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Fix issue #253 #254

Merged
merged 4 commits into from
Oct 30, 2024
Merged

Fix issue #253 #254

merged 4 commits into from
Oct 30, 2024

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lohedges
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@lohedges lohedges commented Oct 29, 2024

This PR closes #253 by exposing the timeout kwarg in dynamics.minimise().

Also closes #255 by adding the include_constrained_energies kwarg to the map and standardising minimisation settings across all API functions.

  • I confirm that I have merged the latest version of devel into this branch before issuing this pull request (e.g. by running git pull origin devel): [y]
  • I confirm that I have added a changelog entry to the changelog (we will add a link to this PR as part of the review): [y]
  • I confirm that I have permission to release this code under the GPL3 license: [y]

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Looks good 👍

@lohedges lohedges merged commit 97d7f2f into devel Oct 30, 2024
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@lohedges lohedges deleted the fix_253 branch October 30, 2024 16:39
lohedges added a commit that referenced this pull request Oct 30, 2024
lohedges added a commit that referenced this pull request Oct 30, 2024
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