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Molecular orbital treatment of gas adsorption on 3d-Metal clusters I. Substrate models

โœ Scribed by D.L. Lazarov; D.R. Drakova


Publisher
Elsevier Science
Year
1978
Weight
523 KB
Volume
3
Category
Article
ISSN
0390-6035

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Molecular orbital treatment of gas adsor
โœ D.L. Lazarov; D.R. Drakova ๐Ÿ“‚ Article ๐Ÿ“… 1978 ๐Ÿ› Elsevier Science โš– 539 KB

This third part of the series presents results for nitrogen atomic and molecular adsorption on 3d-metal clusters, received with the H/.ickel method in the frontier molecular orbitals approximation. Non-dissociative adsorption of nitrogen above the clusters of the metals from Sc to Cr proves energeti