Original work: https://github.com/FitSNAP/TestSNAP/tree/master
Implementation based on: https://github.com/FitSNAP/TestSNAP/tree/OpenMP4.5
Download NVTX tool into code directory or comment out NVTX commands (in CMakeLists.txt, sna.cpp, and test_snap.cpp)
https://github.com/NVIDIA/NVTX?tab=readme-ov-file
mkdir build_cuda && cd build_cuda
cmake -S .. -B . -Dref_data=14 -DCMAKE_CXX_COMPILER=nvc++ -DCMAKE_CXX_COMPILER_ID="NVHPC"
cmake --build .
./test_snap