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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 TiO2(-) with water: photoelectron spectroscopy and density functional calculations

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

  • 1College of Electronics and Information, Xi'an Polytechnic University, Xi'an 710048, China.

The Journal of Chemical Physics
|December 11, 2013
PubMed

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