Oxygen on Ni(111): A multiple-scattering analysis of the near-edge x-ray-absorption fine structure

Oxygen chemisorption and oxide formation on a Ni(111) surface have been monitored by using the near-edge x-ray-absorption fine-structure technique. The adsorption site of oxygen in the p(2×2) and (?3 × ?3 )R30° superstructures has been determined by a multiple-scattering analysis. In both structures the oxygen occupies a threefold-coordinated fcc site with a nearest-neighbor O-Ni bond length of 1.85±0.05 Å on a Ni(111) surface relaxed outwards by ~0.15 Å.