A modified form of multi-reference second-order perturbation theory is considered. The nature of the poor convergence of + Moller-Plesset perturbation theory for systems like cyano radical or He\* , He:+, OS+ cations is analyzed. Additionally, isomerization of the formaldehyde radical cation and the
✦ LIBER ✦
New diagnostics for coupled-cluster and Møller–Plesset perturbation theory
✍ Scribed by Curtis L. Janssen; Ida M.B. Nielsen
- Book ID
- 108312480
- Publisher
- Elsevier Science
- Year
- 1998
- Tongue
- English
- Weight
- 118 KB
- Volume
- 290
- Category
- Article
- ISSN
- 0009-2614
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