Potential envelope theory and the local energy theorem
Abstract
We consider a one--particle bound quantum mechanical system governed by a Schr\"odinger operator , where is an attractive central potential, and is a coupling parameter. If is a `trial function', the local energy theorem tells us that the discrete energies of are bounded by the extreme values of as a function of . We suppose that is a smooth transformation of the form , where is monotone increasing with definite convexity and is a potential for which the eigenvalues of the operator , for appropriate , are known. It is shown that the eigenfunctions of provide local-energy trial functions which necessarily lead to finite eigenvalue approximations that are either lower or upper bounds. This is used to extend the local energy theorem to the case of upper bounds for the excited-state energies when the trial function is chosen to be an eigenfunction of such an operator . Moreover, we prove that the local-energy approximations obtained are identical to `envelope bounds', which can be obtained directly from the spectral data without explicit reference to the trial wave functions.
Cite
@article{arxiv.1905.08852,
title = {Potential envelope theory and the local energy theorem},
author = {Ryan Gibara and Richard L. Hall},
journal= {arXiv preprint arXiv:1905.08852},
year = {2019}
}