University of Cologne
Faculty of
Mathematics and Natural Sciences
Institute of
Physical Chemistry
Group of Prof. (ret.) Dr. Ulrich K. Deiters
Thermodynamics
and
Statistical Thermodynamics
ulrich.deiters@uni-koeln.de
April 16, 2024
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 (vapour-liquid, liquid-liquid, solid-fluid, gas-gas)
↓
Theorie of phase diagrams, topological classification (“global phase diagrams”)