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- Currently displaying 321 - 330 of 330 publications
Hydrogenation of S to H2S on Pt(111): A first-principles study
Journal of Chemical Physics
(2001)
115
8570
(doi: 10.1063/1.1410390)
Catalytic water formation on platinum: a first-principles study.
Journal of the American Chemical Society
(2001)
123
4235
(doi: 10.1021/ja003576x)
A density functional theory study of the reaction of C+O, C+N, and C+H on close packed metal surfaces
The Journal of Chemical Physics
(2001)
114
5792
(doi: 10.1063/1.1352731)
Softened C–H modes of adsorbed methyl and their implications for dehydrogenation: An ab initio study
Journal of Chemical Physics
(2001)
114
2523
(doi: 10.1063/1.1345907)
Density functional theory study of hydroxyl and the intermediate in the water formation reaction on Pt
Journal of Chemical Physics
(2001)
114
513
(doi: 10.1063/1.1328746)
Insight into Microscopic Reaction Pathways in Heterogeneous Catalysis
Journal of the American Chemical Society
(2000)
122
9866
(doi: 10.1021/ja0011919)
A first principles study of CH3 dehydrogenation on Ni(111)
The Journal of Chemical Physics
(2000)
112
8120
(doi: 10.1063/1.481412)
A density functional theory study of CH2 and H adsorption on Ni(111)
Journal of Chemical Physics
(2000)
112
6006
(doi: 10.1063/1.481173)
Methyl chemisorption on Ni(111) and C H M multicentre bonding: a density functional theory study
Surface Science
(1999)
437
362
Physical origin of the high reactivity of subsurface hydrogen in catalytic hydrogenation
Journal of Chemical Physics
(1999)
111
1343
(doi: 10.1063/1.479392)
