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{chem}[iimpi/2020a] Libint v2.6.0 (with CP2K-specific configuration) #11099

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merged 2 commits into from
Aug 13, 2020

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@boegel boegel commented Aug 12, 2020

(created using eb --new-pr)
requires updated Libint easyblock (see easybuilders/easybuild-easyblocks#2116)

@boegel boegel added the update label Aug 12, 2020
boegel added a commit to boegel/easybuild-easyconfigs that referenced this pull request Aug 12, 2020
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@boegel: Tests failed in GitHub Actions, see https://github.com/easybuilders/easybuild-easyconfigs/actions/runs/205478346
Output from first failing test suite run:

ERROR: test__parse_easyconfig_Libint-2.6.0-iimpi-2020a-lmax-6-cp2k.eb (test.easyconfigs.easyconfigs.EasyConfigTest)
Test for parsing of easyconfig Libint-2.6.0-iimpi-2020a-lmax-6-cp2k.eb
----------------------------------------------------------------------
Traceback (most recent call last):
  File "<string>", line 1, in innertest
  File "test/easyconfigs/easyconfigs.py", line 817, in template_easyconfig_test
    ecs = process_easyconfig(spec)
  File "/opt/hostedtoolcache/Python/2.7.18/x64/lib/python2.7/site-packages/easybuild/framework/easyconfig/easyconfig.py", line 1966, in process_easyconfig
    raise EasyBuildError("Failed to process easyconfig %s: %s", spec, err.msg)
EasyBuildError: "Failed to process easyconfig /home/runner/work/easybuild-easyconfigs/easybuild-easyconfigs/easybuild/easyconfigs/l/Libint/Libint-2.6.0-iimpi-2020a-lmax-6-cp2k.eb: Use of 2 unknown easyconfig parameters detected in Libint-2.6.0-iimpi-2020a-lmax-6-cp2k.eb: libint_compiler_configopts, with_fortran\nIf these are just local variables please rename them to start with 'local_', or try using --fix-deprecated-easyconfigs to do this automatically.\nFor more information, see https://easybuild.readthedocs.io/en/latest/Easyconfig-files-local-variables.html ."

======================================================================
FAIL: test_changed_files_pull_request (test.easyconfigs.easyconfigs.EasyConfigTest)
Specific checks only done for the (easyconfig) files that were changed in a pull request.
----------------------------------------------------------------------
Traceback (most recent call last):
  File "test/easyconfigs/easyconfigs.py", line 785, in test_changed_files_pull_request
    self.assertTrue(False, error_msg)
AssertionError: Failed to find parsed easyconfig for Libint-2.6.0-iimpi-2020a-lmax-6-cp2k.eb (and could not isolate it in easyconfigs archive either)

----------------------------------------------------------------------
Ran 10263 tests in 795.827s

FAILED (failures=1, errors=1)
ERROR: Not all tests were successful.

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boegel commented Aug 12, 2020

Test report by @boegel
SUCCESS
Build succeeded for 1 out of 1 (1 easyconfigs in this PR)
node2665.swalot.os - Linux centos linux 7.8.2003, x86_64, Intel(R) Xeon(R) CPU E5-2660 v3 @ 2.60GHz (haswell), Python 2.7.5
See https://gist.github.com/ac80b30316b8157d18b002b38a348ede for a full test report.

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boegel commented Aug 12, 2020

Test report by @boegel
SUCCESS
Build succeeded for 1 out of 1 (1 easyconfigs in this PR)
node3402.kirlia.os - Linux centos linux 7.8.2003, x86_64, Intel(R) Xeon(R) Gold 6240 CPU @ 2.60GHz (cascadelake), Python 2.7.5
See https://gist.github.com/1733e6121e816c0b55d9382fcb4c5b60 for a full test report.

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boegel commented Aug 12, 2020

Test report by @boegel
SUCCESS
Build succeeded for 1 out of 1 (1 easyconfigs in this PR)
generoso-x-5 - Linux centos linux 8.2.2004, x86_64, Intel(R) Xeon(R) CPU E5-2667 v3 @ 3.20GHz (haswell), Python 3.6.8
See https://gist.github.com/42aadd20a9d9ede8233dfef9333f50ca for a full test report.

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boegel commented Aug 12, 2020

Test report by @boegel
SUCCESS
Build succeeded for 1 out of 1 (1 easyconfigs in this PR)
node3103.skitty.os - Linux centos linux 7.8.2003, x86_64, Intel(R) Xeon(R) Gold 6140 CPU @ 2.30GHz (skylake_avx512), Python 3.6.8
See https://gist.github.com/879c4ec812bd6ea907496aef95395fc6 for a full test report.

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smoors commented Aug 12, 2020

Test report by @smoors
SUCCESS
Build succeeded for 1 out of 1 (1 easyconfigs in this PR)
node253.hydra.os - Linux centos linux 7.7.1908, x86_64, Intel(R) Xeon(R) CPU E5-2650 v4 @ 2.20GHz (broadwell), Python 2.7.5
See https://gist.github.com/e25a743df570a20198b680606af8ac17 for a full test report.

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Micket commented Aug 13, 2020

Test report by @Micket
SUCCESS
Build succeeded for 1 out of 1 (1 easyconfigs in this PR)
hebbe-c1 - Linux centos linux 7.8.2003, x86_64, Intel Core Processor (Haswell, no TSX), Python 2.7.5
See https://gist.github.com/05ec130f9bae721342f77e94f7b271ef for a full test report.

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Micket commented Aug 13, 2020

Test report by @Micket
SUCCESS
Build succeeded for 2 out of 2 (1 easyconfigs in this PR)
vera-c1 - Linux centos linux 7.8.2003, x86_64, Intel Xeon Processor (Skylake), Python 2.7.5
See https://gist.github.com/f0319960d619e0540a1abbf4f43c7b88 for a full test report.

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lgtm

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smoors commented Aug 13, 2020

Going in, thanks @boegel!

@smoors smoors merged commit 25656dc into easybuilders:develop Aug 13, 2020
@boegel boegel deleted the 20200812133446_new_pr_Libint260 branch August 13, 2020 20:59
mboisson pushed a commit to ComputeCanada/easybuild-easyconfigs that referenced this pull request Aug 17, 2020
@boegel boegel mentioned this pull request Sep 23, 2020
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4 participants