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{chem}[foss/2021b,intel/2021b] GPAW v24.1.0 #19564

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@schiotz schiotz commented Jan 11, 2024

(created using eb --new-pr)

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schiotz commented Jan 11, 2024

This version of GPAW fixes a rather serious bug, where GPAW in some rare circumstances would give the wrong result. See https://wiki.fysik.dtu.dk/gpaw/releasenotes.html#version-24-1-0

This PR is similar to #19525 and #19563 but for the older 2021a toolchains.

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schiotz commented Jan 27, 2024

Test report by @schiotz
SUCCESS
Build succeeded for 10 out of 10 (2 easyconfigs in total)
slid.fysik.dtu.dk - Linux CentOS Linux 7.9.2009, x86_64, Intel(R) Xeon(R) CPU E5-2650 v4 @ 2.20GHz, Python 3.6.8
See https://gist.github.com/schiotz/81900890b98d0c63f647a2c7aaaf8eab for a full test report.

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