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Effect of oxygen chemisorption on the magnetism of small nickel clusters

✍ Scribed by R. Fournier; D.R. Salahub

Publisher
Elsevier Science
Year
1991
Weight
72 KB
Volume
245
Category
Article
ISSN
0167-2584

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A jellium approach to the chemisorption
A jellium approach to the chemisorption of molecular oxygen on copper clusters
✍ Henrik GrΓΆnbeck; Arne RosΓ©n πŸ“‚ Article πŸ“… 1994 πŸ› Elsevier Science 🌐 English βš– 756 KB

Molecular oxygen chemisorption on copper clusters has been studied using a jellium description of the clusters. Calculations were performed in the framework of the local spin density approximation and the density was expanded according to the MO-LCAO method. To evaluate the applicability of this app