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Bugfix: Issue with spin-polarized calculations #42

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merged 1 commit into from
Jan 21, 2025
Merged

Bugfix: Issue with spin-polarized calculations #42

merged 1 commit into from
Jan 21, 2025

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paulsaxe
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  • The code had several errors to do with detecting whether the calculation was spin-polarized or not. This has been fixed and the detection simplified.

* The code had several errors to do with detecting whether the calculation was
  spin-polarized or not. This has been fixed and the detection simplified.
@paulsaxe paulsaxe added the bug Something isn't working label Jan 21, 2025
@paulsaxe paulsaxe requested a review from seamm January 21, 2025 20:00
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LGTM

@seamm seamm merged commit 9bbbba0 into main Jan 21, 2025
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2 participants