Molecular dynamics simulations of biomolecular systems. (ETH Hönggerberg)

Density functional quantum chemistry, molecular response properties, and computational studies of chemisorption and catalysis.

Ab initio quantum chemistry, molecular response properties, and nonlinear optical properties.

Ab initio quantum chemistry, molecular response properties, and explicitly correlated electronic wavefunctions.

Ab initio quantum chemistry and computational thermochemistry.

Ab initio quantum chemistry and computational studies of superconductors.

Condensed matter science, surface science and statistical mechanics of complex and disordered systems.

Computational chemistry.

Computational chemistry.

Areas of research include reaction mechanisms and the electronic structure of molecules (Indiana University).