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Current densities in density-functional theory

Elliott H. Lieb and Robert Schrader
Phys. Rev. A 88, 032516 – Published 26 September 2013

Abstract

It is well known that any given density ρ(x) can be realized by a determinantal wave function for N particles. The question addressed here is whether any given density ρ(x) and current density j(x) can be simultaneously realized by a (finite kinetic energy) determinantal wave function. In case the velocity field v(x)=j(x)/ρ(x) is curlfree, we provide a solution for all N, and we provide an explicit upper bound for the energy. If the velocity field is not curl-free, there is a finite energy solution for all N4, but we do not provide an explicit energy bound in this case. For N=2 we provide an example of a non-curl-free velocity field for which there is a solution and an example for which there is no solution. The case N=3 with a non-curl-free velocity field is left open.

  • Received 20 August 2013

DOI:https://doi.org/10.1103/PhysRevA.88.032516

©2013 American Physical Society

Authors & Affiliations

Elliott H. Lieb*

  • Princeton University, Departments of Physics and Mathematics, Jadwin Hall, Princeton, New Jersey 08544, USA

Robert Schrader

  • Institut für Theoretische Physik, Freie Universität Berlin, Arnimallee 14, D-14195 Berlin, Germany

  • *lieb@princeton.edu
  • schrader@physik.fu-berlin.de

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Issue

Vol. 88, Iss. 3 — September 2013

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