5 years ago

Comment on “Nonuniqueness of algebraic first-order density-matrix functionals”

Comment on “Nonuniqueness of algebraic first-order density-matrix functionals”
O. V. Gritsenko
Wang and Knowles (WK) [Phys. Rev. A 92, 012520 (2015)] have given a counterexample to the conventional in reduced density-matrix functional theory representation of the second-order reduced density matrix (2RDM) ${\mathrm{Γ}}_{ij,kl}$ in the basis of the natural orbitals as a function ${\mathrm{Γ}}_...

Publisher URL: http://link.aps.org/doi/10.1103/PhysRevA.97.026501

DOI: 10.1103/PhysRevA.97.026501

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