Yüklüyor......
Accurate structure, thermodynamics and spectroscopy of medium-sized radicals by hybrid Coupled Cluster/Density Functional Theory approaches: the case of phenyl radical
The CCSD(T) model coupled with extrapolation to the complete basis-set limit and additive approaches represents the “golden standard” for the structural and spectroscopic characterization of building blocks of biomolecules and nanosystems. However, when open-shell systems are considered, additional...
Kaydedildi:
| Yayımlandı: | J Chem Phys |
|---|---|
| Asıl Yazarlar: | , , , , |
| Materyal Türü: | Artigo |
| Dil: | Inglês |
| Baskı/Yayın Bilgisi: |
2013
|
| Konular: | |
| Online Erişim: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4606980/ https://ncbi.nlm.nih.gov/pubmed/23802956 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.4810863 |
| Etiketler: |
Etiketle
Etiket eklenmemiş, İlk siz ekleyin!
|