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...
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 |
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Other Authors: | Massachusetts Institute of Technology. Department of Chemistry |
Format: | Article |
Language: | English |
Published: |
American Physical Society
2016
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Online Access: | http://hdl.handle.net/1721.1/105188 https://orcid.org/0000-0002-6164-485X |
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