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- Currently displaying 101 - 120 of 212 publications
Methane dissociation and methyl diffusion on PdO{100}
– The Journal of chemical physics
(2009)
130,
014705
(doi: 10.1063/1.3046683)
ChemInform Abstract: In‐silico Investigations in Heterogeneous Catalysis—Combustion and Synthesis of Small Alkanes
– ChemInform
(2008)
40,
no
(doi: 10.1002/chin.200901237)
Structure of gold atoms on stoichiometric and defective ceria surfaces.
– J Chem Phys
(2008)
129,
194708
(doi: 10.1063/1.3009629)
First-principles molecular dynamics of the initial oxidation of Si{001} by ozone
– Physical Review B - Condensed Matter and Materials Physics
(2008)
78,
195407
(doi: 10.1103/PhysRevB.78.195407)
Insight into the Reduction of Pyruvic Acid to Lactic Acid over Cu{110}: The Crucial Role of Intramolecular Tunneling in Direct Hydrogenation
– Journal of the American Chemical Society
(2008)
130,
14483
(doi: 10.1021/ja077786m)
Response from Stephen Jenkins
– Chemistry World
(2008)
5,
36
Interface effects in spin-polarized metal/insulator layered structures
– Surface Science Reports
(2008)
63,
400
In-silico investigations in heterogeneous catalysis-combustion and synthesis of small alkanes
– Chem Soc Rev
(2008)
37,
2274
(doi: 10.1039/b719149a)
Benzene and its dissociation products on Ir{100}
– Journal of Physical Chemistry C
(2008)
112,
14417
(doi: 10.1021/jp804041j)
Radical-mediated adsorption: Ozone oxidation of passivated silicon
– Surface Science
(2008)
602,
L100
(doi: 10.1016/j.susc.2008.05.028)
Facile dissociation of CO on Fe{211}: Evidence from microcalorimetry and first-principles theory
– Surface Science
(2008)
602,
2325
(doi: 10.1016/j.susc.2008.05.014)
Mechanistische Studien der katalytischen Verbrennung und Synthese von Kohlenwasserstoffen auf Übergangsmetalloberflächen
– Angewandte Chemie
(2008)
120,
5332
(doi: 10.1002/ange.200800685)
Mechanistic Studies of Hydrocarbon Combustion and Synthesis on Noble Metals
– Angewandte Chemie (International ed. in English)
(2008)
47,
5253
(doi: 10.1002/anie.200800685)
Oxidation of hydrocarbons at surface defects: Unprecedented confirmation of the oxomethylidyne pathway on a stepped Rh surface
– The Journal of Physical Chemistry C
(2008)
112,
8751
(doi: 10.1021/jp8026594)
Dynamic interplay between diffusion and reaction: nitrogen recombination on Rh{211} in car exhaust catalysis.
– J Am Chem Soc
(2008)
130,
2213
(doi: 10.1021/ja0754913)
Fischer-Tropsch mechanism revisited: Alternative pathways for the production of higher hydrocarbons from synthesis gas
– The Journal of Physical Chemistry C
(2008)
112,
1305
(doi: 10.1021/jp710674q)
Beyond the surface atlas: A roadmap and gazetteer for surface symmetry and structure
– Surface Science Reports
(2007)
62,
373
When adding an unreactive metal enhances catalytic activity: NOx decomposition over silver-rhodium bimetallic surfaces
– Surface Science
(2007)
601,
l103
(doi: 10.1016/j.susc.2007.06.031)
Surface states and surface stability in half-metallic systems: the cases of zinc-blende-structure MnSb {111}A, {111}B and {001}.
– Journal of Physics Condensed Matter
(2007)
19,
315214