Steffen Seiler

Steffen Seiler, M. Sc.

Steffen Seiler

Steffen Seiler

  • Organization: Department of Chemistry and Pharmacy
  • Working group: Professor of Computational Chemistry
  • Phone number: +49 9131 85-20424
  • Fax number: +49 9131 85-20404
  • Email: steffen.seiler@fau.de
  • Address:
    Nägelsbachstraße 25
    91052 Erlangen
    Room 2.304

 

Research topics

  • Study of the sulfuric acid-graphite intercalation compound by means of ab-initio Molecular Dynamics (main project)
  • Nitrogen escape mechanism in the endohedral fullerene N@C60 studied by means of Metadynamics and Umbrella Sampling (side project)
  • Comparison of PBE and PBE-D2/D3 with CCSD(T)@cbs benchmark calculations for the adsorption energies of small molecules on metal oxide clusters (side project)
  • STM image simulations (side project)
  • Application of Bardeen’s tunneling formula for the calculation of STM images (Master’s thesis)