Computer Simulations

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• How positively and negatively charged ions behave at interfaces
  

  How positively and negatively charged ions behave at the interface between a solid surface and an aqueous solution has been investigated by researchers from the Cluster of Excellence RESOLV at the Ruhr-Universität Bochum, its sister research network CALSOLV in Berkeley, and the University of Evry in more

• Where does gold come from?
  

  How are chemical elements produced in our Universe? Where do heavy elements like gold and uranium come from? Using computer simulations, a research team from the GSI Helmholtzzentrum für Schwerionenforschung in Darmstadt, together with colleagues from Belgium and Japan, shows that the synthesis of h more

• New images lead to better prediction of shear thickening
  

  For the first time, researchers have been able capture images providing unprecedented details of how particles behave in a liquid suspension when the phenomenon known as shear thickening takes place. The work allows us to directly understand the processes behind shear thickening, which had previousl more

Publications Computer Simulations

• Relating the structure factors of two-dimensional materials in planar and spherical geometries

  Scattering structure factors provide essential insight into material properties and are routinely obtained in experiments, computer simulations, and theoretical analyses. Different approaches favor different geometries of the material. In case of lipid bilayers, scattering experiments can be perform more

• Squeezing and stick-slip friction behaviors of lubricants in boundary lubrication [Applied Physical Sciences]

  Lubricant films under extreme confinement at nanometer scales play a crucial role in lubrication engineering. Improved understanding of squeezing and friction behaviors of such ultrathin films can lead to strategies for preventing surface failure and efficient national energy usage. Through computer more

• Effective interaction potentials for model amphiphilic surfactants adsorbed at fluid–fluid interfaces

  Computer simulations are a useful tool to explore the effects of interactions and structure of surfactants on interfacial microstructure and properties. Starting with “molecular-level”, three-dimensional reference systems of short amphiphilic surfactants at fluid–fluid interfaces, we here derive eff more