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Guided Ion Beam and Ab Initio Studies of Platinum Chloride Cations

✍ Scribed by Liyanage, R.; Styles, M. L.; O'Hai, R. A. J.; Armentrout, P. B.

Book ID
126210651
Publisher
American Chemical Society
Year
2003
Tongue
English
Weight
136 KB
Volume
107
Category
Article
ISSN
1089-5639

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Ab initio study of AgNH3 and its cation
Ab initio study of AgNH3 and its cation
✍ H.-H. Ritze; W. Radloff πŸ“‚ Article πŸ“… 1996 πŸ› Elsevier Science 🌐 English βš– 375 KB

Ab initio calculations are performed for AgNH 3 and Ag+NH3 at the MP2 level of theory. The equilibrium structures show C3v symmetry, the Ag-NH 3 (Ag+-NH3) stabilization energy is 0.20 eV (2.00 eV). The frequencies of the silver-ammonia stretching and bending vibrations are calculated. The theoretica