Exchange and correlation energy of an inhomogeneous electron gas at metallic densities
- 15 February 1976
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 13 (4) , 1477-1488
- https://doi.org/10.1103/physrevb.13.1477
Abstract
A convenient expression is derived for the coefficient, , which determines the first gradient corrections to the exchange and correlation energy of an inhomogeneous electron gas. The result is exact to all orders in and is expressed in terms of a single-particle propagator. The lowest-order contributions to are evaluated without the simplifying high-density approximation. The formal structure of the derived expression for is then used to develop an approximation method for including the contribution of all higher-order graphs within the random-phase approximation. Numerical results are given for in the metallic density range. Application to surface energy of metals show an improvement over any previous approximations for .
Keywords
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