[QE-developers] Pseudopotentials on QE website

[Pietro Delugas]

Sorry Uli and thanks for reporting the issue.

my fault. I made tests with recent versions and I overlooked previous 
ones. The previous xml reader is not reading correctly the CDATA sections.

The best thing to do is to drop using the CDATA for a long while and 
write backward compatible pseudos again.

I will fix the pseudos as soon as possible. In the meantime just wipe 
away the whole pp_info section before using the pseudo an they  will 
work  again.

Sorry for the incovenience.

    Pietro


On 06/04/2018 15:51, ulrich.aschauer at dcb.unibe.ch wrote:
> Dear All,
>
> It seems that there was recently a change to the pseudopotential part 
> of the QE website. Now all (at least those we tried) pseudos from the 
> original QE PP library contain some extra CDATA tags in the PP_INFO 
> section that don’t seem to play nice with actually reading the pseudos 
> in a pw.x calculation. For the PS library potentials the CDATA tags 
> seems to be elsewhere but they also fail.
>
> Is this some unwanted side effect or would these be readable only with 
> a more recent version of QE than we tried (in that case backwards 
> compatibility would be an issue)?
>
> Best regards,
> -uli
> --------------------------------------------------------------
> SNF Prof. Dr. Ulrich Aschauer
> Universität Bern
> Departement für Chemie und Biochemie
> Freiestrasse 3
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> ulrich.aschauer at dcb.unibe.ch <mailto:ulrich.aschauer at dcb.unibe.ch>
> www.dcb.unibe.ch
> Büro: N215
> --------------------------------------------------------------
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