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Orbital optimization #711
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area/functionalityInvolves the features and operations implemented in OpenFermionInvolves the features and operations implemented in OpenFermionhelp wanted
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area/functionalityInvolves the features and operations implemented in OpenFermionInvolves the features and operations implemented in OpenFermionhelp wanted
It would be really nice to have orbital optimization routines in OpenFermion. A basic one can be made with the Hartree-Fock gradient code.