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Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
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Interaction of Co(m)O(-) (m = 1-3) with water: anion photoelectron spectroscopy and density functional calculations

Ren-Zhong Li1, Hong-Guang Xu, Guo-Jin Cao

  • 1Beijing National Laboratory for Molecular Sciences, Institute of Chemistry, Chinese Academy of Sciences, Beijing 100190, China.

The Journal of Chemical Physics
|October 14, 2011
PubMed

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