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Updated: Sep 4, 2026

An Analog Macroscopic Technique for Studying Molecular Hydrodynamic Processes in Dense Gases and Liquids
Published on: December 4, 2017
Frenkel line of Yukawa fluids within the self-consistent relaxation theory
Anatolii Mokshin1, Ilnaz Fayrushin2
1Department of Computational Physics, Kazan Federal University, 18 Kremlyovskaya Street, Kazan, Tatarstan, 420008, Russian Federation.
Abstract:
For a simple model fluid, the Yukawa fluid, the condition for dynamic crossover, known as the Frenkel line, is defined. The condition is related to the fact that the roton minimum in the dispersion relation of longitudinal acoustic-like excitations exists only when the collective vibrational dynamics of particles dominates in the liquid. Based on the self-consistent relaxation theory for the Yukawa fluid, thermodynamic states are determined in which the roton minimum disappears. The obtained values of the state parameters for the Frenkel line are consistent with the results of studies in which the position of this line on the phase diagram of the Yukawa fluid was determined using molecular dynamics simulations. It is shown that the Frenkel line in this system can be determined directly from the structural characteristic - the static structure factor. A physical interpretation of the roton minimum frequency for simple liquids near the Frenkel line is proposed.
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