Since their conception, ionic liquids (ILs) have been investigated for an extensive range of
applications including in solvent chemistry, catalysis, and electrochemistry. This is due to …

Ionic liquids (ILs) offer a wide range of promising applications because of their much
enhanced properties. However, further development of such materials depends on the …

Halide perovskites are poised as a game-changing semiconductor system with diverse
applications in optoelectronics. Industrial entities aim to commercialize perovskite …

We have applied molecular dynamics to calculate thermodynamic and transport properties
of a set of 19 room-temperature ionic liquids. Since accurately simulating the thermophysical …

The large collection of thermophysical properties data for liquids available in the open
literature is analyzed, describing its importance for industrial purposes. Although there has …

A systematic ionic liquid (IL) screening approach for acid gas removal processes was
developed by taking into account a wide range of process performance-determining factors …

The group contribution method proposed by Valderrama and Robles in 2007 and extended
by Valderrama et al. in 2008 to estimate the critical properties of ionic liquids is revised and …

Experimental measurements and molecular dynamics simulations are used to determine the
density, heat capacity, self-diffusivity, shear viscosity, and thermal conductivity of six ionic …

Hydrofluorocarbon refrigerants are being phased out over the next two decades due to their
high global warming potential. To separate and recycle refrigerants that form azeotropic …

Molecular dynamics simulations have been performed to investigate the structure and
dynamics of the ionic liquid, 1-n-butyl-3-methylimidazolium bis (trifluoromethanesulfonyl) …