Theory of length-scale dependent relaxation moduli and stress fluctuations in glass-forming and viscoelastic liquids - Archive ouverte HAL
Article Dans Une Revue The Journal of Chemical Physics Année : 2022

Theory of length-scale dependent relaxation moduli and stress fluctuations in glass-forming and viscoelastic liquids

Résumé

The spatiotemporal correlations of the local stress tensor in supercooled liquids are studied both theoretically and by molecular dynamics simulations of a two-dimensional (2D) polydisperse Lennard-Jones system. Asymptotically exact theoretical equations defining the dynamical structure factor and all components of the stress correlation tensor for low wave-vector q are presented in terms of the generalized ( q-dependent) shear and longitudinal relaxation moduli, G( q, t) and K( q, t). We developed a rigorous approach (valid for low q) to calculate K( q, t) in terms of certain bulk correlation functions (for q = 0), the static structure factor S( q), and thermal conductivity κ. The proposed approach takes into account both the thermostatting effect and the effect of polydispersity. The theoretical results for the ( q, t)-dependent stress correlation functions are compared with our simulation data, and an excellent agreement is found for [Formula: see text] (with [Formula: see text] being the mean particle diameter) both above and below the glass transition without any fitting parameters. Our data are consistent with recently predicted (both theoretically and by simulations) long-range correlations of the shear stress quenched in heterogeneous glassy structures.
Fichier principal
Vignette du fichier
245hal.pdf (753.07 Ko) Télécharger le fichier
Origine Fichiers produits par l'(les) auteur(s)

Dates et versions

hal-03806940 , version 1 (08-10-2022)

Identifiants

Citer

L. Klochko, J. Baschnagel, J. Wittmer, H. Meyer, O. Benzerara, et al.. Theory of length-scale dependent relaxation moduli and stress fluctuations in glass-forming and viscoelastic liquids. The Journal of Chemical Physics, 2022, 156 (16), pp.164505. ⟨10.1063/5.0085800⟩. ⟨hal-03806940⟩
20 Consultations
86 Téléchargements

Altmetric

Partager

More