Molecular dynamics study on water confinement in deep eutectic solvents

The nanoscopic properties of highly diluted water solutions in choline chloride + lactic acid deep eutectic solvent was studied using molecular dynamics simulations as a function concentration and temperature with the objective characterize confinement solvents non-regular mechanism. allowed analysis changes response to presence well behaviour confined cavities. structural, energetic dynamic factors provides for first time characterization these environmentally friendly solvents. results showed how can be liquid cages maintaining individuality minor properties, which used tuning development technological applications.