Dr. Swart's was supervised by Prof. Dr. J.G. Snijders, Prof. Dr. H.J.C. Berendsen, and Prof. Dr. G.W. Canters. Publications by Marcel Swart and coworkers can be found on the web site of Prof. Snijders' group.
Topics treated in the thesis include: generation of force fields from density functional calculations, improvement and applications of QM/MM methods in ADF, and calculations of magnetic and optical properties of copper proteins.
