Theoretical approach to the correlations of a classical crystal

被引:51
作者
Rascon, C [1 ]
Mederos, L [1 ]
Navascues, G [1 ]
机构
[1] UNIV AUTONOMA MADRID,INST CIENCIA MAT,E-28049 MADRID,SPAIN
来源
PHYSICAL REVIEW E | 1996年 / 54卷 / 02期
关键词
D O I
10.1103/PhysRevE.54.1261
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
We present a theoretical approach to the angular-average of the two-body correlation function (g) over tilde(r) for simple solids. It is based on three sum rules for (g) over tilde(r): the virial, compressibility, and normalization equations. We apply the theory to determine this correlation function for the case of the fee solid phase of hard spheres. The agreement with simulation data is excellent over all the density range. The application to other simple systems is discussed. The approach opens a route to perturbation theories for simple solids.
引用
收藏
页码:1261 / 1264
页数:4
相关论文
共 13 条
  • [1] HARD-SPHERE RADIAL-DISTRIBUTION FUNCTIONS FOR FACE-CENTERED CUBIC AND HEXAGONAL CLOSE-PACKED PHASES - REPRESENTATION AND USE IN A SOLID-STATE PERTURBATION-THEORY
    CHOI, YM
    REE, T
    REE, FH
    [J]. JOURNAL OF CHEMICAL PHYSICS, 1991, 95 (10) : 7548 - 7561
  • [2] DENSITY-FUNCTIONAL APPROACH TO THE EQUATION OF STATE OF A HARD-SPHERE CRYSTAL
    DENTON, AR
    ASHCROFT, NW
    CURTIN, WA
    [J]. PHYSICAL REVIEW E, 1995, 51 (01): : 65 - 73
  • [3] Evans R., 1992, FUNDAMENTALS INHOMOG
  • [4] Hansen J P., 2013, Theory of Simple Liquids: With Applications to Soft Matter
  • [5] KIRDILIS A, 1993, PHYS REV E, V47, P427
  • [6] DENSITY FUNCTIONAL THEORY OF FREEZING - ANALYSIS OF CRYSTAL DENSITY
    LAIRD, BB
    MCCOY, JD
    HAYMET, ADJ
    [J]. JOURNAL OF CHEMICAL PHYSICS, 1987, 87 (09) : 5449 - 5456
  • [7] CAN THE THERMODYNAMIC PROPERTIES OF A SOLID BE MAPPED ONTO THOSE OF A LIQUID
    LUTSKO, JF
    BAUS, M
    [J]. PHYSICAL REVIEW LETTERS, 1990, 64 (07) : 761 - 763
  • [8] PERTURBATION-THEORY APPLIED TO THE FREEZING OF CLASSICAL-SYSTEMS
    MEDEROS, L
    NAVASCUES, G
    TARAZONA, P
    [J]. PHYSICAL REVIEW E, 1994, 49 (03): : 2161 - 2166
  • [9] DENSITY DISTRIBUTION IN A HARD-SPHERE CRYSTAL
    OHNESORGE, R
    LOWEN, H
    WAGNER, H
    [J]. EUROPHYSICS LETTERS, 1993, 22 (04): : 245 - 249
  • [10] ANALYSIS OF CLASSICAL STATISTICAL MECHANICS BY MEANS OF COLLECTIVE COORDINATES
    PERCUS, JK
    YEVICK, GJ
    [J]. PHYSICAL REVIEW, 1958, 110 (01): : 1 - 13