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arXiv 0708.2677cond-mat.stat-mechcond-mat.softphysics.chem-ph
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奇数维硬超球流体的结构

Structure of hard-hypersphere fluids in odd dimensions

Rene D. Rohrmann, Andres Santos

摘要:

本文用解析近似方法研究了奇维空间$d$中硬超球单组分流体的结构性质。B. Yuste和A. Santos,Phys.Rev.A { \bf 43},5418(1991)]。该理论利用精确形式的径向分布函数的第一阶密度和扩展到有限密度假设一个合理的形式定义在拉普拉斯空间的函数,由简单的物理要求确定的系数。傅立叶变换的逆贝塞尔多项式构成的数学框架,从静态结构因子的解析表达式得到的近似。在其最基本的形式,该方法恢复的Percus-Yevick封闭的Ornstein-Zernike方程的奇维超球的解决方案。目前的形式主义允许人们通过产生维里和压缩性路线之间热力学一致性的解来超越任何期望的状态方程。与现有的计算机模拟数据在$d=5$和$d=7$得到了很好的协议。作为本研究的副产品,给出了任意奇数维两个全同超球面相交体积的精确和显式的多项式表达式。

英文摘要:

The structural properties of single component fluids of hard hyperspheres in odd space dimensionalities $d$ are studied with an analytical approximation method that generalizes the Rational Function Approximation earlier introduced in the study of hard-sphere fluids [S. B. Yuste and A. Santos, Phys. Rev. A {\bf 43}, 5418 (1991)]. The theory makes use of the exact form of the radial distribution function to first order in density and extends it to finite density by assuming a rational form for a function defined in Laplace space, the coefficients being determined by simple physical requirements. Fourier transform in terms of reverse Bessel polynomials constitute the mathematical framework of this approximation, from which an analytical expression for the static structure factor is obtained. In its most elementary form, the method recovers the solution of the Percus-Yevick closure to the Ornstein-Zernike equation for hyperspheres at odd dimension. The present formalism allows one to go beyond by yielding solutions with thermodynamic consistency between the virial and compressibility routes to any desired equation of state. Excellent agreement with available computer simulation data at $d=5$ and $d=7$ is obtained. As a byproduct of this study, an exact and explicit polynomial expression for the intersection volume of two identical hyperspheres in arbitrary odd dimensions is given.

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