Department Chemie und Pharmazie

Efficient methods to calculate dynamic hyperpolarizability tensors by time-dependent density-functional theory (2002) Heinze H, Della Sala F, Görling A Journal article, Original article Electron spectroscopic studies of iron and iridium silicides (2002) Probst M, Denecke R, Whelan C, Kinne M, Borgmann D, Steinrück HP Journal article, Original article Dissociation and oxidation of methanol on Cu(110) (2002) Ammon C, Bayer A, Held G, Richter B, Schmidt T, Steinrück HP Journal article An in situ photoemission study of the dehydrogenation reaction of methanol on Ni(1 0 0) (2002) Neubauer R, Whelan C, Denecke R, Steinrück HP Journal article, Original article On the stacking behavior of functionalized single-wall carbon nanotubes (2002) Kukovecz A, Kramberger C, Holzinger M, Kuzmany H, Schalko J, Mannsberger M, Hirsch A Journal article, Original article Negative molecular ions of azafullerenes and their hydrogenated derivatives (2002) Vasil’ev Y, Abzalimov R, Nasibullaev S, Tuktarov R, Hauke F, Reuther U, Hirsch A, Drewello T Journal article, Original article Interaction of a water soluble fullerene derivative with reactive oxygen species and model enzymatic systems (2002) Foley S, Curtis A, Brettreich M, Hirsch A, Pelegrin A, Seta P, Larroque C Journal article, Original article End-cap stabilized oligoynes: Model compounds for the linear sp carbon allotrope carbyne (2002) Gibtner T, Hampel F, Gisselbrecht JP, Hirsch A Journal article, Original article A highly regioselective approach to multiple adducts of C60 governed by strain minimization of macrocyclic malonate addends (2002) Reuther U, Brandmüller T, Donaubauer W, Hampel F, Hirsch A Journal article, Original article GIAO-DFT calculated and experimentally derived complexation-induced chemical shifts of calix[4]arene-solvent inclusion complexes (2002) Schatz J Journal article, Original article