Page 1 of 1

Pseudopotentials with GGA Tag in INCAR

Posted: Tue Jul 21, 2009 7:48 pm
by ZachTexas
In order to run GGA calculations using the AM05 functional (as well as any calculations in which the GGA tag is set), which set of pseudopotentials should be used: the LDA (LEXCH=CA in the POTCAR) or the GGA (LEXCH=91) or the PBE (LEXCH=PE)?

Does this change for GGA=RP, PS, LM?

Re: Pseudopotentials with GGA Tag in INCAR

Posted: Wed Sep 11, 2024 2:06 pm
by support_vasp

Hi,

We're sorry that we didn’t answer your question. This does not live up to the quality of support that we aim to provide. The team has since expanded. If we can still help with your problem, please ask again in a new post, linking to this one, and we will answer as quickly as possible.

Best wishes,

VASP