DFT in the f-block


DFT in the f-block

Patzschke, M.

Computational chemistry has become an important tool. The most popular approaches are based on the electronic density, methods known as DFT calculations. We review the basic principles as well as the applicability to f-element systems.

Keywords: Computational chemistry; DFT; f-elements

  • Invited lecture (Conferences)
    EUFEN 4, 09.04.2015, Lissabon, Portugal

Permalink: https://www.hzdr.de/publications/Publ-23971
Publ.-Id: 23971