IMFUFA-seminar on Computational screening of new materials

Join the IMFUFA seminar when Karsten Jacobsen (DTU) talks about Computational screening of new materials.
Place: Roskilde University, Building 27.1, room I

Electronic structure theory has reached a level where reliable calculations of structure, stability, and a variety of electronic properties can be performed for real materials. In combination with the increasing speed and storage capacity of computer clusters, this has led to a situation where computational screening can be used to suggest new materials. In the talk I shall discuss the application of computational descriptors in materials design, and show some examples of screening studies within structural materials, catalysis, and photoelectronic devices.


The seminar is open for everyone, no registration needed.