Original paper
Accurate Exchange-Correlation Energies for the Warm Dense Electron Gas
Abstract
The density matrix quantum Monte Carlo (DMQMC) method is used to sample exact-on-average N-body density matrices for uniform electron gas systems of up to 10^{124} matrix elements via a stochastic solution of the Bloch equation. The results of these calculations resolve a current debate over the accuracy of the data used to parametrize finite-temperature density functionals. Exchange-correlation energies calculated using the real-space...
Paper Details
Title
Accurate Exchange-Correlation Energies for the Warm Dense Electron Gas
Published Date
Sep 7, 2016
Journal
Volume
117
Issue
11
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