| Literature DB >> 11800975 |
Andrea Marini1, Giovanni Onida, Rodolfo Del Sole.
Abstract
We show that the results of photoemission and inverse photoemission experiments on bulk copper can be quantitatively described within band-structure theory, with no evidence of effects beyond the single-quasiparticle approximation. The well-known discrepancies between the experimental band structure and the Kohn-Sham eigenvalues of density functional theory are almost completely corrected by self-energy effects. Exchange-correlation contributions to the self-energy arising from 3s and 3p core levels are shown to be crucial.Entities:
Year: 2001 PMID: 11800975 DOI: 10.1103/PhysRevLett.88.016403
Source DB: PubMed Journal: Phys Rev Lett ISSN: 0031-9007 Impact factor: 9.161