To-Do List
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12/2013
- structs for RPA
- rpa (jun)
- keep on eye on crashes
- EXX on GPUs
2/5/2013
- profile GPU-GPAW with maxed out memory on the GPU (lin)
- gpu-gpaw profiling thoughts:
- cpo thinks improving mpi performance may be difficult
- lin thinks improving mpi performance may be important, since number of k-points decreases in future.
- maybe we could pipeline other work while mpi is running?
- why do we only get a x5 speedup for Pt 3x3x4? (samuli sees 8 to 11)
- see if the mask stuff is called every SCF step (aj)
- think about randomization idea (aj)
- evaluate effectiveness of tzp+PK on na2o4/pt (aj)
- freeze D_aps?
- rpa (jun)
- keep on eye on crashes
- rewrite code for the ZHERK
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