Dong-bo Cao

发表

Insight into the structure and intrinsic stability of the Keggin and Wells-Dawson neutral cages

Xian‐Ming Zhang, Hai-Shun Wu, H. Jiao, 2005 .

CO2 reforming of CH4 on Ni(111): a density functional theory calculation.

Shengguang Wang, Jianguo Wang, H. Jiao, 2006, The journal of physical chemistry. B.

Kinetic aspect of CO2 reforming of CH4 on Ni(111): A density functional theory calculation

Shengguang Wang, Jianguo Wang, H. Jiao, 2007 .

Reactivity of surface OH in CH4 reforming reactions on Ni(111): A density functional theory calculation

Shengguang Wang, Jianguo Wang, H. Jiao, 2009 .

CH4 dissociation on Ni surfaces: Density functional theory study

Shengguang Wang, Jianguo Wang, H. Jiao, 2006 .

The Rise of Calcination Temperature Enhances the Performance of Cu Catalysts: Contributions of Support

Yulei Zhu, Yifeng Zhu, Yong-wang Li, 2014 .

Chemisorption of CO2 on nickel surfaces.

Shengguang Wang, Jianguo Wang, H. Jiao, 2005, The journal of physical chemistry. B.

DFT study on H2 and H adsorption and the electronic properties of single atom Cu modified Fe (1 1 1) surface

Ya-jun Ma, X. Wen, Yu Meng, 2020 .

Density functional theory study of CO adsorption on the Fe(111) surface

Jianguo Wang, H. Jiao, Yong-wang Li, 2004 .

CO2 dissociation on Ni(2 1 1)

Jianguo Wang, H. Jiao, Yong-wang Li, 2009 .

Oxygenate kinetics in Fischer–Tropsch synthesis over an industrial Fe–Mn catalyst

Jie Chang, Chenghua Zhang, H. Xiang, 2005 .

Morphology control of K2O promoter on Hägg carbide (χ-Fe5C2) under Fischer–Tropsch synthesis condition

Yong Yang, Jianguo Wang, Wenping Guo, 2016 .

A density functional theory study of the CH(2)I(2) reaction on Ag(111): Thermodynamics, kinetics, and electronic structures.

Weixin Huang, FengChao Wu, Botao Teng, 2010, The Journal of chemical physics.

Adsorption and dissociation of H2O and CO2 on the clean and O-pre-covered Ru(0001) surface

H. Xiang, Shaoli Liu, H. Jiao, 2017 .

Factors Controlling the Interaction of CO2 with Transition Metal Surfaces

Shengguang Wang, Jianguo Wang, H. Jiao, 2007 .

Density functional theory study of CO adsorption on the (100), (001) and (010) surfaces of Fe3C

Shengguang Wang, Jianguo Wang, H. Jiao, 2007 .

Predicting the structural and electronic properties of transition metal monoxides from bulk to surface morphology

Yong Yang, Pengju Ren, Wenping Guo, 2017 .

Prediction on morphologies and phase equilibrium diagram of iron oxides nanoparticles

Yong Yang, Wenping Guo, X. Wen, 2019, Applied Surface Science.

When Density Functional Approximations Meet Iron Oxides.

Albert K. Dearden, X. Gonze, Yong Yang, 2016, Journal of chemical theory and computation.

CO Self-Promoting Hydrogenation on CO-Saturated Ru(0001): A New Theoretical Insight into How H2 Participates in CO Activation

Yong Yang, H. Xiang, H. Jiao, 2019, The Journal of Physical Chemistry C.

Effect of ammonium salt on the distribution of titanium species in the synthesis of TS-1 zeolites

Hong Wang, Yulei Zhu, Yong-wang Li, 2021, Journal of Fuel Chemistry and Technology.

Theoretical study of the competitive decomposition and isomerization of 1-hexyl radical

Jie Ren, Feng Wang, Gang Liu, 2010 .

High coverage adsorption and co-adsorption of CO and H2 on Ru(0001) from DFT and thermodynamics.

Jianguo Wang, H. Xiang, H. Jiao, 2015, Physical chemistry chemical physics : PCCP.

