High-density correlation energy expansion of the one-dimensional uniform electron gas

被引:24
|
作者
Loos, Pierre-Franois [1 ]
机构
[1] Australian Natl Univ, Res Sch Chem, Canberra, ACT 0200, Australia
来源
JOURNAL OF CHEMICAL PHYSICS | 2013年 / 138卷 / 06期
基金
澳大利亚研究理事会;
关键词
TOMONAGA-LUTTINGER-LIQUID; COLLECTIVE DESCRIPTION; BEHAVIOR; TRANSPORT; INTEGRALS; STATE;
D O I
10.1063/1.4790613
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
We show that the expression of the high-density (i.e., small-r(s)) correlation energy per electron for the one-dimensional uniform electron gas can be obtained by conventional perturbation theory and is of the form epsilon(c)(r(s)) = -pi(2)/360 + 0.00845 r(s) + ..., where r(s) is the average radius of an electron. Combining these new results with the low-density correlation energy expansion, we propose a local-density approximation correlation functional, which deviates by a maximum of 0.1 mhartree compared to the benchmark diffusion Monte Carlo calculations. (C) 2013 American Institute of Physics. [http://dx.doi.org/10.1063/1.4790613]
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页数:5
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