fix support for imkl for numexpr 2.8.0+ in numexpr easyblock

[SebastianAchilles]

(created using eb --new-pr)

site.cfg was updated to use the libraries tag instead of mkl_libs, which is recommended for newer version of NumPy.

CC: @jhgoebbert

[SebastianAchilles]

Test report by @SebastianAchilles

Overview of tested easyconfigs (in order)

• SUCCESS numexpr-2.7.1-foss-2019b-Python-3.7.4.eb
• SUCCESS numexpr-2.7.1-foss-2020a-Python-3.8.2.eb
• SUCCESS numexpr-2.7.1-fosscuda-2019b-Python-3.7.4.eb
• SUCCESS numexpr-2.7.1-intel-2019b-Python-2.7.16.eb
• SUCCESS numexpr-2.7.1-intel-2020a-Python-3.8.2.eb
• SUCCESS SciPy-bundle-2020.11-foss-2020b.eb
• SUCCESS SciPy-bundle-2020.11-foss-2020b-Python-2.7.18.eb
• SUCCESS SciPy-bundle-2020.11-fosscuda-2020b.eb
• SUCCESS SciPy-bundle-2020.11-intel-2020b.eb
• SUCCESS SciPy-bundle-2020.11-intelcuda-2020b.eb
• SUCCESS SciPy-bundle-2021.05-foss-2021a.eb
• SUCCESS SciPy-bundle-2021.05-intel-2021a.eb
• FAIL (build issue) SciPy-bundle-2021.10-foss-2021b.eb (partial log available at https://gist.github.com/aaae7ad072b2b3ec005dcb2ac16de4de)
• FAIL (build issue) SciPy-bundle-2021.10-foss-2021b-Python-2.7.18.eb (partial log available at https://gist.github.com/19615dd0d52d1812696bea422249192c)
• SUCCESS SciPy-bundle-2021.10-intel-2021b.eb

Build succeeded for 13 out of 15 (15 easyconfigs in total)
cnx3 - Linux Rocky Linux 8.5, x86_64, Intel(R) Xeon(R) CPU E5-2667 v3 @ 3.20GHz (haswell), Python 3.6.8
See https://gist.github.com/12fab62f0a69ba42ea49cdc64f959afc for a full test report.

[SebastianAchilles]

Error in SciPy-bundle-2021.10-foss-2021b.eb and SciPy-bundle-2021.10-foss-2021b-Python-2.7.18.eb is

test_lobpcg.py::test_hermitian Fatal Python error: Segmentation fault

which was already observed in easybuilders/easybuild-easyconfigs#13789 (comment)

[SebastianAchilles]

Error in SciPy-bundle-2021.10-foss-2021b.eb and SciPy-bundle-2021.10-foss-2021b-Python-2.7.18.eb is

test_lobpcg.py::test_hermitian Fatal Python error: Segmentation fault

which was already observed in easybuilders/easybuild-easyconfigs#13789 (comment)

This error was already fixed in easybuilders/easybuild-easyconfigs#14178 However I did not yet rebuild OpenBLAS.

[akesandgren]

LGTM

[akesandgren]

Test report by @akesandgren

Overview of tested easyconfigs (in order)

• SUCCESS SciPy-bundle-2021.10-foss-2021b.eb
• SUCCESS SciPy-bundle-2021.10-foss-2021b-Python-2.7.18.eb

Build succeeded for 2 out of 2 (2 easyconfigs in total)
b-an02.hpc2n.umu.se - Linux Ubuntu 20.04, x86_64, Intel(R) Xeon(R) CPU E5-2690 v4 @ 2.60GHz, Python 3.8.10
See https://gist.github.com/dc4ea1db617b195e0f574a4d55469406 for a full test report.

[akesandgren]

Going in, thanks @SebastianAchilles!

[SebastianAchilles]

Test report by @SebastianAchilles

Overview of tested easyconfigs (in order)

• SUCCESS SciPy-bundle-2021.10-foss-2021b.eb
• SUCCESS SciPy-bundle-2021.10-foss-2021b-Python-2.7.18.eb
• SUCCESS SciPy-bundle-2021.10-intel-2021b.eb

Build succeeded for 3 out of 3 (3 easyconfigs in total)
cnx3 - Linux Rocky Linux 8.5, x86_64, Intel(R) Xeon(R) CPU E5-2667 v3 @ 3.20GHz (haswell), Python 3.6.8
See https://gist.github.com/58bb9e9cd696fd7c395738db43740087 for a full test report.