[QE-developers] Pseudopotentials on QE website

[Pietro Delugas]

I replaced the pseudo files, now they are readable by previous pw versions


On 06/04/2018 16:45, Pietro Delugas wrote:
>
> 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
>> CH-3012 Bern
>> Tel. +41 (0)31 631 5629
>> ulrich.aschauer at dcb.unibe.ch <mailto:ulrich.aschauer at dcb.unibe.ch>
>> www.dcb.unibe.ch
>> Büro: N215
>> --------------------------------------------------------------
>>
>>
>>
>>
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>
>
>
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