Number of fp tasks just once? #675
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McAlexDudu
McAlexDudu
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Hi~ I ran dpgen success but had a question about number of fp tasks. My candidate number is 668 and I set fp tasks 20. I checked the dpgen.log and found that it seem to just run 20 times of DFT and what about the rest(648) ?
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Answered by
McAlexDudu
Mar 20, 2022
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Now I know not all the candidate would be labelled to run dft, and just add these new data to the dataset. |
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Now I know not all the candidate would be labelled to run dft, and just add these new data to the dataset.