Solvation of molecular cosolvents and inorganic salts in ionic liquids: A review of molecular dynamics simulations
| Autor: | Oscar Cabeza, Jesús Carrete, Luis M. Varela, Borja Docampo-Álvarez, Trinidad Méndez-Morales, Luis J. Gallego, Olga Russina, Víctor Gómez-González |
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| Rok vydání: | 2015 |
| Předmět: |
binary-mixtures
room-temperature Implicit solvation Inorganic chemistry Ionic bonding electrical-conductivity Ion liquid/water mixtures Molecular dynamics chemistry.chemical_compound Materials Chemistry Molecule nanostructural organization Physical and Theoretical Chemistry Spectroscopy thermodynamic properties neutron-diffraction Chemistry Solvation Condensed Matter Physics Atomic and Molecular Physics and Optics Electronic Optical and Magnetic Materials lithium-niytrate transport-properties raman-spectroscopy Solvation shell Chemical physics Ionic liquid |
| Zdroj: | Journal of Molecular Liquids. 210:178-188 |
| ISSN: | 0167-7322 |
| DOI: | 10.1016/j.molliq.2015.06.036 |
| Popis: | Trying to contribute to an overall picture of solvation in ionic liquids, we report a review of the main recent results in the field of molecular dynamics simulations of structural and dynamic properties of mixtures of ionic liquids with molecular cosolvents or salts. The majority of reported results indicate that solvation of neutral molecules and salt ions takes place selectively in the bulk nanoregions of the dense ionic solvents, fitting the parts of the solute's moieties to the similar regions of the dense ionic solvent, in what has been called nanostructured solvation [Mendez-Morales et al. J. Phys. Chem. B 118 (2014) 761–770]. |
| Databáze: | OpenAIRE |
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