Documentation about restart task#15
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JacekDziedzic merged 1 commit intoonetep-devel:mainfrom Sep 25, 2025
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@JacekDziedzic @nickhine Might be a bit tight to have a look before tomorrow morning's meeting, but here it is... |
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@manueldsdias -- looks all good to me, merging! |
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@manueldsdias, @nickhine -- I merged it but it failed to deploy with an https://github.com/onetep-devel/documentation/actions/runs/17999244856/job/51204613480 I have no idea why that would happen or how to fix this. |
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Maybe it's a temporary issue. Is it possible to try again in a few hours, to check that? |
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I updated the description of the restarting capabilities in ONETEP, creating a new section under
Starting with ONETEPnamedRestarting or continuing ONETEP runs. I also updated the existing text about the basic read/write flags for the NGWFs/kernel/Hamiltonian. Lastly, I sneaked in a short mention that UPF pseudopotentials are also supported and where to find some, at the end of the section aboutCreating input files.