Contributions should be related to applications of molecular simulation and molecular thermodynamics in relation with an industrial problem. The scope also includes the development of engineering methods (equations of state for complex fluids) and experimental work (molecular tools for data gathering and validation) related to or combined with molecular thermodynamic, modeling and simulation. Major areas of interest are:
- Tools :
- MD/MC simulation methods and tools (force fields)
- Coupling molecular tools and equations of state
- Use of multiscale tools in experimental research
- Systems :
- Process and Solvent design for sustainable processes
- Nanoscale Processes
- Porous media, Processes at Surfaces, heterogeneous catalysis
- Applications :
- Water treatment
- CO2 capture and storage
- Electrolyte applications
- Biomolecules
- Polymers
- Reactive Systems












