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Chemisorption of molecular oxygen on small copper clusters and the Cu(100) surface

✍ Scribed by Grönbeck, H.; Rosén, A.


Book ID
122685390
Publisher
Elsevier Science
Year
1994
Tongue
English
Weight
520 KB
Volume
2
Category
Article
ISSN
0927-0256

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A jellium approach to the chemisorption
✍ Henrik Grönbeck; Arne Rosén 📂 Article 📅 1994 🏛 Elsevier Science 🌐 English ⚖ 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