Density functional theory study of CO adsorption on Fe5C2(001), -(100), and -(110) surfaces

H. Jiao, Yong-wang Li, Fu-qiang Zhang, 2004 .

Density functional theory study into H2O dissociative adsorption on the Fe5C2(0 1 0) surface

Yong Yang, Jianguo Wang, Shaoli Liu, 2013 .

Chain growth mechanism of Fischer–Tropsch synthesis on Fe5C2(0 0 1)

Jianguo Wang, H. Jiao, Yong-wang Li, 2011 .

Adsorption and Reaction of Surface Carbon Species on Fe5C2(001)

Jianguo Wang, H. Jiao, Yong-wang Li, 2008 .

Effects of reaction conditions on iron-catalyzed Fischer–Tropsch synthesis: A kinetic Monte Carlo study

Jian Xu, Yong Yang, Hongwei Xiang, 2010 .

Density function theory study of CO adsorption on Fe3O4(111) surface.

H. Jiao, Yong-wang Li, Dong-bo Cao, 2006, The journal of physical chemistry. B.

The role of water on the selective decarbonylation of 5-hydroxymethylfurfural over Pd/Al2O3 catalyst: Experimental and DFT studies

X. Wen, Yulei Zhu, Yong-wang Li, 2017 .

What is the product of ketene hydrogenation on Fe5C2(0 0 1): Oxygenates or hydrocarbons?

Shengguang Wang, Jianguo Wang, H. Jiao, 2007 .

Insight into the structure and energy of Mo27SxOy clusters

Albert K. Dearden, Yong Yang, Tao Yang, 2017 .

Morphology and Reactivity Evolution of HCP and FCC Ru Nanoparticles under CO Atmosphere

Yong Yang, H. Xiang, Pengju Ren, 2019, ACS Catalysis.

Formation of oxygen vacancies on the TiO2(110) surfaces

Shengguang Wang, Jianguo Wang, H. Jiao, 2005 .

Mechanism of Graphene Formation via Detonation Synthesis: A DFTB Nanoreactor Approach.

Haijun Jiao, Xingchen Liu, Xiao-Dong Wen, 2019, Journal of chemical theory and computation.

A combined computational and experimental study of the adsorption of sulfur containing molecules on molybdenum disulfide nanoparticles

Tao Yang, X. Wen, Hao Li, 2018, Journal of Materials Research.

The role of ligands in pressure-induced phase transition of gold nanoribbons

X. Wen, Xingchen Liu, Li Xiao-hong, 2021 .

Structures and energetics of H2O adsorption on the Fe3O4 (111) surface

Jianguo Wang, Tao Yang, X. Wen, 2009 .

Structures and energies of coadsorbed CO and H2 on Fe5C2(001), Fe5C2(110), and Fe5C2(100).

Haijun Jiao, Jianguo Wang, Yong-Wang Li, 2005, The journal of physical chemistry. B.

Intercalation Mechanisms of Fe Atoms underneath A Graphene Monolayer on Ru(0001)

C. J. Weststrate, J. Niemantsverdriet, Yong Yang, 2018, The Journal of Physical Chemistry C.

Density functional theory study of hydrogen adsorption on Fe5C2(001), Fe5C2(110), and Fe5C2(100).

Haijun Jiao, Jianguo Wang, Yong-Wang Li, 2005, The journal of physical chemistry. B.

A comprehensive kinetics model of Fischer-Tropsch synthesis over an industrial Fe-Mn catalyst

Ying Liu, Hongwei Xiang, Y. Liu, 2006 .

Theoretical study on potential energy surface of the C2HF2O and C2F3O radicals

Yi‐hong Ding, H. Jiao, Yong-wang Li, 2004 .

Structures and Energies of Coadsorbed CO and H 2 on Fe 5 C 2 (001), Fe 5 C 2 (110), and Fe 5 C 2 (100)

Jianguo Wang, H. Jiao, Yong-wang Li, 2005 .

High coverage adsorption and co-adsorption of CO and H2 on Ru(0001) from DFT and thermodynamics.

Jianguo Wang, H. Xiang, H. Jiao, 2015, Physical chemistry chemical physics : PCCP.

Adsorption and energetics of H2O molecules and O atoms on the χ-Fe5C2 (111), (−411) and (001) surfaces from DFT

Yong Yang, Jianguo Wang, H. Jiao, 2014 .