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On the collective network of ionic liquid/water mixtures: III. Structural analysis of ionic liquids on the basis of Voronoi decomposition

Three different mixtures of 1-butyl-3-methyl-imidazolium tetrafluoroborate with water have been studied by means of molecular dynamics simulations. Based on the classical Lopes-Padua force field trajectories of approximately 60 ns were computed. This is the third part of a series concerning the coll...

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Pubblicato in:J Chem Phys
Autori principali: Schröder, C., Neumayr, G., Steinhauser, O.
Natura: Artigo
Lingua:Inglês
Pubblicazione: 2009
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Accesso online:https://ncbi.nlm.nih.gov/pmc/articles/PMC7613741/
https://ncbi.nlm.nih.gov/pubmed/19466839
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.3127782
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