Department Chemie und Pharmazie

Excited state conformational dynamics of semiflexibly bridged electron donor-acceptor systems: a semiempirical CI-study including solvent effects (2002) Clark T, Bleisteiner B, Schneider S Journal article Accumulation of non-enzymatic glycation products on proteins and DNA (2002) Kislinger T, Schneider M, Pischetsrieder M Book chapter / Article in edited volumes Interaction of oxygen with palladium deposited on a thin alumina film (2002) Libuda J Journal article Characterization of oxidized SWCNTs by XPS (2002) Holzinger M, Hirsch A, Hennrich F, Kappes M, Dziakova A, Ley L, Graupner R Book chapter / Article in edited volumes Ropes of Carbon Nanotube Intramolecular Junctions (2002) Hassanien A, Holzinger M, Hirsch A, Venturini P, Prodan A, Tokumoto M, Bernier P Book chapter / Article in edited volumes A QSPR-approach to the estimation of the pK(HB) of six-membered nitrogen-heterocycles using quantum mechanically derived descriptors (2002) Hennemann M, Clark T Journal article The asymptotic region of the Kohn-Sham exchange potential in molecules (2002) Della Sala F, Görling A Journal article, Original article Orbitals from a self-interaction free Kohn-Sham potential as a single electron basis for ab initio methods (2002) Hupp T, Engels B, Della Sala F, Görling A Journal article, Original article Excitonic optical spectrum of semiconductors obtained by time-dependent density-functional theory with the exact-exchange kernel (2002) Kim YH, Görling A Journal article, Original article Exact Kohn-Sham exchange kernel for insulators and its long-wavelength behavior (2002) Kim YH, Görling A Journal article, Original article