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Download libxc 6.2.2 from https://www.tddft.org/programs/libxc/download/.

Prerequisites

• FFTW/MKL package

• SCALAPACK

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1. Find the best balance between OpenMP threads and MPI processes, show your work in the team’s interview presentation. Investigate the weak scaling (with the other inputs) as the MPI/OpenMP balance is changed. present your work in the interview.
   

2. Run CONQUEST with on 4 nodes and submit the results to the team’s folder (any number of PPN you choose).
   

3. Run IPM profile or any other MPI profile on 4 nodes, and find the 3 most used MPI calls, show your work in the team interview presentation.
   

4. Try run the application on 1,2,4 nodes (for the si_888.xtl input) and present strong scaling graph in the teams interview presentation.