Accurate Exchange-Correlation Energies for the Warm Dense Electron Gas

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[superscript 124] matrix elements via a stochastic solution of the Bloch equation. The results of these calculations resolve a current debate o...

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Bibliographic Details
Main Authors: Malone, Fionn D., Blunt, N. S., Brown, Ethan W., Lee, D. K. K., Spencer, J. S., Foulkes, W. M. C., Shepherd, James J
Other Authors: Massachusetts Institute of Technology. Department of Chemistry
Format: Article
Language:English
Published: American Physical Society 2016
Online Access:http://hdl.handle.net/1721.1/105188
https://orcid.org/0000-0002-6164-485X