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| Code Block |
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Memory estimate --------------- Calculator 574.32 MiB |
Tips for Running with BEEF
If you use the BEEF functional:
- the code parallelizes over 20 cores (because of the way the VDW contribution is calculated)
- you typically need a lot of memory, even for small calculations. For larger calculations you sometimes have to use more than 20 cores, just to get enough memory (you don't get additional parallelization).
- the GPAW memory estimates are incorrect
Building a Private Version of GPAW
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