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Computational DFT data related to the redox behaviour of tris(β-diketonato)ruthenium(III) compounds
The data presented in this paper are related to the research article titled “Redox Behaviour of [Ru(β-diketonato)(3)] Compounds” [1]. This paper presents structural and energy data obtained from the density functional theory (DFT) computations. The energy data is related to experimentally obtained r...
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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Elsevier
2020
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7206207/ https://www.ncbi.nlm.nih.gov/pubmed/32395584 http://dx.doi.org/10.1016/j.dib.2020.105617 |