Systematic corrections to the Thomas-Fermi approximation without a gradient expansion

ORAL

Abstract

We improve on the Thomas–Fermi approximation for the single particle density of fermions by introducing inhomogeneity corrections. Rather than invoking a gradient expansion, we relate the density to the unitary evolution operator for the given effective potential energy and approximate this operator by a Suzuki–Trotter factorization. This yields a hierarchy of approximations, one for each approximate factorization. For the purpose of a first benchmarking, we examine the approximate densities for a few cases with known exact densities and observe a very satisfactory, and encouraging, performance. As a bonus, we also obtain a simple fourth-order leapfrog algorithm for the symplectic integration of classical equations of motion.

Presenters

  • Jun Hao Hue

    National University of Singapore

Authors

  • Jun Hao Hue

    National University of Singapore

  • Thanh Tri Chau

    National University of Singapore

  • Martin-Isbjörn Trappe

    National University of Singapore

  • Berge Englert

    National University of Singapore