[QE-users] XML Parser Error CPMD
Pietro Delugas
pdelugas at sissa.it
Sun Apr 12 08:39:42 CEST 2020
Hi
the problem is with the pseudo files not with the xml file produced by
cp.x.
There is probably some hidden forbidden character in the string functional
functional="SLA PW NOGX NOGC"
if you retype the string with an editor in all your upf files
everything should work fine.
It would look like an issue of program that generates the pseudos, only
with the functional string, but I have been using ONCVPSP pseudos
quite often and never met such issue before.
kind regards
Pietro
On 11/04/20 16:13, bikash sankar kanungo wrote:
> While restarting a CPMD run (using cp.x), I get the following error
> message,
>
> PARSE_ERR
> 81 runParser
> abort:
>
> I believe this to be an XML parsing error, but I'm unable to find the
> source of it. More importantly, I don't get this error while
> restarting for a smaller system. I tried to perform a sanity check
> with xmllint, but didn't find anything spurious. Can you please help
> me identify the source of the error?
>
> You can access the input and restart files in this Google Drive
> Folder:
> https://drive.google.com/drive/folders/15VMIFGs7Vs6Ultw8uZq9893PmgoA9YTx?usp=sharing
>
> Thanks,
> Bikash
>
>
>
> --
> Bikash Kanungo
> Postdoctoral Research Fellow,
> Computational Materials Physics,
> Mechanical Engineering,
> University of Michigan
> (+1)734-741-3244
>
> _______________________________________________
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu/quantum-espresso)
> users mailing list users at lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/users
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20200412/2e0c6e52/attachment.html>
More information about the users
mailing list