[QE-developers] fatal error reading xml file

[Pietro Delugas]

Hi

I checked your input with version 6.5,  it seems to be working fine.

Your issue could be related with the compiler you are using.

Could  you give us more details ?

regards - Pietro

On 18/02/20 07:40, vinsa kharisma wrote:
> Dear developer of quantum espresso
>
> I have done calculations with quantum espresso starting in version 5 
> and there are no problems in calculating scf, nscf, bands, or dos. but 
> when I use version 6.4.1 there is an error like this:
>
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>      task #         0
>      from read_conf_from_file : error #         1
>      fatal error reading xml file
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
>
> I think this is a bug and I try to use the latest version, which is 
> version 6.5 and do the scf, kpoint, and bandstructure calculations, 
> but when I count nscf,
> there is the same CRASH as version 6.4.1. I have tried asking my 
> professor who has also used quantum espresso for a long time, but he 
> has never experienced an error like this. how is the solution? Please 
> help.
>
> Thank you
> Best Regards
> vinsa
>
> here I attach my input :
>
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> developers at lists.quantum-espresso.org
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