Okay I understand
Thanks for all the useful information and support!
Best regards,
Giacomo
On 24/04/2025 11:06, Pietro Davide Delugas wrote:
Dear Giacomo
Those tests should be skipped unless you have compiled linking with
libxc.
So, if you have compiled without linking libxc, nothing to
lugas ; Quantum ESPRESSO users Forum
Subject: Re: [QE-users] Test-suite failing QE-7.4.1
Thank you very much Pietro!
Now the tests run and I get:
All done. ERROR: only 248 out of 253 tests passed.
Failed tests in:
/home/giacomo/espresso/test-suite/pw_libxc/
/home/giacomo/espresso
Thank you very much Pietro!
Now the tests run and I get:
All done. ERROR: only 248 out of 253 tests passed.
Failed tests in:
/home/giacomo/espresso/test-suite/pw_libxc/
/home/giacomo/espresso/test-suite/pw_metaGGA/
In the *.err.* files of pw_libxc there is:
MPI_ABORT was invoke
Yes
It's obviously a typo. Probably I added the trailing space in the tarball when
I was testing the CMake builds.
Sorry.
I removed it from the tarball.
Redownload the package or just remove the space.
Pietro
Il 20 apr 2025 12:12 PM, Giacomo De Santis via users
ha scritto:
Hi,
I'm a new us
On 20/04/2025 12:11, Giacomo De Santis via users wrote:
So I think the problem is the space between /home/giacomo/numerical-
methods/modulo7/qe-7.4.1/test-suite/../ (which is ESPRESSO_BUILD env var
in ENVIRONMENT) and /bin/pw.x.
Why there is such space which cause the "Is a directory" error?
I'd like to add some more details to my previous post.
The SKIPPED tests (shown below) seem to be related to libxc. Am I correct to
understand that linking libxc should fix these issues?
pw_libxc - lda_pol_atom-lsda.in: SKIPPED.
pw_libxc - gga_unpol_atom-pbe.in: SKIPPED.
pw_libxc - hyb_gga_unpol
to build are simply running the configure script
without any options and then using make -j 12 all.
Best regards,
Ian Dunn
ASML
From: users On Behalf Of Pietro
Davide Delugas
Sent: Thursday, April 3, 2025 2:39 AM
To: Ian Dunn via users
Subject: Re: [QE-users] Test-suite failing QE-7.4.1
lugas
Sent: Thursday, April 3, 2025 2:39 AM
To: Ian Dunn via users
Subject: Re: [QE-users] Test-suite failing QE-7.4.1
CAUTION: This message is from an external sender
Dear Ian
We checked the test suite with as many toolchains as possible and all tests
were passing for 7.4.1.
The failures you r
Dear Ian
We checked the test suite with as many toolchains as possible and all
tests were passing for 7.4.1.
The failures you report may be due to your particular build. Could you
send us the details of your build ?
In general can always verify the status ( of the develop ) at this link:
htt
On 03/04/2025 04:46, Ian Dunn via users wrote:
The SKIPPED tests (shown below) seem to be related to libxc. Am I
correct to understand that linking libxc should fix these issues?
correct.
It looks like your compiler is mis-compiling some parts of the phonon
code.It might also be a problem w
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