Monte Carlo simulation and SAFT modeling study of the solvation thermodynamics of dimethylformamide, dimethylsulfoxide, ethanol and 1-propanol in the ionic liquid trimethylbutylammonium bis(trifluoromethylsulfonyl)imide
Abstract
Molecular simulations and equation of state modelling enable accurate prediction of solute–ionic liquid mixing thermodynamics.
Document Details
- Document Type
- Pub Defense Publication
- Publication Date
- Jan 01, 2015
- Source ID
- 10.1039/c4cp05961a
Entities
People
- Alireza Vahid
- E. J. Maginn
Organizations
- Air Force Office of Scientific Research
- United States Army
- University of Notre Dame