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Update for newer GPU4PySCF versions#70

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awvwgk merged 2 commits into
microsoft:mainfrom
awvwgk:gpu4pyscf-update
May 11, 2026
Merged

Update for newer GPU4PySCF versions#70
awvwgk merged 2 commits into
microsoft:mainfrom
awvwgk:gpu4pyscf-update

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@awvwgk awvwgk commented May 11, 2026

Closes #64
Closes #47

@awvwgk awvwgk self-assigned this May 11, 2026
@awvwgk awvwgk merged commit dd2c363 into microsoft:main May 11, 2026
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@awvwgk awvwgk deleted the gpu4pyscf-update branch May 11, 2026 07:48
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Persistent issues with GPU for geometry optimization and single-point calculations in ASE Check support for newer GPU4PySCF versions

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