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deeperwin.orbitals.build_pyscf_molecule
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deeperwin.orbitals.calculate_molecular_orbital_cusp_params
deeperwin.orbitals.eval_atomic_orbitals
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deeperwin.orbitals.evaluate_molecular_orbitals
deeperwin.orbitals.get_baseline_solution
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deeperwin.orbitals.build_pyscf_molecule_from_physical_config
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deeperwin.orbitals.build_pyscf_molecule_from_physical_config
deeperwin.orbitals.
build_pyscf_molecule_from_physical_config
(
physical_config
:
deeperwin.configuration.PhysicalConfig
,
basis_set
)
[source]