Dirac-Fock one-centre expansion calculations on the molecular model systems ThH4 and UH6
Overview & Synopsis
Relativistic Dirac-Fock one-centre expansion calculations are presented for the molecular model systems ThH4 and UH6. The hybridizations, the radial distributions and the effect of the 5f : s on the bond length are discussed. A value of 30 pm is predicted for the actinoid contraction.
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Document Information
| Document Title | Dirac-Fock one-centre expansion calculations on the molecular model systems ThH4 and UH6 |
|---|---|
| Author / Organization | P. Pyykkö, J. Desclaux |
| Subject & Discipline | Multidisciplinary Academic Open Research |
| Categories | Science & Mathematics |
| Publication Year | 1979 |
| License / Rights | Open Access / Creative Commons |
| Resource Verification | Listed PDF (Verification Pending) |
| Original Host Website |
HAL Open Science
(hal.science)
|
| File Format | application/pdf (Portable Document Format) |
| Language | EN |
| Catalog ID | DOC-87082 |
| Original Source Link | Visit Source Page on hal.science » |