Načítá se...
Valence-Only Correlation in LiH and BeH(+*)
The pseudonatural orbital procedure has been applied to the calculation of the potential energy curve of LiH and the dissociation energy of BeH(+). Only the two-electron bonding pair is correlated and estimates of σ and π type correlation are obtained. The results for LiH are in good agreement with...
Uloženo v:
| Vydáno v: | J Res Natl Bur Stand A Phys Chem |
|---|---|
| Hlavní autoři: | , |
| Médium: | Artigo |
| Jazyk: | Inglês |
| Vydáno: |
National Institute of Standards and Technology
1968
|
| Témata: | |
| On-line přístup: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6640588/ https://ncbi.nlm.nih.gov/pubmed/31824079 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.6028/jres.072A.009 |
| Tagy: |
Přidat tag
Žádné tagy, Buďte první, kdo otaguje tento záznam!
|