Systematic corrections to the Thomas-Fermi approximation without a gradient expansion
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.
Cite
@article{arxiv.1709.01719,
title = {Systematic corrections to the Thomas-Fermi approximation without a gradient expansion},
author = {Thanh Tri Chau and Jun Hao Hue and Martin-Isbjörn Trappe and Berthold-Georg Englert},
journal= {arXiv preprint arXiv:1709.01719},
year = {2019}
}
Comments
20 pages; added 1 figure, 3 appendices, and references; old figures updated