[QE-users] Compile QE 6.8

Lorenzo Paulatto lorenzo.paulatto at cnrs.fr
Wed Nov 16 15:07:54 CET 2022


I would guess that your ifort installation is not configured correctly. 
Tipcally as part of the ifort installation you get a script called 
setvars.sh or someting similar, it depends on the version. Run it like

source /path/to/setvars.sh

(or variabt depending on teh version) and you should be fine.

On 16/11/2022 14:59, Riccardo Piombo uniroma1 via users wrote:

> Dear comunity,
>
> I'm trying to compile QE on ubuntu 18.04. I have followed the 
> instructions written in the documentation and I have successfully 
> compiled the software without any errors.
>
> However, as soon as I try to launch any type of job the following 
> error shows up:
>
> /error while loading shared libraries: libmkl_scalapack_lp64.so: 
> cannot open shared object file: No such file or directory/
>
> It is very strange that such an error appears as ./configure did not 
> report any errors.
>
>
> Could someone help me out?
>
> Thanks in advance for your help.
>
>
> Riccardo Piombo
>
> Post doc researcher in Condensed Matter Physics at Sapienza University 
> of Rome
>
>
> _______________________________________________
> The Quantum ESPRESSO community stands by the Ukrainian
> people and expresses its concerns about the devastating
> effects that the Russian military offensive has on their
> country and on the free and peaceful scientific, cultural,
> and economic cooperation amongst peoples
> _______________________________________________
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
> users mailing listusers at lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/users
-- 
Dr. Lorenzo Paulatto
IdR @ IMPMC - CNRS UMR 7590 & Sorbonne Université
phone: +33 (0)1 442 79822 / skype: paulatz
http://www.impmc.upmc.fr/~paulatto/ - https://anharmonic.github.io/
23-24/423 B115, 4 place Jussieu 75252 Paris CX 05
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20221116/8d74012c/attachment.html>


More information about the users mailing list