Structure and bonding of water on Pt(111)

被引:493
作者
Ogasawara, H [1 ]
Brena, B
Nordlund, D
Nyberg, M
Pelmenschikov, A
Pettersson, LGM
Nilsson, A
机构
[1] Stockholm Univ, Albanova Univ Ctr, FYSIKUM, S-10691 Stockholm, Sweden
[2] Uppsala Univ, Dept Phys, S-75121 Uppsala, Sweden
[3] Stanford Synchrotron Radiat Lab, Menlo Pk, CA 94025 USA
关键词
D O I
10.1103/PhysRevLett.89.276102
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
We address the adsorption of water on Pt(111) using x-ray absorption, x-ray emission, and x-ray photoelectron spectroscopy along with calculations in the framework of density functional theory. Using the direct relationship between the electronic structure and adsorbate geometry, we show that in the first layer all the molecules bind directly to the surface and to each other through the in-layer H bonds without dissociation, creating a nearly flat overlayer. The water molecules are adsorbed through alternating metal-oxygen (M-O) and metal-hydrogen (M-HO) bonds.
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页数:4
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