[CP2K-user] Goedecker-Teter-Hutter (GTH) pseudopotentials

[ahadal... at gmail.com]

Can someone elaborate me the difference between the when defining the element: 

Cu GTH-PADE-q11 GTH-LDA-q1

Cu GTH-PADE-q11 GTH-LDA-q11

Cu GTH-PADE-q11 GTH-LDA-q19

In pseudopotentials database. And how to know which one is appropriate while calculating energy and forces. 

-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20190212/0b67a258/attachment.htm>