Rigorous Density Functional Theory for Inhomogeneous Bose-Condensed Fluids

preprint1995arXivOpen access

Abstract

The density functional theory originally developed by Hohenberg, Kohn and Sham provides a rigorous conceptual framework for dealing with inhomogeneous interacting Fermi systems. We extend this approach to deal with inhomogeneous interacting Bose-condensed systems, limiting this presentation to setting up the formalism to deal with ground state (T=0)(T=0) properties. The key new feature is that one must deal with energy functionals of both the local density n(r)n({\bf r}) and the local complex macroscopic wavefunction Φ(r)Φ({\bf r}) associated with the Bose broken-symmetry (the local condensate density is nc(r)=∣Φ(r)∣2n_{c}({\bf r}) = \vert Φ({\bf r}) \vert ^{2}). Implementing the Kohn-Sham scheme, we reduce the problem to a gas of weakly-interacting Bosons moving in self-consistent diagonal and off-diagonal one-body potentials. Our formalism should provide the basis for studies of the surface properties of liquid 4^4He as well as the properties of Bose-condensed atomic gases trapped in external potentials.

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