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液态态同构,罗森塔尔-塔拉萨诺温度标度,黎曼热力学几何。

Liquid state isomorphism, Rosenfeld-Tarazona temperature scaling, and Riemannian thermodynamic geometry.

机构信息

Technical University of Cologne, 50678 Köln, Germany.

Thermodynamics and Energy Technology, University of Paderborn, 33098 Paderborn, Germany.

出版信息

Phys Rev E. 2018 May;97(5-1):052149. doi: 10.1103/PhysRevE.97.052149.

Abstract

Aspects of isomorph theory, Rosenfeld-Tarazona temperature scaling, and thermodynamic geometry are comparatively discussed on the basis of the Lennard-Jones potential. The first two approaches approximate the high-density fluid state well when the repulsive interparticle interactions become dominant, which is typically the case close to the freezing line. However, previous studies of Rosenfeld-Tarazona scaling for the isochoric heat capacity and its relation to isomorph theory reveal deviations for the temperature dependence. It turns out that a definition of a state region in which repulsive interactions dominate is required for achieving consistent results. The Riemannian thermodynamic scalar curvature R allows for such a classification, indicating predominantly repulsive interactions by R>0. An analysis of the isomorphic character of the freezing line and the validity of Rosenfeld-Tarazona temperature scaling show that these approaches are consistent only in a small state region.

摘要

在伦纳德-琼斯势的基础上,比较讨论了同构理论、罗森菲尔德-塔拉萨诺温度标度和热力学几何的各个方面。前两种方法在排斥相互作用占主导地位时,很好地逼近了高密度流体状态,这种情况通常接近冻结线。然而,以前对等容热容的罗森菲尔德-塔拉萨诺标度及其与同构理论的关系的研究表明,温度依赖性存在偏差。事实证明,需要定义一个以排斥相互作用为主导的状态区域,才能得到一致的结果。黎曼热力学标量曲率 R 允许这样的分类,表明 R>0 表示主要的排斥相互作用。对冻结线的同构特征和罗森菲尔德-塔拉萨诺温度标度的有效性的分析表明,这些方法仅在一个小的状态区域内是一致的。

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