Department Chemie und Pharmazie

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 Temperature dependent oxidation of thin Ni layers on Cu(1 1 1) (2002) Domnick R, Held G, Steinrück HP Journal article Strong repulsion and site exclusion in a system with ontop and bridge sites on a one-dimensional lattice: Equilibrium and kinetics (2002) Payne SH, Kreuzer HJ, Kinne M, Denecke R, Steinrück HP Journal article, Original article Kinetic parameters of CO adsorbed on Pt(111) studied by in situ high resolution x-ray photoelectron spectroscopy (2002) Kinne M, Fuhrmann T, Whelan C, Zhu J, Pantförder J, Probst M, Held G, et al. Journal article, Original article