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Communication: Anion-specific response of mesoscopic organization in ionic liquids upon pressurization.

Fabrizio Lo CelsoAlessandro TrioloLorenzo GontraniOlga Russina
Published in: The Journal of chemical physics (2018)
One of the outstanding features of ionic liquids is their inherently hierarchical structural organization at mesoscopic spatial scales. Recently experimental and computational studies showed the fading of this feature when pressurising. Here we use simulations to show that this effect is not general: appropriate anion choice leads to an obstinate resistance against pressurization.
Keyphrases
  • ionic liquid
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  • machine learning
  • deep learning
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  • monte carlo