Computational Study of Spinodal Decomposition in Thin Layers
Publicerad
Författare
Typ
Examensarbete för masterexamen
Modellbyggare
Tidskriftstitel
ISSN
Volymtitel
Utgivare
Sammanfattning
Phase separation through spinodal decomposition is the process where a mixture
becomes unstable and spontaneously separates into two phases. The decomposition
yields tortuous microstructures which are versatile in materials for transporting of
liquids and molecules. In pharmaceutical industries, these types of materials are
used in order to control drug releases from tablets and thus receive effective treatments
against various diseases. A computational study is performed to improve the
understanding of this decomposition in thin layers, by simulations of the conservative
Allen-Cahn (AC) and Cahn-Hilliard (CH) equations. In an ongoing PhD project,
at the department of Physics in collaboration with RISE Agrifood and Bioscience,
the evolution in time of the decomposition is studied for mixtures of ethylcellulose
(EC) and hydroxypropylcellulose (HPC) with ethanol as solvent, and generally, the
phase separation occurs as the solvent evaporates.
For both AC and CH, a pure diffusive model, and a model coupled with the Navier-
Stokes equations (NS) for fluid flow are studied, where time-resolved results of length
scales, curvatures, accuracy, etc., are compared with theory and the conducted experiments.
The simulations could to some extent be compared to the experiments,
and the AC models showed better agreement than the CH models. However, limitations
in the models such as parameter settings is discussed. Further, insights
for future work are proposed in order to compare the results properly. Comprising
other models which appear to be accurate, and models that consider the effect of
the evaporation.
Beskrivning
Ämne/nyckelord
Spinodal decompostion, phase separation, Allen-Cahn, Cahn-Hilliard, modelling, simulation, drug release