[QE-users] PAW basis sets for the actinoids

[Malte Sachs]

Dear Quantum Espresso community,

during my PhD I have created a set of scalar- and fully-relativistic PAW 
basis sets for the actinoids from Th to Lr with the ld1.x code. If you 
are interested in these, please visit our group homepage:

https://www.uni-marburg.de/de/fb15/arbeitsgruppen/ag-kraus/forschung/paw_datasets_for_the_actinoids

Best regards,

Malte Sachs

-- 
Dr. Malte Sachs
Anorganische Chemie, Fluorchemie
Philipps-Universität Marburg
Hans-Meerwein-Straße 4
35032 Marburg (Paketpost: 35043 Marburg)
Tel.: +49 (0)6421 28 - 25 68 0
http://www.uni-marburg.de/fb15/ag-kraus/