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refactor(dftu): collapse cal_occ_mat_k/gamma signatures onto Plus_U& #1408

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refactor(dftu): collapse cal_occ_mat_k/gamma signatures onto Plus_U&

refactor(dftu): collapse cal_occ_mat_k/gamma signatures onto Plus_U& #1408

Run time

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Job Run time
Build with Intel toolchain
8m 55s
Build without LCAO
5m 31s
Build extra components with GNU toolchain
17m 19s
Build with CUDA support
11m 24s
Build without MPI
6m 38s
Build without LCAO and MPI
4m 21s
Build with GNU toolchain
6m 50s
Build without ELPA
8m 23s
Build extra components with Intel toolchain
17m 51s
1h 27m 12s