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QE-GPU v1.0
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@fspiga fspiga released this 03 Nov 21:29
· 30 commits to devel-gpu since this release
v1.0
895a9c2

This is the first production version of QE-GPU, not all packages and functionalities are fully supported. At present, only PWscf k-point calculations are GPU accelerated. This version is based on the QE v6.1 codebase. Please refer to README.md for additional information.

If you find a specific and reproducible problem please open a GitHub issue. Just a remind that GitHub issues are not for feature requests. If you have specific requests or specific input cases to test please email directly Filippo Spiga

Important notes:

  • If your reference architecture is POWER, please strictly use PGI 17.4 or 17.5 since a compiler bug affecting more recent versions has been recently discovered (fix available in the commit 92327a5)
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