A series of experimental and simulation studies examined the validity of the Stokes–Einstein
relationship (SER) of water in binary water/alcohol mixtures of different mixture …

Liquid-liquid phase separation is an important phenomenon that prevails from simple to
complex molecular systems where temperature plays a crucial role in the fundamental …

What selects azeotropic pairs and governs the azeotropic conditions (composition and
temperature) is an open and intriguing question. A combined simulation and experimental …

Temperature dependent hydrogen bond energetics and dynamical features, such as the
diffusion coefficient and re-orientational times, have been determined for ethanol-water …

The conformational propensity of amino acid residues is determined by an intricate balance
of peptide–solvent and solvent–solvent interactions. To explore how the systematic …

The thermodynamic changes occurring upon mixing small monovalent alcohols and water
are systematically analyzed as a function of both the size and shape of the apolar group of …

We observe, by computer simulations, a remarkable long-distance, rare, but repetitive,
exchange of ethanol molecules between two parallel graphene surfaces in nanoconfined …

Mixtures of short-chain alcohols and water produce anomalous thermodynamic and
structural quantities, including molecular segregation into water-rich and alcohol-rich …

Binary mixtures of water with lower alcohols display non-linear phase behaviors upon
mixing, which are attributed to potential cluster formation at the molecular level. Unravelling …

Alcohol-water mixtures are important solvent systems, widely used in many applications. In
this study, the intriguing water induced tautomerism of the fluorescent chromophore …