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Xiang He

Nanjing University

14

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266

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Does confinement effect always enhance catalytic activity? A theoretical study of H2 dissociation on CNT supported gold clusters

2011 Catalysis Today
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Zinc coverage dependent structure of PdZn surface alloy

2011 Physical Chemistry Chemical Physics
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Communication: Emergence of localized magnetic moment at adsorbed beryllium dimer on graphene.

2010 Journal of Chemical Physics
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Theoretical Study on the Possibility of Using Frustrated Lewis Pairs as Bifunctional Metal-Free Dehydrogenation Catalysts of Ammonia−Borane

2010 Inorganic Chemistry
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A theoretical study of the water gas shift reaction mechanism on Cu(111) model system

2009 Surface Science
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A theoretical study of the effects of the charge state and size of gold clusters on the adsorption and dissociation of H2.

2009 Journal of Chemical Physics
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The Spontaneous Generation of Magnetic Moment of Beryllium Dimer on Graphene

2009 arXiv: Materials Science
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Hydrogenation of conjugated CC and CO bonds: Quantum chemical preview before metal catalysis

2008 Journal of Molecular Structure-theochem
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Influence of finite chemical potential on the critical number of fermion flavors inQED3_

2006 Physical Review D
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Critical Number of Fermion Flavors at Finite Chemical Potential in QED3The project supported in part by National Natural Science Foundation of China under Grant Nos. 10175033 and 10135030 and the Research Fund for the Doctoral Program of Higher Education under Grant No. 20030284009

2005 Communications in Theoretical Physics
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