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Thermodynamic modelling of complex mixture

Research Theme
Thermodynamic modelling of complex mixtures

Multicomponent liquid mixtures are ubiquitous in both chemical engineering and pharmaceutical research. We use both phase-field modelling and classical molecular dynamics simulation to study the phase diagram and miscibility of the multicomponent mixture. In the last few years, we have established a strong link with the School of Pharmacy to help improve the bio-availability of poorly soluble drugs.

 

Recently we have modified the so-called two-phase theory of liquids to obtain a reliable estimate of the chemical potentials in an efficient way. In future, we plan to apply the 2PT to chemical engineering problems.
Researcher: Lorenzo Stella

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