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Added ML-MIX-kokkos which is compatible with symmetrix/mace/kokkos for GPU/GPU mixing#9

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Fraser-Birks merged 22 commits intomainfrom
develop
Jun 6, 2025
Merged

Added ML-MIX-kokkos which is compatible with symmetrix/mace/kokkos for GPU/GPU mixing#9
Fraser-Birks merged 22 commits intomainfrom
develop

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@Fraser-Birks Fraser-Birks commented May 30, 2025

To do before merge:

  • Fix C.I.
  • Add in-source build instructions to docs (as well as plugin build instructions)
  • Add note on kokkos pair_styles to docs
  • Add simple working kokkos example to simple_examples/
  • Add warnings about pair_styles not working to README and docs
  • Report LAMMPS kokkos bug that breaks some kokkos tests

@Fraser-Birks Fraser-Birks merged commit 7e86877 into main Jun 6, 2025
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