EQUATION OF STATE OF THE ONE-COMPONENT PLASMA DERIVED FROM PRECISION MONTE-CARLO CALCULATIONS

被引:189
作者
STRINGFELLOW, GS
DEWITT, HE
SLATTERY, WL
机构
[1] UNIV CALIF SANTA CRUZ, BOARD STUDIES ASTRON & ASTROPHYS, LICK OBSERV, SANTA CRUZ, CA 95064 USA
[2] UNIV CALIF LAWRENCE LIVERMORE NATL LAB, INST GEOPHYS & PLANETARY PHYS, LIVERMORE, CA 94550 USA
[3] UNIV CALIF SANTA CRUZ, INST NONLINEAR SCI, SANTA CRUZ, CA 95064 USA
[4] UNIV CALIF LOS ALAMOS SCI LAB, LOS ALAMOS, NM 87545 USA
来源
PHYSICAL REVIEW A | 1990年 / 41卷 / 02期
关键词
D O I
10.1103/PhysRevA.41.1105
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
Analytical fits to the one-component plasma (OCP) equation of state have been derived for internal energies that have reduced all N-dependent effects to within the statistical uncertainties introduced by the Monte Carlo computational process, which themselves are very small. Values of N500 adequately represent the thermodynamic limit. Using the fluid internal energies for only N=686, various analytical fits are generated, compared, and discussed. The thermal energy is accurately represented by a simple power-series fit with the leading term given by 1/3, but also requires a small correction to the bcc Madelung term that brings that coefficient down to nearly -0.9, the value derived for hypernetted-chain theory. The fluid thermal energy data are reproduced to better than 0.2% over all by our fit(s). The solid phase requires both anharmonic terms to be included in the fit, implying that the previous justification for dropping the first anharmonic correction is unwarranted. The location of the fluid-solid phase transition utilizing these new fits yields bcc=178 and fcc=192. © 1990 The American Physical Society.
引用
收藏
页码:1105 / 1111
页数:7
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