Formats (`qiskit_nature.second_q.formats`)#

Submodules#

`fcidump`	FCIDump (qiskit_nature.second_q.formats.fcidump)
`qcschema`	QCSchema (qiskit_nature.second_q.formats.qcschema)
`watson`	The Watson Hamiltonian (qiskit_nature.second_q.formats.watson)

`MoleculeInfo`	A dataclass storing molecule information.
`fcidump_to_problem`	Builds out an `ElectronicStructureProblem` from a `FCIDump` instance.
`watson_to_problem`	Builds out a `VibrationalStructureProblem` from a `WatsonHamiltonian`.
`qcschema_to_problem`	Builds out an `ElectronicStructureProblem` from a `QCSchema` instance.
`get_ao_to_mo_from_qcschema`	Builds out a `BasisTransformer` from a `QCSchema` instance.
`get_overlap_ab_from_qcschema`	Builds the alpha-beta spin orbital overlap matrix from a `QCSchema` instance.