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Wb97m D3bj Issue 95 Pyscf Gpu4pyscf Github

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Overriding nested functions · Issue #1457 · pyscf/pyscf · GitHub

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Issues · pyscf/gpu4pyscf · GitHub

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A error related to h5py · Issue #1003 · pyscf/pyscf · GitHub

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Cannot import pyscf.geomopt.geometric_solver.optimize · Issue #834 ...

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PySCF is incompatible with NumPy 2.0 · Issue #2260 · pyscf/pyscf · GitHub

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