[QE-users] ONCV pseudopotential files are "not readable"

Paolo Giannozzi p.giannozzi at gmail.com
Sat Jun 20 12:16:36 CEST 2020


Where did you find those pseudopotentials, and which version of QE are you
using?

Paolo

On Sat, Jun 20, 2020 at 3:05 AM Jibiao Li <jibiaoli at foxmail.com> wrote:

> Dear All,
>
> I am trying to perform calculations using ONCV pseudopotential files
> online, but the calculations always complain that the files are "not
> readable".  Any idea to resolve this issue?
>
>
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>      task #         6
>      from readpp : error #         1
>      file /home/yons/pseudo/ONCV/H_ONCV_PBE_sr.UPF not readable
>
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
>
>
>
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>      task #        33
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%     file
> /home/yons/pseudo/ONCV/H_ONCV_PBE     task #        38      from readpp :
> error #         1
>      file /home/yons/pseudo/ONCV/H_ONCV_PBE_sr.UPF not readable
>
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
> %%%%%%%%%%%%%%%%%%% %%%%%%%%%%%%%%%
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
>
>
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>      task #         4
>
>
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>      task #        37      from readpp : error #         1     from readpp
> : error #         1
>      file /home/yons/pseudo/ONCV/H_ONCV_PBE_sr.UPF not readable
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%     f
> le /home/yons/pseudo/ONCV/H_ONCV_PBE_sr.UPF not readable
>
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
> %%%%
>
>
> ------------------------------
> *Dr. Jibiao Li, *
> *Department of Material Science and Engineering*
> *Yangtze Normal University*
> *Juxian Dadao 16#, Fuling, Chongqing, China*
> *Email: jibiaoli at yznu.edu.cn <jibiaoli at yznu.edu.cn>, jibiaoli at foxmail.com
> <jibiaoli at foxmail.com>, jibiao.li at hotmail.com <jibiao.li at hotmail.com>*
> *Homepage: https://www.researchgate.net/profile/Jibiao_Li
> <https://www.researchgate.net/profile/Jibiao_Li>*
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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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