Speaker
Jan Vorberger
(HZDR)
Description
Libxc, one of a few available libraries for exchange-correlation functionals, currently contains well above 100 different LDA, GGA, hybrid GGA, meta-GGA, and hybrid meta-GGA functionals. The aim of this talk is to show the results of trying quite a few of these for different warm dense matter states and different properties. When possible, quantum Monte Carlo data will be used to benchmark the DFT results.
Primary author
Jan Vorberger
(HZDR)