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Pull requests: wavefunction91/IntegratorXX
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Add an arbitrary-precision generator for the angular grid tables
#110
opened Aug 30, 2026 by
susilehtola
Collaborator
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Remove dead code and ignore build products
#107
opened Aug 29, 2026 by
susilehtola
Collaborator
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README: fix the usage example and the scope and failure claims
#106
opened Aug 29, 2026 by
susilehtola
Collaborator
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Fix container type and empty-vector defects in the composite quadratures
#105
opened Aug 29, 2026 by
susilehtola
Collaborator
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Make header-only builds work from any number of translation units
#104
opened Aug 29, 2026 by
susilehtola
Collaborator
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Make the batcher and partition iterators usable
#103
opened Aug 29, 2026 by
susilehtola
Collaborator
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Diagnose invalid angular grid sizes instead of returning zeros
#101
opened Aug 29, 2026 by
susilehtola
Collaborator
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Implementation of the Baker et al radial grid.
#85
opened Oct 3, 2023 by
susilehtola
Collaborator
•
Draft
Lindh-Malmqvist-Gagliardi Radial Grid
#84
opened Sep 28, 2023 by
wavefunction91
Owner
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Draft
3 of 4 tasks
Include tabulated Hartree-Fock wave functions for atoms
#71
opened Aug 11, 2023 by
susilehtola
Collaborator
•
Draft
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