[Pw_forum] PB mixing PP produced with ld1 with virtual.x
Nicola Marzari
marzari at MIT.EDU
Thu Jun 12 14:37:51 CEST 2008
Jérémie Teyssier wrote:
> Dear all
>
>
>
> I have produced a PP for Bi that works pretty well. I would like to mix
> it with another PP but virtual returns this error message :
>
>
>
> ./virtual.x
>
>
>
> Generate the UPF pseudopotential for a virtual atom
>
> combining two pseudopootentials in UPF format
Dear Jeremie,
hopefully someone will reply about your specific error message
(looks to me just a matter of compatibility between reading upf formats).
Do note though that virtual.x has some (simple) bugs - we are working
on it these days. Be in touch with Jivtesh Garg <jivtesh at MIT.EDU>.
nicola
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