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Predicting Scaling Properties from a Single Fluid Configuration.

Authors :
Schrøder TB
Source :
Physical review letters [Phys Rev Lett] 2022 Dec 09; Vol. 129 (24), pp. 245501.
Publication Year :
2022

Abstract

Time-dependent dynamical properties of a fluid cannot be estimated directly from a single configuration without performing a simulation. Here, however, we present a method that predicts the scaling properties of both structure and dynamics from a single configuration. The method is demonstrated to work well for the Lennard-Jones fluid as well as the viscous Kob-Andersen Lennard-Jones mixture, both in and out of equilibrium. The method is conceptually simple and easy to implement and, thus, should become a standard tool in the study of scaling properties of fluids and liquids.

Details

Language :
English
ISSN :
1079-7114
Volume :
129
Issue :
24
Database :
MEDLINE
Journal :
Physical review letters
Publication Type :
Academic Journal
Accession number :
36563245
Full Text :
https://doi.org/10.1103/PhysRevLett.129.245501