arXiv · 2603.23283
Analytic structure and asymptotic analysis of screened second-order exchange in the uniform electron gas
Abstract
The uniform electron gas underlies the local-density approximation of density-functional theory, yet correlation contributions beyond the random-phase approximation (RPA) are known mainly through high-dimensional numerical evaluation, not in closed form. We study the screened second-order exchange (``kite'') diagram, in which one interaction line carries a frequency-dependent screened interaction. For a single-pole reference model with a momentum-independent screening scale, we perform the frequency and loop integrals analytically and reduce the diagram to a one-dimensional integral, whose static limit reproduces in closed form the exact Onsager-Mittag-Stephen second-order exchange, fixing the absolute energy scale with no free parameter. A Mellin-Barnes analysis with rigorous remainder estimates gives the behaviour in both screening limits. Using the linearity of the reduced functional in the screened line, we replace the bare interaction by the physical static RPA (Lindhard) screening, so that the density enters only through the Thomas-Fermi scale rather than an assumed map, and its dependence is set by the endpoints of a single geometric kernel with exponents fixed by the diagram. We prove that this kernel is even and that its quadratic coefficient vanishes identically, so the high-density expansion contains no half-integer power; this justifies the integer-power-times-logarithm form used in recent numerical work and identifies a half-integer term there as an interpolation artifact. The construction extends to arbitrary spin polarization, the bare diagram being polarization-independent, and a dynamical adiabatic-connection evaluation normalized only to that limit reproduces the numerically evaluated kite for both the unpolarized and fully polarized gas, including the low-density sign change. The result is a controllable analytic reference for screened exchange beyond the RPA.
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Fumihiro Imoto. 2026-03-24. Analytic structure and asymptotic analysis of screened second-order exchange in the uniform electron gas. https://arxiv.org/abs/2603.23283
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