[Q-e-developers] virtual.x bug

[Paolo Giannozzi]

Oops ... fixed, thank you - Paolo

On Fri, Oct 13, 2017 at 4:38 PM, Stefano Dal Forno <
s.dal-forno at imperial.ac.uk> wrote:

> Hi there,
>
> Long story short, I got this error when using virtual.x
>
>      Error in routine set_dft_from_name (1):
>      : unrecognized dft
>
> So I took a look at the source and found that the
> compute_virtual(x,filein) subroutine in virtual.f90 was importing the
> module pseudo, I changed the import to "use pseudo_mod".
> Then I set to public all the variables in read_upf.f90 (aka the
> pseudo_mod).
> Now all the variables are defined within virtual.x and everything is
> working.
> I hope this helps.
>
> Cheers,
> Stefano.
>
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>
>


-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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