Nonlocal functional derivative of kinetic energy for the self-consistent Thomas-Fermi atom

N. H. March
Phys. Rev. A 56, 1025 – Published 1 July 1997
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Abstract

It is well known in the Thomas-Fermi (TF) theory that the functional derivative δT/δn(r), with T the kinetic energy and n(r) the ground-state electron density, is proportional to n2/3(r). But the differential equation satisfied by the TF self-consistent density for atoms is shown here to express n1/3(r) as a linear combination of 2n/n and (n/n)2. Hence a nonlocal form for δT/δn(r) follows, solely in terms of these two variables.

  • Received 2 December 1996

DOI:https://doi.org/10.1103/PhysRevA.56.1025

©1997 American Physical Society

Authors & Affiliations

N. H. March

  • Oxford University, Oxford, England

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Vol. 56, Iss. 1 — July 1997

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