A3 Multiscale Modeling and Simulation

Control over charge transfer through molecular wires by temperature and chemical structure modifications (2010) Wielopolski M, De Miguel Rojas G, Van Der Pol C, Brinkhaus L, Katsukis G, Bryce M, Clark T, Guldi DM Journal article, Original article An augmented BV setting for feedback switching control (2010) Hante F, Leugering G, Seidman TI Journal article Force statistics and correlations in dense granular packings (2010) Müller MK, Luding S, Pöschel T Journal article, Original article Multidisciplinary Free Material Optimization (2010) Haslinger J, Kocvara M, Leugering G, Stingl M Journal article On the equilibrium of elastic bodies containing thin rigid inclusions (2010) Leugering G, Khludnev AM Journal article Dendronizing and metalating trans-2 C60 tetraaryl porphyrins - A versatile approach toward water-soluble donor-acceptor conjugates (2010) Ruppert M, Spänig F, Wielopolski M, Jäger C, Bauer W, Clark T, Hirsch A, Guldi DM Journal article, Original article Random phase approximation correlation energies with exact Kohn-Sham exchange (2010) Heßelmann A, Görling A Journal article, Original article Molecular wires in single-molecule junctions: Charge transport and vibrational excitations (2010) Ballmann S, Hieringer W, Secker D, Zheng Q, Gladysz JA, Görling A, Weber HB Journal article, Original article Hyperfine coupling constants of the nitrogen and phosphorus atoms: A challenge for exact-exchange density-functional and post-Hartree-Fock methods (2010) Kaupp M, Arbuznikov AV, Heßelmann A, Görling A Journal article, Original article Extension of exact-exchange density functional theory of solids to finite temperatures (2010) Greiner M, Carrier P, Görling A Journal article, Original article