CORDIS Project
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The project develops a method to derive equations that describe the flow behavior of polymeric and anisotropic fluids from molecular models. This approach combines advanced simulation techniques with thermodynamics to create a hierarchy of models applicable to various systems.
The overall aim of this project is to develop a systematic and thermodynamically consistent method to derive macroscopic constitutive equations from molecular models of polymeric and anisotropic fluids.Since the constitutive equations describe the transport and flow behavior of the material on a coarse-grained level, many phenomenological approaches have been proposed in the past.
The method we will develop here combines projection operator techniques and simulations within a nonequilibrium ther…
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