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Dynamic and quantum size effects in molecular clusters

✍ Scribed by J. Jortner; U. Even; N. Ben-Horin; D. Scharf; R. N. Barnett; U. Landman

Book ID
105193196
Publisher
Springer
Year
1989
Tongue
English
Weight
567 KB
Volume
12
Category
Article
ISSN
1434-6060

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Quantum chemistry of quantum size-effect
Quantum chemistry of quantum size-effects in semiconductors: Small clusters electronic structure calculations
✍ V. S. Gurin πŸ“‚ Article πŸ“… 1999 πŸ› John Wiley and Sons 🌐 English βš– 141 KB πŸ‘ 2 views

Ab initio RHF SCF calculations are used for some small clusters M X , x y where M s Cd, Ag; X s S, I; and x, y F 7. Variation of electronic structure with size for some clusters with the bulklike tetrahedral coordination and with the lower symmetry allows one to predict their possible geometries wh