[Pw_forum] PP generation for specific exchange and correlation
Keitel Cervantes Salguero
kacsssj at gmail.com
Wed Mar 24 00:08:15 CET 2010
Dear people,
I need to do a calculation with
the OPBE functional (OPTX exchange
and PBE correlation) and PW basis set.
Through the internet I have found that most
of the PPs have only one functional type (the same X and C)
for generation.
Is it correct if I generate my pseudopotential
with the OPTX and PBE type ?
If that is correct, which program do you recommend me ?
Many thanks in advanced.
Best Regards
--
Atte.
Keitel Cervantes Salguero
-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://www.democritos.it/pipermail/pw_forum/attachments/20100323/909a0a35/attachment.htm
More information about the Pw_forum
mailing list