Final Thesis

Gibbs Free Energy Topologies from COSMO-Therm Predictions for Binary LLE

Key Info

Basic Information

Unit:
Process Systems Engineering
Type:
Bachelorthesis
Focus/Key Topic:
simulativ
Date:
1.10.2017

Contact

For the automated investigation of COSMO-Therm generated predictions we offer a Bachelor's thesis which combines thermodynamics with mathematical optimization. The thesis is concerned with topologies of Gibbs free energy and regression of NRTL parameters. This is what we expect from you

  • Sound fundamentals of mixture thermodynamics, including NRTL model and equilibrium condition, preferably also tangent criterion.
  • Basics of programming, e.g., MATLAB
This is what you will take home Das erwartet dich/nimmst du mit
  • Programming with MATLAB
  • Application of COSMO-Therm
  • Case Studies from TMFB
  • Study of criteria for thermodynamic stability
  • Study of mathematical optimization and formulation of regression problems
Please contact moll.glass@avt.rwth-aachen.de or 0241/80 97006 for arranging a meeting (Forckenbeckstraße 51, R A-213)