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The .UHF file is now written if the molecule has a uhf larger than 0 #74

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merged 6 commits into from
Nov 18, 2024

Negative charge is now written aswell

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Merged

The .UHF file is now written if the molecule has a uhf larger than 0 #74

Negative charge is now written aswell
99a7533
Select commit
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Failed to load commit list.
static-tests (ubuntu-latest, 3.12)
succeeded Nov 18, 2024 in 27s