Chemical Physics Letters, Vol.359, No.5-6, 493-499, 2002
The adsorption of molecular oxygen on neutral and negative Au-n clusters (n=2-5)
We use density functional theory to examine the binding of O-2, to Au-n and Au-n(-) clusters. O-2 binds more strongly to clusters having an odd number of electrons than to those with an even number. A second O-2 molecule binds more weakly than the first. (C) 2002 Elsevier Science B.V. All rights reserved.