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Biomimetic heterobimetallic architecture of Ni(ii) and Fe(ii) for CO(2) hydrogenation in aqueous media. A DFT study
In this work, density functional theory has been employed to design a heterobimetallic catalyst of Ni(ii) and Fe(ii) for the effective CO(2) hydrogenation to HCOOH. Based on computational results, our newly designed catalyst is found to be effective for such conversion reactions with free energy as...
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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The Royal Society of Chemistry
2019
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9073165/ https://www.ncbi.nlm.nih.gov/pubmed/35529114 http://dx.doi.org/10.1039/c9ra07139c |