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Molecular Dynamics Simulations of Ionic Liquids and Electrolytes Using Polarizable Force Fields
[Image: see text] Many applications in chemistry, biology, and energy storage/conversion research rely on molecular simulations to provide fundamental insight into structural and transport properties of materials with high ionic concentrations. Whether the system is comprised entirely of ions, like...
Autores principales: | Bedrov, Dmitry, Piquemal, Jean-Philip, Borodin, Oleg, MacKerell, Alexander D., Roux, Benoît, Schröder, Christian |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2019
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6620131/ https://www.ncbi.nlm.nih.gov/pubmed/31141351 http://dx.doi.org/10.1021/acs.chemrev.8b00763 |
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