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Allow custom cmdargs #81

Merged
merged 3 commits into from
Oct 11, 2022
Merged

Allow custom cmdargs #81

merged 3 commits into from
Oct 11, 2022

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Leimeroth
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Allow to add custom args to lammps initialization. Allows to use accelarator packages (f.e. -sf intel), gpus, etc.

@Leimeroth Leimeroth added the format_black reformat the code using the black standard label Oct 6, 2022
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On my pc the citatons.txt file is created and the test passes. Not sure why it failes here

@jan-janssen jan-janssen merged commit a51eeb0 into master Oct 11, 2022
@delete-merged-branch delete-merged-branch bot deleted the allow-custom-cmdargs branch October 11, 2022 16:50
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I fixed the issues in #82

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@jan-janssen jan-janssen Awaiting requested review from jan-janssen

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@Leimeroth @jan-janssen @pyiron-runner