Comment on “Kinetic energy as a density functional”

A. Holas and N. H. March
Phys. Rev. A 66, 066501 – Published 20 December 2002
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Abstract

In a recent paper, Nesbet [Phys. Rev. A 65, 010502(R) (2001)] has proposed dropping “the widespread but unjustified assumption that the existence of a ground-state density functional for the kinetic energy, Ts[ρ], of an N-electron system implies the existence of a density-functional derivative, δTs[ρ]/δρ(r), equivalent to a local potential function,” because, according to his arguments, this derivative “has the mathematical character of a linear operator that acts on orbital wave functions.” Our Comment demonstrates that the statement called by Nesbet an “unjustified assumption” happens, in fact, to be a rigorously proven theorem. Therefore, his previous conclusions stemming from his different view of this derivative, which undermined the foundations of density-functional theory, can be discounted.

  • Received 3 April 2002

DOI:https://doi.org/10.1103/PhysRevA.66.066501

©2002 American Physical Society

Authors & Affiliations

A. Holas

  • Institute of Physical Chemistry of the Polish Academy of Sciences, 44/52 Kasprzaka, 01-224 Warsaw, Poland

N. H. March

  • University of Oxford, Oxford, England
  • Department of Physics (RUCA), University of Antwerp, B-2020 Antwerp, Belgium

Original Article

Kinetic energy as a density functional

R. K. Nesbet
Phys. Rev. A 65, 010502(R) (2001)

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Vol. 66, Iss. 6 — December 2002

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