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Understanding CO(2) capture kinetics and energetics by ionic liquids with molecular dynamics simulation
Room temperature ionic liquids (ILs) are recognized to be potential media for CO(2) capture, but the interaction nature is less documented which hinders the future development of ILs with high CO(2) solvation capability. Here, through all atom molecular dynamics (MD) simulations, the solvation proce...
Autores principales: | , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2020
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9051916/ https://www.ncbi.nlm.nih.gov/pubmed/35498469 http://dx.doi.org/10.1039/d0ra02221g |