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Fock space multi-reference coupled cluster study of transition moment and oscillator strength

✍ Scribed by Maria Barysz

Book ID
120750011
Publisher
Springer
Year
1995
Tongue
English
Weight
701 KB
Volume
90
Category
Article
ISSN
1432-2234

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Fock space multi-reference coupled-clust
Fock space multi-reference coupled-cluster study of excitation energies and dipole oscillator strengths of ozone
✍ Maria Barysz; Magnus Rittby; Rodney J. Bartlett πŸ“‚ Article πŸ“… 1992 πŸ› Elsevier Science 🌐 English βš– 539 KB

The singlet and triplet excitation energies are investigated by the Fock space multi-reference coupled-cluster method. A procedure for evaluating dipole transition moments and oscillator strengths is also presented and applied. Good agreement is achieved for excitation energies and transition moment