexes with attached argon atoms, are produced by laser vaporization in a pulsed nozzle source. Complexes of the form Mn+(H2O)Ar-n (n = 1-4) and Mn2+(H2O)Ar-4 are studied via mass-selected infrared photodissociation spectroscopy, detected in the mass channels corresponding to the elimination of argon. Sharp resonances are detected for all complexes in the region of the symmetric and asymmetric stretch vibrations of water. With the guidance of density functional theory computations, specific vibrational band resonances are assigned to complexes having different argon attachment configurations. In the small singly charged complexes, argon adds first to the metal ion site and later in larger clusters to the hydrogens of water. The doubly charged complex has argon only on the metal ion. Vibrations in all of these complexes are shifted to lower frequencies than those of the free water molecule. These shifts are greater when argon is attached to hydrogen and also greater for the dication compared to the singly charged species. Cation binding also causes the IR intensities for water vibrations to be much greater than those of the free water molecule, and the relative intensities are greater for the symmetric stretch than the asymmetric stretch. This latter effect is also enhanced for the dication complex.
作者
我是这篇论文的作者
点击您的名字以认领此论文并将其添加到您的个人资料中。
推荐
暂无数据