Natasha M. Galea

Analysis of Intrinsic Defects in CeO₂ Using a Koopmans-Like GGA+<i>U</i> Approach

Patrick R. L. Keating, David O. Scanlon, Benjamin J. Morgan et al. · The Journal of Physical Chemistry C · 2011 · 164 citations

Materials Science, Electrical Engineering, Engineering +11

Density functional theory studies of methane dissociation on anode catalysts in solid-oxide fuel cells: Suggestions for coke reduction

Natasha M. Galea, Daniel R. Knapp, Thomas R. Ziegler · Journal of Catalysis · 2007 · 109 citations

Materials Science, Chemical Engineering, Catalytic Material +10

Reactivity on the (110) Surface of Ceria: A GGA+<i>U</i>Study of Surface Reduction and the Adsorption of CO and NO₂

David O. Scanlon, Natasha M. Galea, Benjamin J. Morgan et al. · The Journal of Physical Chemistry C · 2009 · 73 citations

Materials Science, Split Vacancy, Oxygen Reduction Reaction +14

A DFT study on the removal of adsorbed sulfur from a nickel(111) surface: Reducing anode poisoning

Natasha M. Galea, John M. H. Lo, Tom Ziegler · Journal of Catalysis · 2009 · 45 citations

Adsorbed Sulfur, Chemical Engineering, Engineering +10

A GGA+<i>U</i>study of the reduction of ceria surfaces and their partial reoxidation through NO₂adsorption

Natasha M. Galea, David O. Scanlon, Benjamin J. Morgan et al. · Molecular Simulation · 2009 · 34 citations · Full text