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ECP-copa
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CabanaMD
Molecular dynamics proxy application based on Cabana
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Remove NNP code and move to n2p2
#37
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streeve
closed
3 years ago
streeve
commented
4 years ago
Steps towards removing the n2p2 specific code:
[x] Merge flexible AoSoA #30, templating over System and System_NNP (better interface to main n2p2 kernels)
[x] Merge neighbor list update #43, templating over Neighbor
[x] Merge update for NNP kernels 46 to use Cabana slices, rather than CabanaMD System
[x] Merge template over device type #51 and clean up use of Kokkos Views for NNP
[x] Merge into n2p2
[x] Remove all NNP files except force_nnp* (wrapping n2p2 functions)
Steps towards removing the n2p2 specific code: