theofem.de - Theory of Functional Energy Materials (TheoFEM)

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Theory of Functional Energy Materials (TheoFEM)

We use and develop modern theoretical tools to describe functional energy materials at the microscopic level. Our goal is to understand and predict electronic, optical, and dynamical properties in a wide range of complex materials systems. These include hybrid molecule-metal interfaces, halide perovskites, organic semiconductors, ion conductors, photocatalytically active molecules and more. To this end we combine quantum-mechanical methods, molecular dynamics, and state-of-the-art computational techniques,

24.05.2023: David has been promoted to Associate Professor with a permanent W3 position (see here ), many congratulations!

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