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dev-zero / cp2k

Quantum chemistry and solid state physics software package
https://www.cp2k.org
GNU General Public License v2.0
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cmake: require specific DBCSR configuration and version #43

Open dev-zero opened 3 years ago

dev-zero commented 3 years ago

There are numerous combinations on how to build CP2K and DBCSR and the combination of them. At the moment, building DBCSR as a submodule inside the current build system restricts the combinations and ensures that options are used consistently (for example MPI, CUDA, etc.). Since we cannot test all combinations it may be a good idea to check for consistent options rigorously. DBCSR possibly has to be extended to export them in a parseable fashion.

dev-zero commented 3 years ago

... and CP2K has a rather strict requirement for the DBCSR version, we should track that as well