Exchange-correlation energy for the 3D homogeneous electron gas at arbitrary temperature
Abstract
We fit finite-temperature path integral Monte Carlo calculations of the exchange-correlation energy of the 3D finite-temperature homogeneous electron gas in the warm-dense regime (rs = (3/4π n)1/3 aB-1 < 40 and = T/TF > 0.0625). In doing so, we construct a Pad\'e approximant which collapses to Debye-H\"uckel theory in the high-temperature, low-density limit. Likewise, the zero-temperature limit matches the numerical results of ground-state quantum Monte Carlo, as well as analytical results in the high-density limit.
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