Cargando…
Spin-state dependence of the structural and vibrational properties of solvated iron(ii) polypyridyl complexes from AIMD simulations: III. [Fe(tpen)]Cl(2) in acetonitrile
In order to achieve an in-depth understanding of the role played by the solvent in the photoinduced low-spin (LS) → high-spin (HS) transition in solvated Fe(ii) complexes, an accurate description of the solvated complexes in the two spin states is required. To this end, we are applying state-of-the-...
| Autor principal: | |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
The Royal Society of Chemistry
2020
|
| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9058091/ https://www.ncbi.nlm.nih.gov/pubmed/35519674 http://dx.doi.org/10.1039/d0ra09499d |