Wordt geladen...
Relativistic DFT Calculations of Hyperfine Coupling Constants in 5d Hexafluorido Complexes: [ReF(6)](2−) and [IrF(6)](2−)
The performance of relativistic density functional theory (DFT) methods has been investigated for the calculation of the recently measured hyperfine coupling constants of hexafluorido complexes [ReF(6)](2−) and [IrF(6)](2−). Three relativistic methods were employed at the DFT level of theory: the 2‐...
Bewaard in:
| Gepubliceerd in: | Chemistry |
|---|---|
| Hoofdauteurs: | , , , , |
| Formaat: | Artigo |
| Taal: | Inglês |
| Gepubliceerd in: |
John Wiley and Sons Inc.
2017
|
| Onderwerpen: | |
| Online toegang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5969236/ https://ncbi.nlm.nih.gov/pubmed/29027277 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/chem.201704653 |
| Tags: |
Voeg label toe
Geen labels, Wees de eerste die dit record labelt!
|