title: Application of semi-empirical and ab initio quantum mechanical calculations.
authors.affiliation: Institut für Organische Chemie der Universität Erlangen-Nürnberg, F.R.G.
authors.forename: P
authors.initials: P
authors.lastname: von Ragué Schleyer
mesh_terms: D003198:Computer Simulation; D008838:Microcomputers; D008958:Models, Molecular; D011789:Quantum Theory