Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
9850844 | Nuclear Physics A | 2005 | 19 Pages |
Abstract
Special bases of orthogonal polynomials are defined, that are suited to expansions of density and potential perturbations under strict particle number conservation. Particle-hole expansions of the density response to an arbitrary perturbation by an external field can be inverted to generate a mapping between density and potential. Information is obtained for derivatives of the Hohenberg-Kohn functional in density space. A truncation of such an information in subspaces spanned by a few modes is possible. Numerical examples illustrate these algorithms.
Related Topics
Physical Sciences and Engineering
Physics and Astronomy
Nuclear and High Energy Physics
Authors
B.G. Giraud, A. Weiguny, L. Wilets,