单斌
- B. Shan*, J. Hyun, N. Kapur, S. Yang, J.B. Nicholas and K. Cho “Monte-Carlo Simulations of PdAu Bimetallic Alloy Surface under Realistic CO Coverage”, Mater. Res. Soc. Symp. Proc., Vol. 1177, (2009) Z02-06.
- B. Shan*, N. Kapur, J. Hyun, L. Wang, J.B. Nicholas, and K. Cho “CO-Coverage-Dependent Oxygen Dissociation on Pt(111) Surface” Journal of Physical Chemistry C, 113 (2009) 710.
- B. Shan*, Y. Zhao, J. Hyun, N. Kapur, J.B. Nicholas and K. Cho “Coverage Dependent CO Adsorption Energies from First-Principles” Journal of Physical Chemistry C, 113 (2009) 6088.
- B. Shan*, L. Wang, S. Yang, Y. Zhao, J. Hyun, J.B. Nicholas and K. Cho “First-principles-based embedded atom method for PdAu nanoparticles”, Physical Review B, 80 (2009) 035404.
- C Gong, G Lee, W Wang, B. Shan, E. M. Vogel, R. M. Wallace, and K. Cho* “First-Principles and Quantum Transport Studies of Metal-Graphene End Contacts” Mater. Res. Soc. Symp. Proc., Vol. 1259, (2010) S14-35.
- N. Kapur,C. Sampara, X. Hao, J. Hyun, B. Shan, J.B. Nicholas, B. Davis, and K. Cho* “Microkinetic Study of Oxygenate and Hydrocarbon Formation from Syngas on Rhodium and Cobalt Surfaces: Effect of Site Structure on Catalytic Cycles” Technical Proceedings of the 2010 Nanotechnology Conference (2010).
- N. Kapur, J. Hyun, B. Shan, J.B. Nicholas, K. Cho*, “Ab-Initio Study of CO Hydrogenation to Oxygenates on Reduced Rh Terraces and Stepped Surfaces” Journal of Physical Chemistry C, 114 (2010) 10171.
- B. Shan*, and K. Cho, “Oxygen Dissociation on Nitrogen-doped Single Wall Nanotube: A First-principles Study” Chemical Physics Letters 492 (2010) 131.
- C. Gong, G. Lee, B. Shan, E.M. Vogel, R.M. Wallace, and K. Cho*, “First-Principles Study of Metal-Graphene Interfaces” Journal of Applied Physics 108 (2010) 123711.
- N. Kapur, B. Shan, J. Hyun, L. Wang, S. Yang, J.B. Nicholas, and K. Cho*, “First Principles Study of CO Oxidation on Bismuth Promoted Pt(111) Surfaces” Molecular Simulation 1029-0435 (2011 Coverage page article).