Cargando…
SOMO–HOMO Level Inversion in Biologically Important Radicals
[Image: see text] Conventionally, the singly occupied molecular orbital (SOMO) of a radical species is considered to be the highest occupied molecular orbital (HOMO), but this is not the case always. In this study, we considered a number of radicals from smallest diatomic anion radicals such as supe...
| Autores principales: | , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical
Society
2017
|
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5767877/ https://www.ncbi.nlm.nih.gov/pubmed/29240424 http://dx.doi.org/10.1021/acs.jpcb.7b10002 |