๐”– Bobbio Scriptorium
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Single-determinantal open- and closed-shell FSGO calculations for some diatomic molecules

โœ Scribed by A. H. Pakiari; J. W. Linnett


Publisher
John Wiley and Sons
Year
1980
Tongue
English
Weight
600 KB
Volume
18
Category
Article
ISSN
0020-7608

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An effective Hamiltonian for calculating rotational energy levels of an open-shell diatomic molecule, in a 2Sฯฉ1 โŒบ electronic state, weakly bonded to a closed-shell partner was presented (W. M. Fawzy, J. Mol. Spectrosc. 191, 68 -80 (1998)). The Hamiltonian was given as H ฯญ H ev ฯฉ H rot ฯฉ H sr ฯฉ H ss

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This paper concerns rotational energy levels and line intensities for electronic, vibrational, and microwave transitions in an open-shell complex consisting of an open-shell diatomic molecule and a closed-shell partner. The electronic state of the open-shell diatomic fragment is a 2Sฯฉ1 โŒบ state, wher