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cycling_analysis utility #14

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lorisercole opened this issue Oct 17, 2022 · 0 comments
Open

cycling_analysis utility #14

lorisercole opened this issue Oct 17, 2022 · 0 comments
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deliverable This issue is associated or required by a deliverable in a funding project

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@lorisercole
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The utils/cycling_analysis utility checks if a job was monitored and tries to retrieve the most recent results.
These can be the output of the monitoring job, or the last snapshot that it retrieved, or the output of the CalcJob, or the raw data file.
https://github.com/epfl-theos/aiida-aurora/blob/23811bc02e59e8c01e7cf449ff5fa0d5f27db666/aiida_aurora/utils/cycling_analysis.py#L102-L108

Once #13 is implemented, this function can be simplified, as the workchain should link to the correct output node.
https://github.com/epfl-theos/aiida-aurora/blob/23811bc02e59e8c01e7cf449ff5fa0d5f27db666/aiida_aurora/utils/cycling_analysis.py#L193-L208
@ramirezfranciscof ramirezfranciscof added the deliverable This issue is associated or required by a deliverable in a funding project label Nov 8, 2022
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@ramirezfranciscof @lorisercole