Accurate solution of the Dirac equation on Lagrange meshes
Abstract
The Lagrange-mesh method is an approximate variational method taking the form of equations on a grid because of the use of a Gauss quadrature approximation. With a basis of Lagrange functions involving associated Laguerre polynomials related to the Gauss quadrature, the method is applied to the Dirac equation. The potential may possess a singularity. For hydrogenic atoms, numerically exact energies and wave functions are obtained with small numbers of mesh points, where is the principal quantum number. Numerically exact mean values of powers to 3 of the radial coordinate can also be obtained with mesh points. For the Yukawa potential, a 15-digit agreement with benchmark energies of the literature is obtained with 50 mesh points or less.
Cite
@article{arxiv.1404.5409,
title = {Accurate solution of the Dirac equation on Lagrange meshes},
author = {Daniel Baye and Livio Filippin and Michel Godefroid},
journal= {arXiv preprint arXiv:1404.5409},
year = {2014}
}