Diagrammatic self-energy approximations and the total particle number
Abstract
There is increasing interest in many-body perturbation theory as a practical tool for the calculation of ground-state properties. As a consequence, unambiguous sum rules such as the conservation of particle number under the influence of the Coulomb interaction have acquired an importance that did not exist for calculations of excited-state properties. In this paper we obtain a rigorous, simple relation whose fulfilment guarantees particle-number conservation in a given diagrammatic self-energy approximation. Hedin's G0W0 approximation does not satisfy this relation and hence violates the particle-number sum rule. Very precise calculations for the homogeneous electron gas and a model inhomogeneous electron system allow the extent of the nonconservation to be estimated.
- Publication:
-
Physical Review B
- Pub Date:
- December 2001
- DOI:
- arXiv:
- arXiv:cond-mat/0110435
- Bibcode:
- 2001PhRvB..64w5106S
- Keywords:
-
- 71.45.Gm;
- 71.15.Qe;
- Exchange correlation dielectric and magnetic response functions plasmons;
- Excited states: methodology;
- Condensed Matter - Materials Science
- E-Print:
- 6 pages including 3 figures, RevTeX