:29:27 AM
To: Quantum ESPRESSO users Forum
Subject: Re: [QE-users] Tracing MPI buidl of QE 7.0 malfuction (gfortranm
OpenMPI).
I only said edit ENVIRONMENT. The download script will add the pseudopotential
file name to NETWORK_PSEUDO and download the file.
https://www.quantum-espresso.org/wp
on behalf of Ye
> Luo
> Sent: Friday, February 4, 2022 12:39 AM
> To: Quantum ESPRESSO users Forum
> Subject: Re: [QE-users] Tracing MPI buidl of QE 7.0 malfuction (gfortranm
> OpenMPI).
>
>
> export NETWORK_PSEUDO=
> http://www.quantum-espresso.org/wp-content/uploads/upf_file
o.org Port 443
From: users on behalf of Ye Luo
Sent: Friday, February 4, 2022 12:39 AM
To: Quantum ESPRESSO users Forum
Subject: Re: [QE-users] Tracing MPI buidl of QE 7.0 malfuction (gfortranm
OpenMPI).
export
NETWORK_PSEUDO=http://www.quantum-espresso.o
>
>
> export NETWORK_PSEUDO=
> http://www.quantum-espresso.org/wp-content/uploads/upf_files/
> to
> export NETWORK_PSEUDO=
> https://www.quantum-espresso.org/wp-content/uploads/upf_files/
> in the file
> ENVIRONMENT
>
Yes this is what I meant. You also need to delete all the bad ones left on
the
ry 3, 2022 10:26 PM
To: Quantum ESPRESSO users Forum
Subject: [QE-users] Tracing MPI buidl of QE 7.0 malfuction (gfortranm OpenMPI).
Hi
I am trying to find why the MPI build (gfortan + OpenMP) does not work for QE
6.6-7.0
The code stops in the routine
good_fft_order (in fft_support.f90)
on follo
o] Error 255
>
>
> Sound like the server with pseudopotential is down (I am fully connected -
> no block).
>
>
> Any more advice is strongly appreciated ...
>
>
> Michal Husak
>
>
>
>
> From: users on behalf of Husak
&g
...
Michal Husak
From: users on behalf of Husak
Michal
Sent: Thursday, February 3, 2022 10:26 PM
To: Quantum ESPRESSO users Forum
Subject: [QE-users] Tracing MPI buidl of QE 7.0 malfuction (gfortranm OpenMPI).
Hi
I am trying to find why the MPI build
build QE without MPI without OpenMP, run test-suite. To check if your
compiler and library works.
build QE with MPI without OpenMP, run test-suite. To check if your MPI
library works properly.
build QE without MPI but with OpenMP, run test-suite. To check if OpenMP is
the issue.
build QE with MPI a
Hi
I am trying to find why the MPI build (gfortan + OpenMP) does not work for QE
6.6-7.0
The code stops in the routine
good_fft_order (in fft_support.f90)
on following statement
IF (np <= 0 .OR. np > nr) &
This is called from
realspace_grid_init (in fft_types.f90) ...
Following command ge
