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    Convergence of an implicit Voronoi finite volume method for reaction-diffusion problems
    (Berlin : Weierstraß-Institut für Angewandte Analysis und Stochastik, 2013) Fiebach, André; Glitzky, Annegret; Linke, Alexander
    We investigate the convergence of an implicit Voronoi finite volume method for reaction- diffusion problems including nonlinear diffusion in two space dimensions. The model allows to handle heterogeneous materials and uses the chemical potentials of the involved species as primary variables. The numerical scheme uses boundary conforming Delaunay meshes and preserves positivity and the dissipative property of the continuous system. Starting from a result on the global stability of the scheme (uniform, mesh-independent global upper and lower bounds), we prove strong convergence of the chemical activities and their gradients to a weak solution of the continuous problem. In order to illustrate the preservation of qualitative properties by the numerical scheme, we present a long-term simulation of the Michaelis-Menten-Henri system. Especially, we investigate the decay properties of the relative free energy and the evolution of the dissipation rate over several magnitudes of time, and obtain experimental orders of convergence for these quantities.
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    Uniform global bounds for solutions of an implicit Voronoi finite volume method for reaction-diffusion problems
    (Berlin : Weierstraß-Institut für Angewandte Analysis und Stochastik, 2012) Fiebach, André; Glitzky, Annegret; Linke, Alexander
    We consider discretizations for reaction-diffusion systems with nonlinear diffusion in two space dimensions. The applied model allows to handle heterogeneous materials and uses the chemical potentials of the involved species as primary variables. We propose an implicit Voronoi finite volume discretization on regular Delaunay meshes that allows to prove uniform, mesh-independent global upper and lower L bounds for the chemical potentials. These bounds provide the main step for a convergence analysis for the full discretized nonlinear evolution problem. The fundamental ideas are energy estimates, a discrete Moser iteration and the use of discrete Gagliardo-Nirenberg inequalities. For the proof of the Gagliardo-Nirenberg inequalities we exploit that the discrete Voronoi finite volume gradient norm in 2d coincides with the gradient norm of continuous piecewise linear finite elements.
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    Self-heating effects in organic semiconductor devices enhanced by positive temperature feedback
    (Berlin : Weierstraß-Institut für Angewandte Analysis und Stochastik, 2012) Fischer, Axel; Pahner, Paul; Lüssem, Björn; Leo, Karl; Scholz, Reinhard; Koprucki, Thomas; Fuhrmann, Jürgen; Gärtner, Klaus; Glitzky, Annegret
    We studied the influence of heating effects in an organic device containing a layer sequence of n-doped / intrinsic / n-doped C60 between crossbar metal electrodes. A strong positive feedback between current and temperature occurs at high current densities beyond 100 A/cm2, as predicted by the extended Gaussian disorder model (EGDM) applicable to organic semiconductors. These devices give a perfect setting for studying the heat transport at high power densities because C60 can withstand temperatures above 200ʿ C. Infrared images of the device and detailed numerical simulations of the heat transport demonstrate that the electrical circuit produces a superposition of a homogeneous power dissipation in the active volume and strong heat sources localized at the contact edges ...