[Pw_forum] carbon pseudopotential

Paolo Giannozzi giannozz at nest.sns.it
Tue Apr 22 13:27:46 CEST 2008


Marci wrote:

> I'm searching for a norm-conserving pbe type pseudo for C.

I have this one, of unknown origin, sitting on my disk since
several years. No warranty.

> is there a way to convert Siesta pseudo to UPF format?

of course there is, but it has to be implemented. There is
a template in upftools/any2upf.f90

Paolo

-- 
Paolo Giannozzi, Democritos and University of Udine, Italy
-------------- next part --------------
An embedded and charset-unspecified text was scrubbed...
Name: Cpbe.mt
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20080422/075b37a3/attachment.ksh>


More information about the users mailing list