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

[Jibiao Li]

Hi, Paolo


I downloaded those pp files from the offical website of QE. I am using QE 6.4.1. What's wrong with the PP files?


Jibiao Li





------------------ Original ------------------
From: "p.giannozzi"<p.giannozzi at gmail.com>;
Date: Sat, Jun 20, 2020 06:16 PM
To: "Quantum ESPRESSO users Forum"<users at lists.quantum-espresso.org>;

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



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 foxmail.com, jibiao.li at hotmail.com
Homepage: 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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