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Leading gradient correction to the kinetic energy for two-dimensional fermion gases

  • Martin Isbjörn Trappe
  • , Yink Loong Len
  • , Hui Khoon Ng
  • , Cord Axel Müller
  • , Berthold Georg Englert

Research output: Contribution to journalArticlepeer-review

Abstract

Density-functional theory (DFT) is notorious for the absence of gradient corrections to the two-dimensional (2D) Thomas-Fermi kinetic-energy functional; it is widely accepted that the 2D analog of the 3D von Weizsäcker correction vanishes, together with all higher-order corrections. Contrary to this long-held belief, we show that the leading correction to the kinetic energy does not vanish, is unambiguous, and contributes perturbatively to the total energy. This insight emerges naturally in a simple extension of standard DFT, which has the effective potential energy as a functional variable on equal footing with the single-particle density.

Original languageEnglish
Article number042510
JournalPhysical Review A
Volume93
Issue number4
DOIs
Publication statusPublished - 2016 Apr 25

All Science Journal Classification (ASJC) codes

  • Atomic and Molecular Physics, and Optics

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