University of Cologne


Group of Prof. Dr. Ulrich K. DeitersThermodynamics
and


ulrich.deiters@unikoeln.de 
Research topics:Calculation of intermolecular interaction potentials with quantum mechanical methods ↓ Calculation of thermodynamic properties from interaction potentials by computer simulation ↓ Development of equations of state for fluid (= gaseous, liquid oder supercritical) pure substances and mixtures ↓ Calculation of all thermodynamic properties of fluid pure substances or mixtures : pVT relations, caloric data, speed of sound, phase equilibria (vapourliquid, liquidliquid, solidfluid, gasgas) ↓ Theorie of phase diagrams, topological classification (“global phase diagrams”) 