Ab initio quantum Monte Carlo simulation of the warm dense electron gas

被引:63
作者
Dornheim, Tobias [1 ]
Groth, Simon [1 ]
Malone, Fionn D. [2 ]
Schoof, Tim [1 ]
Sjostrom, Travis [3 ]
Foulkes, W. M. C. [2 ]
Bonitz, Michael [1 ]
机构
[1] Christian Albrechts Univ Kiel, Inst Theoret Phys & Astrophys, D-24098 Kiel, Germany
[2] Imperial Coll London, Dept Phys, Exhibit Rd, London SW7 2AZ, England
[3] Los Alamos Natl Lab, Div Theoret, Los Alamos, NM 87545 USA
基金
英国工程与自然科学研究理事会;
关键词
EQUATION-OF-STATE; FUNCTIONAL THEORY; SIGN PROBLEM; SYSTEMS; THERMODYNAMICS; EXCHANGE; PLASMAS; MATTER;
D O I
10.1063/1.4977920
中图分类号
O35 [流体力学]; O53 [等离子体物理学];
学科分类号
070204 ; 080103 ; 080704 ;
摘要
Warm dense matter is one of the most active frontiers in plasma physics due to its relevance for dense astrophysical objects and for novel laboratory experiments in which matter is being strongly compressed, e. g., by high-power lasers. Its description is theoretically very challenging as it contains correlated quantum electrons at finite temperature-a system that cannot be accurately modeled by standard analytical or ground state approaches. Recently, several breakthroughs have been achieved in the field of fermionic quantum Monte Carlo simulations. First, it was shown that exact simulations of a finite model system (30. 100 electrons) are possible, which avoid any simplifying approximations such as fixed nodes [Schoof et al., Phys. Rev. Lett. 115, 130402 (2015)]. Second, a novel way to accurately extrapolate these results to the thermodynamic limit was reported by Dornheim et al. [Phys. Rev. Lett. 117, 156403 (2016)]. As a result, now thermodynamic results for the warm dense electron gas are available, which have an unprecedented accuracy on the order of 0.1%. Here, we present an overview on these results and discuss limitations and future directions. Published by AIP Publishing.
引用
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页数:10
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