The transverse-current autocorrelation function CT(Q, t), obtained by molecular dynamics simulation of a dense Lennard-Jones fluid, has been analyzed in the wavevector range between the hydrodynamic region and Qp/2 (where Qp is the position of the main peak in the static structure factor). The exponential expansion theory (EET) provides a full and accurate account of CT(Q, t), and reveals a varied dynamical behaviour. We identify and accurately locate the Q value at which a shear wave begins to propagate, and show how this phenomenon is described as the continuous transition of a harmonic oscillator from the overdamped to the underdamped state. Moreover, this analysis reveals the existence of a second pair of modes equivalent to another oscillator that undergoes, at higher Q values, a similarly smooth over- to underdamped transition [1]. [1] E. Guarini et al., Phys. Rev. E (2023), in press

Transverse dynamics in fluids: how a collective excitation sets in

Ubaldo Bafile;Daniele Colognesi;Alessio De Francesco;Ferdinando Formisano;
2023

Abstract

The transverse-current autocorrelation function CT(Q, t), obtained by molecular dynamics simulation of a dense Lennard-Jones fluid, has been analyzed in the wavevector range between the hydrodynamic region and Qp/2 (where Qp is the position of the main peak in the static structure factor). The exponential expansion theory (EET) provides a full and accurate account of CT(Q, t), and reveals a varied dynamical behaviour. We identify and accurately locate the Q value at which a shear wave begins to propagate, and show how this phenomenon is described as the continuous transition of a harmonic oscillator from the overdamped to the underdamped state. Moreover, this analysis reveals the existence of a second pair of modes equivalent to another oscillator that undergoes, at higher Q values, a similarly smooth over- to underdamped transition [1]. [1] E. Guarini et al., Phys. Rev. E (2023), in press
2023
Istituto di Fisica Applicata - IFAC
Fluids dynamics
Molecular dynamics
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/20.500.14243/436388
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