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Thermodynamic Properties of Hydrogen-Producing Cobaloxime Catalysts: A Density Functional Theory Analysis
[Image: see text] Density functional theory calculations were carried out to study the electrochemical properties including reduction potentials, pK(a) values, and thermodynamic hydricities of three prototypical cobaloxime complexes, Co(dmgBF(2))(2) (dmgBF(2) = difluoroboryl-dimethylglyoxime), Co(dm...
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| Publicado no: | ACS Omega |
|---|---|
| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
American Chemical Society
2019
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| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6649079/ https://ncbi.nlm.nih.gov/pubmed/31459350 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acsomega.8b02107 |
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