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Pull requests: FermiQC/GaussianBasis.jl

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Pull requests list

Added functions for 2e3c and 2e2c integral gradients
#31 opened Dec 1, 2025 by felipelewyee Loading…
Ensure BasisSet is type stable
#30 opened Oct 23, 2025 by hz-xiaxz Loading…
1
Atomic orbital amplitudes
#28 opened Oct 17, 2025 by lukas-weber Loading…
1
Optimization of gradients
#27 opened Oct 17, 2025 by lukas-weber Loading…
Fix related to performing AD on molecular integrals
#22 opened Apr 25, 2025 by tansongchen • Draft
2
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