The Atomistic Force Field for Pyridinium-Based Ionic Liquids: Reliable Transport Properties

Iuliia V. Voroshylova; Vitaly V. Chaban

The Atomistic Force Field for Pyridinium-Based Ionic Liquids: Reliable Transport Properties

Materials Science 2014-08-19 v1 Chemical Physics

Authors: Iuliia V. Voroshylova , Vitaly V. Chaban

Abstract

Reliable force field (FF) is a central issue in successful prediction of physical chemical properties via computer simulations.

Keywords

force field pyridinium-based ionic liquids transport properties computer simulations atomistic modeling

Cite

@article{arxiv.1408.3730,
  title  = {The Atomistic Force Field for Pyridinium-Based Ionic Liquids: Reliable Transport Properties},
  author = {Iuliia V. Voroshylova and Vitaly V. Chaban},
  journal= {arXiv preprint arXiv:1408.3730},
  year   = {2014}
}