Short-range correlation in the uniform electron gas: Extended Overhauser model
- 18 September 2001
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 64 (15) , 155102
- https://doi.org/10.1103/physrevb.64.155102
Abstract
We use the two-electron wave functions (geminals) and the simple screened Coulomb potential proposed by Overhauser [Can. J. Phys. 73, 683 (1995)] to compute the pair-distribution function for a uniform electron gas, finding the exact for this model and extending the results from to We find that the short-range part of this is in excellent agreement with quantum Monte Carlo simulations for a wide range of electron densities. We are thus able to estimate the value of the second-order coefficient of the small interelectronic-distance expansion of the pair-distribution function. The coefficients of the small- expansion of the spin-resolved have density or dependencies which we parametrize in a way that makes it easy to find their coupling-constant averages. Their spin-polarization or dependencies are estimated from a proposed spin-scaling relation.
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