cp2k: use one MPS daemon per GPU#490
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ekouts merged 3 commits intoeth-cscs:mainfrom Dec 19, 2025
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cscs-ci run alps-daint-uenv;MY_UENV=cp2k/2025.1:v2 |
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cscs-ci run alps-eiger-uenv;MY_UENV=cp2k/2025.1:v3 |
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PR #452 introduced many changes to the CP2K ReFrame tests, including convergence tolerances, and a different input file for one test. I updated the references based on the upcoming CP2K uenv.
However, after @msimberg asked about the different reference and given some recent issues I encountered with MPS, I realized that adding out
mps-wrapper.shcould have impacted the update of the reference number.This PR reverts the changes in reference numbers (actually tightens them), by adding a new MPS wrapper (which @msimberg developed a while ago for DLA-Future) which starts one MPS daemon per GPU (instead of one per node).