openfermion.hamiltonians.rhf_minimization
Perform Hartree-Fock energy minimization
openfermion.hamiltonians.rhf_minimization(
rhf_object: openfermion.hamiltonians.HartreeFockFunctional
,
method: Optional[str] = 'CG',
initial_guess: Optional[Union[None, np.ndarray]] = None,
verbose: Optional[bool] = True,
sp_options: Optional[Union[None, Dict]] = None
) -> OptimizeResult
Args |
rhf_object
|
An instantiation of the HartreeFockFunctional
|
method
|
(optional) scipy optimization method
|
initial_guess
|
(optional) initial rhf parameter vector. If None
zero vector is used.
|
verbose
|
(optional) turn on printing. This is passed to the
scipy 'disp' option.
sp_options:
|
Returns: scipy.optimize result object
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Last updated 2024-04-26 UTC.
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