Theoretical study of the correlation effects in the photoelectron spectrum of bis(π-allyl)nickel
✍ Scribed by P. Decleva; G. Fronzoni; A. Lisini
- Publisher
- Elsevier Science
- Year
- 1989
- Tongue
- English
- Weight
- 875 KB
- Volume
- 134
- Category
- Article
- ISSN
- 0301-0104
No coin nor oath required. For personal study only.
📜 SIMILAR VOLUMES
of tic anomalous intensity ratio of the two peaks arking from nitrogen 1s ionizatíon of nitric oxide is presented. It is found that correlation effccts in both the ground state of NO, and the íonic states 13il, ' fl) of NO+ contriiutc to deviations of this intcnsity ratio from the "frazen orbital" v
The S,,+T, electronic band spectrum in biacetyl arising from the activity of the methyl torsion modes was simulated by RHF/ UHF ab initio calculations. A tit of the calculated band spectrum to the cold jet phosphorescence excitation spectrum provided an assignment of the major bands and predicted th