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MRD-CI calculations for the low-lying electronic states of scandiumhydride and titaniumhydride

✍ Scribed by J. Anglada; P.J. Bruna; S.D. Peyerimhoff; R.J. Buenker

Book ID
119115935
Publisher
Elsevier Science
Year
1983
Tongue
English
Weight
358 KB
Volume
93
Category
Article
ISSN
0166-1280

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An MRD-CI study of low-lying electronic
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✍ Peter BΓΌndgen; Bernd Engels; Sigrid D. Peyerimhoff πŸ“‚ Article πŸ“… 1991 πŸ› Elsevier Science 🌐 English βš– 532 KB

Dipole moments and various spectroscopic constants of some low-lying electronic states of the CaF molecule have been calculated using the multireference single-and double-excitation configuration-interaction (MRD-CI) method. The electronic structure of the highly ionic molecule in various excited st