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Current Status of AMOEBA–IL: A Multipolar/Polarizable Force Field for Ionic Liquids

Computational simulations of ionic liquid solutions have become a useful tool to investigate various physical, chemical and catalytic properties of systems involving these solvents. Classical molecular dynamics and hybrid quantum mechanical/molecular mechanical (QM/MM) calculations of IL systems hav...

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Detalles Bibliográficos
Autores principales:	Vázquez-Montelongo, Erik Antonio, Vázquez-Cervantes, José Enrique, Cisneros, G. Andrés
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2020
Materias:	Review
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7037047/ https://www.ncbi.nlm.nih.gov/pubmed/31973103 http://dx.doi.org/10.3390/ijms21030697

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