Update CP2K easyblock for v2024 and v2025

[pavelToman]

replaced by:

• Update CP2K easyblock for v2024 and v2025 #3892

[pavelToman]

@boegelbot please test @ jsc-zen3 EB_ARGS="CP2K-2023.1-foss-2023a.eb"

[boegelbot]

@pavelToman: Request for testing this PR well received on jsczen3l1.int.jsc-zen3.fz-juelich.de

PR test command 'if [[ develop != 'develop' ]]; then EB_BRANCH=develop ./easybuild_develop.sh 2> /dev/null 1>&2; EB_PREFIX=/home/boegelbot/easybuild/develop source init_env_easybuild_develop.sh; fi; EB_PR=3888 EB_ARGS="CP2K-2023.1-foss-2023a.eb" EB_REPO=easybuild-easyblocks EB_BRANCH=develop /opt/software/slurm/bin/sbatch --job-name test_PR_3888 --ntasks=8 ~/boegelbot/eb_from_pr_upload_jsc-zen3.sh' executed!

• exit code: 0
• output:

Submitted batch job 7590

Test results coming soon (I hope)...

- notification for comment with ID 3187752547 processed

Message to humans: this is just bookkeeping information for me,
it is of no use to you (unless you think I have a bug, which I don't).

[pavelToman]

@boegelbot please test @ jsc-zen3 EB_ARGS="CP2K-2023.1-foss-2023a.eb --try-amend='tests_maxtasks=4'"

[boegelbot]

@pavelToman: Request for testing this PR well received on jsczen3l1.int.jsc-zen3.fz-juelich.de

PR test command 'if [[ develop != 'develop' ]]; then EB_BRANCH=develop ./easybuild_develop.sh 2> /dev/null 1>&2; EB_PREFIX=/home/boegelbot/easybuild/develop source init_env_easybuild_develop.sh; fi; EB_PR=3888 EB_ARGS="CP2K-2023.1-foss-2023a.eb --try-amend='tests_maxtasks=4'" EB_REPO=easybuild-easyblocks EB_BRANCH=develop /opt/software/slurm/bin/sbatch --job-name test_PR_3888 --ntasks=8 ~/boegelbot/eb_from_pr_upload_jsc-zen3.sh' executed!

• exit code: 0
• output:

Submitted batch job 7593

Test results coming soon (I hope)...

- notification for comment with ID 3188267534 processed

Message to humans: this is just bookkeeping information for me,
it is of no use to you (unless you think I have a bug, which I don't).

[boegelbot]

Test report by @boegelbot

Overview of tested easyconfigs (in order)

• SUCCESS CP2K-2023.1-foss-2023a.eb

Build succeeded for 1 out of 1 (1 easyconfigs in total)
jsczen3c2.int.jsc-zen3.fz-juelich.de - Linux Rocky Linux 9.6, x86_64, AMD EPYC-Milan Processor (zen3), Python 3.9.21
See https://gist.github.com/boegelbot/c61735f3eff21f0682c5160729c82cfb for a full test report.

[pavelToman]

@boegelbot please test @ jsc-zen3 EB_ARGS="CP2K-2023.1-foss-2023a.eb"

Failed with "_project_def-maintainers_boegelbot_rocky9_zen3_software_CP2K_2023.1-foss-2023a.lock already exists, aborting!"

[boegelbot]

@pavelToman: Request for testing this PR well received on jsczen3l1.int.jsc-zen3.fz-juelich.de

PR test command 'if [[ develop != 'develop' ]]; then EB_BRANCH=develop ./easybuild_develop.sh 2> /dev/null 1>&2; EB_PREFIX=/home/boegelbot/easybuild/develop source init_env_easybuild_develop.sh; fi; EB_PR=3888 EB_ARGS="CP2K-2023.1-foss-2023a.eb" EB_REPO=easybuild-easyblocks EB_BRANCH=develop /opt/software/slurm/bin/sbatch --job-name test_PR_3888 --ntasks=8 ~/boegelbot/eb_from_pr_upload_jsc-zen3.sh' executed!

• exit code: 0
• output:

Submitted batch job 7599

Test results coming soon (I hope)...

- notification for comment with ID 3191051357 processed

Message to humans: this is just bookkeeping information for me,
it is of no use to you (unless you think I have a bug, which I don't).

[pavelToman]

@boegelbot please test @ jsc-zen3 EB_ARGS="CP2K-2023.1-foss-2023a.eb"

Ok

[boegelbot]

@pavelToman: Request for testing this PR well received on jsczen3l1.int.jsc-zen3.fz-juelich.de

PR test command 'if [[ develop != 'develop' ]]; then EB_BRANCH=develop ./easybuild_develop.sh 2> /dev/null 1>&2; EB_PREFIX=/home/boegelbot/easybuild/develop source init_env_easybuild_develop.sh; fi; EB_PR=3888 EB_ARGS="CP2K-2023.1-foss-2023a.eb" EB_REPO=easybuild-easyblocks EB_BRANCH=develop /opt/software/slurm/bin/sbatch --job-name test_PR_3888 --ntasks=8 ~/boegelbot/eb_from_pr_upload_jsc-zen3.sh' executed!

• exit code: 0
• output:

Submitted batch job 7602

Test results coming soon (I hope)...

- notification for comment with ID 3191457485 processed

Message to humans: this is just bookkeeping information for me,
it is of no use to you (unless you think I have a bug, which I don't).

[boegelbot]

Test report by @boegelbot

Overview of tested easyconfigs (in order)

• FAIL (build issue) CP2K-2023.1-foss-2023a.eb (partial log available at https://gist.github.com/boegelbot/333998d4639dd58c3d4af7d8a41fe992)

Build succeeded for 0 out of 1 (1 easyconfigs in total)
jsczen3c2.int.jsc-zen3.fz-juelich.de - Linux Rocky Linux 9.6, x86_64, AMD EPYC-Milan Processor (zen3), Python 3.9.21
See https://gist.github.com/boegelbot/e4dc429d9051e661f71cc8a62b865235 for a full test report.

[boegelbot]

Test report by @boegelbot

Overview of tested easyconfigs (in order)

• SUCCESS CP2K-2023.1-foss-2023a.eb

Build succeeded for 1 out of 1 (1 easyconfigs in total)
jsczen3c2.int.jsc-zen3.fz-juelich.de - Linux Rocky Linux 9.6, x86_64, AMD EPYC-Milan Processor (zen3), Python 3.9.21
See https://gist.github.com/boegelbot/9e278c915b64ff4e92c2dc1138345a7a for a full test report.

[pavelToman]

Try alt version to debug v2024 failing tests:

• Update CP2K easyblock for v2024 and v2025 #3892

[pavelToman]

Replaced by:

• Update CP2K easyblock for v2024 and v2025 #3892