A generalized valence bond + configuration interaction description of the P2O molecule
β Scribed by Solange Regina Blaszkowski; Marco Antonio Chaer Nascimento
- Book ID
- 113258020
- Publisher
- Elsevier Science
- Year
- 1993
- Tongue
- English
- Weight
- 642 KB
- Volume
- 287
- Category
- Article
- ISSN
- 0166-1280
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
## Abstract CI calculations were performed on the energies and relative intensities of the outer and inner valence levels of the CS molecule. Breakdown of the oneβparticle model is discussed in terms of CI, and the results are compared with the analogous investigations using the Green's function te
A configuration interaction (Cl) treatment of the r(z,n\*), V, state of ethylene was carried out in two s'ages. First, on& r and n+ orbit& IKE considered in the Cl 2nd the treatment was found to giw acceptable results for the description of the 3(rr,~\*) state but not for the '(~,a\*) state. In the