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Thermodynamic and Transport Properties of Crown-Ethers: Force Field Development and Molecular Simulations

[Image: see text] Crown-ethers have recently been used to assemble porous liquids (PLs), which are liquids with permanent porosity formed by mixing bulky solvent molecules (e.g., 15-crown-5 ether) with solvent-inaccessible organic cages. PLs and crown-ethers belong to a novel class of materials, whi...

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Detalles Bibliográficos
Autores principales:	Jamali, Seyed Hossein, Ramdin, Mahinder, Becker, Tim M., Rinwa, Shwet Kumar, Buijs, Wim, Vlugt, Thijs J. H.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2017
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5592649/ https://www.ncbi.nlm.nih.gov/pubmed/28792215 http://dx.doi.org/10.1021/acs.jpcb.7b06547

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