First-principles Design of Hetero CoM (M=3d,4d, 5d Block Metals) Double Atom Catalysts for Oxygen Evolution Reaction
E. Lee, S. H. Choi, H.C. Ham*
Nanoscale Advances, 2022
52
Role of Heteronuclear Interactions in Selective H2 Formation from HCOOH Decomposition on Pd/M (M=Late Transition FCC Metals) Catalysts
J. Cho, S. Lee, J. Han, S.P. Yoon, S. W. Nam, K. Y. Lee, H.C. Ham*
ACS Catalysis, 2017
53
Impact of d-band Occupancy and Lattice Contraction on Selective Hydrogen Production from Formic Acid in the Bimetallic Pd-M(early-transition metal) Catalyst
S. Lee, J. Cho, J. H. Jang, J. Han, S. W. Nam, S.P. Yoon, T. H. Lim, H. C. Ham*
ACS Catalysis, 2016
54
Effect of Gold Subsurface Layer on the Surface Activity and Segregation in Pt3M Alloy Catalyst from First-Principles
C.-E. Kim, D.-H. Lim, J.H. Jang, S.P. Yoon, H.-J. Kim, S. W. Nam, S-. A. Hong, A. Soon*, H.C. Ham*
The Journal of Chemical Physics, 2015
55
Mechanisms of Enhanced Sulfur Tolerance on Samarium (Sm)-doped Cerium Oxide (CeO2) from First-Principles
D. H. Lim, H.S. Kim, S.P. Yoon, J. Han, S. W. Nam, H. C. Ham*
Physical Chemistry Chemical Physics(PCCP), 2014
56
Importance of Ligand Effect in Enhanced Dehydrogenation of HCOOH on the Bimetallic Pd/Ag Catalyst from First-Principles
J. Cho, S. Lee, J. Han, S.P. Yoon, S. W. Nam, S.H. Choi, K. Y. Lee, H.C. Ham*
Journal of Physical Chemistry C, 2014
57
Enhanced Oxygen Reduction Reaction and Its Underlying Mechanism in Pd-Ir-Co Trimetallic Alloys
H. C. Ham, D. Manogaran, K.H. Lee, K. Kwon, S.-A. Jin, D.J. You, C. Pak, G.S. Hwang*
The Journal of Chemical Physics - Communications, 2013
58
Role of small Pd ensemble in boosting CO oxidation in AuPd alloys
H. C. Ham, J. A. Stephenson, G. S. Hwang*, J Han, S. W. Nam, T. H. Lim
Journal of Physical Chemistry Letter, 2012
59
On the Role of Pd Ensembles in Selective H2O2 Formation on AuPd Alloy Surfaces
H. C. Ham, G. S. Hwang*, J. Han, S. W. Nam, T. H. Lim
Journal of Physical Chemistry C – Letter, 2009
60
First-Principles Study on the Design of Nickel based Bimetallic Catalysts for Xylose to Xylitol conversion