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The Effect of Environment on the Reaction of Water on the Ceria(111) Surface: A DFT plus U Study

Yang, Zongxian^*; Wang, Qinggao; Wei, Shuyi; Ma, Dongwei; Sun, Qiang

Journal of Physical Chemistry C, 2010, 114(35): 14891-14899.

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The synergistic effects of the Cu-CeO2(111) catalysts on the adsorption and dissociation of water molecules

Yang, Zongxian^*; Wang, Qinggao; Wei, Shuyi

Physical Chemistry Chemical Physics, 2011, 13(20): 9363-9373.

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The effect of Zr-doping on the interaction of water molecules with the ceria (111) surface

Yang, Zongxian^*; Wang, Qinggao; Wei, Shuyi

Surface Science, 2011, 605(3-4): 351-360.

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First-principles study on the incipient oxidization of Nb(110)

Wang, Qing-Gao^*; Shang, Jia-Xiang

Journal of Physics: Condensed Matter , 2012, 24(22): 225005.

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DFT plus U Study on the Interaction of Water Molecule and Ceria (111) Surface

Wang Qing-Gao; Yang Zong-Xian^*; Wei Shu-Yi

Acta Physico - Chimica Sinica, 2009, 25(12): 2513-2518.

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First-Principles Study on the Initial Oxidization of a Nb(100) Surface

Wang, Qing-Gao; Shang, Jia-Xiang^*; Yang, Zongxian

JOURNAL OF PHYSICAL CHEMISTRY C, 2012, 116(44): 23371-23376.

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Effects of O Atom Coverage on the Dissociation of O-2 Molecules on the Nb(110) Surface

Wang Qing-Gao; Shang Jia-Xiang^*

ACTA PHYSICO-CHIMICA SINICA, 2013, 29(2): 365-370.

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