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Potfit: effective potentials from ab-initio data

, and . Modelling and Simulation in Materials Science and Engineering, (2007)

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Self-assembly of complex crystals and quasicrystals with, and . (2007)Vortrag.Self-assembly of Quasicrystals and Approximants in a, and . (2007)Vortrag.Direct Wolf summation of a polarizable force field for silica, , , , , and . The Journal of Chemical Physics, (2010)Influence of polarizability on metal oxide properties studied by molecular dynamics simulations, , , and . Journal of Physics: Condensed Matter (selected for inclusion in IOPselect), (2012)Simulating structure and physical properties in complex metallic alloys, , , , , , and . Proceedings of the 3rd European School in Materials Science, Ljubljana, Mai 2007; in press, Word Scientific, (2008)Empirical effective potentials for complex metallic alloys, and . (2007)Vortrag.Development and Test of Interaction Potentials for Complex Metallic Alloys (Entwicklung und Test von Wechselwirkungspotenzialen für komplexe intermetallische Verbindungen). Institut für Theoretische und Angewandte Physik, Universität Stuttgart, (2008)Potfit: effective potentials from ab-initio data, and . Modelling and Simulation in Materials Science and Engineering, (2007)Scalable molecular dynamics simulations of oxides, and . Verhandlungen der Deutschen Physikalischen Gesellschaft, 1, (2008)Ab initio based polarizable force field generation and application to liquid silica and magnesia, , , and . The Journal of Chemical Physics, (2011)