Browsing by Author Wohlthat, Soren

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Issue DateTitleAuthor(s)Citation
2010Accurate and computationally efficient third-nearest-neighbor tight-binding model for large graphene fragmentsHush, Noel; Reimers, Jeffrey; Wohlthat, Soren; Molecular Bioscience; Chemistry; ChemistryAccurate and computationally efficient third-nearest-neighbor tight-binding model for large graphene fragments, Physical Review B (Condensed Matter and Materials Physics), vol.81, 19, 2010,pp 195125-1-195125-8
2008Cluster-based density-functional approach to quantum transport through molecular and atomic contactsWohlthat, Soren; Burkle, M; Cuevas, J C; Hafner, M; Huniar, U; Pauly, Fabian; Schon, G; Viljas, J K; ChemistryCluster-based density-functional approach to quantum transport through molecular and atomic contacts, New Journal of Physics, vol.10, doi:10.1088/1367-2630/10/12/125019, 2008,pp 125019-1-125019-28
2008The conduction properties of alpha,omega-diaminoalkanes and hydrazine bridging gold electrodesReimers, Jeffrey; Wohlthat, Soren; Pauly, Fabian; Chemistry; ChemistryThe conduction properties of alpha,omega-diaminoalkanes and hydrazine bridging gold electrodes, Chemical Physics Letters, vol.454, 4-6, 2008,pp 284-288
2008Highly Conductive Molecular Junctions Based on Direct Binding of Benzene to Platinum ElectrodesWohlthat, Soren; Cuevas, J C; Djukic, D; Kiguchi, M; Krieger, M; Pauly, Fabian; Tal, O; van Ruitenbeek, J M; ChemistryHighly Conductive Molecular Junctions Based on Direct Binding of Benzene to Platinum Electrodes, Physical Review Letters, vol.101, 4, 2008,pp 046801-1-046801-4
2009N-silylamine junctions for molecular wires to gold: The effect of binding atom hybridization on the electronic transmissionKirchner, Thomas; Reimers, Jeffrey; Wohlthat, Soren; Chemistry; Chemistry; ChemistryN-silylamine junctions for molecular wires to gold: The effect of binding atom hybridization on the electronic transmission, The Journal of Physical Chemistry Part C: Nanomaterials and Interfaces, vol.113, 47, 2009,pp 20458-20462
2008Two-dimensional, phenanthroline-based, extended pi-conjugated molecules for single-molecule conductionReimers, Jeffrey; Wohlthat, Soren; Pauly, Fabian; Chemistry; ChemistryTwo-dimensional, phenanthroline-based, extended pi-conjugated molecules for single-molecule conduction, Journal of Physics: Condensed Matter, vol.20, 29, 2008,pp 295208-1-295208-5