Extended Gutzwiller approximation for inhomogeneous systems

Wing-Ho Ko, Cody P. Nave, and Patrick A. Lee
Phys. Rev. B 76, 245113 – Published 14 December 2007

Abstract

The generalization of the Gutzwiller approximation to inhomogeneous systems is considered, with extra spin-and-site-dependent fugacity factors included. It is found that the inclusion of fugacity factors reconciles the seemingly contradictory choices of Gutzwiller factors used in the literature. Moreover, from the derivation of the Gutzwiller factors, it is shown that the Gutzwiller approximation breaks the rotational symmetry of the trial wave functions and that different components of the spin-spin interaction need to be renormalized differently under the approximation. Various schemes to restore the rotational symmetry are discussed and are compared with results from variational Monte Carlo calculations for the two-dimensional square-lattice antiferromagnet. Results along different paths within the full parameter space, which correspond to different choices of fugacity factors in the literature, are also compared.

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  • Received 26 September 2007

DOI:https://doi.org/10.1103/PhysRevB.76.245113

©2007 American Physical Society

Authors & Affiliations

Wing-Ho Ko, Cody P. Nave*, and Patrick A. Lee

  • Department of Physics, Massachusetts Institute of Technology, Cambridge, Massachusetts 02139, USA

  • *Present address: Condensed Matter Theory Center, Department of Physics, University of Maryland, College Park, Maryland 20742-4111, USA.

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Issue

Vol. 76, Iss. 24 — 15 December 2007

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