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I can test report CASTEP-24.1-foss-2023b.eb but I do not have the source for CASTEP-25.1.2-foss-2024a.eb. I think @smoors has the sources and hopefully can test report.
My test report will be tomorrow - we have maintenance today.
Test report by @smoors SUCCESS
Build succeeded for 1 out of 1 (1 easyconfigs in total)
node600.hydra.os - Linux Rocky Linux 9.6, x86_64, AMD EPYC 9384X 32-Core Processor (zen4), Python 3.9.21
See https://gist.github.com/smoors/26aa302974cedfb224f89c8c4f135715 for a full test report.
boegel
changed the title
avoid test failure on AVX512 system in CASTEP
avoid test failure on AVX512 systems by using -O2 instead of -O3 for CASTEP 24.1 + 25.1.2
Dec 19, 2025
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(created using
eb --new-pr)see #24377