Your browser doesn't support javascript.
loading
Sampling Efficiency of Transverse Forces in Dense Liquids.
Ghimenti, Federico; Berthier, Ludovic; Szamel, Grzegorz; van Wijland, Frédéric.
Afiliação
  • Ghimenti F; Laboratoire Matière et Systèmes Complexes (MSC), Université Paris Cité et CNRS (UMR 7057), 75013 Paris, France.
  • Berthier L; Laboratoire Charles Coulomb (L2C), Université de Montpellier et CNRS (UMR 5221), 34095 Montpellier, France.
  • Szamel G; Yusuf Hamied Department of Chemistry, University of Cambridge, Lensfield Road, Cambridge CB2 1EW, United Kingdom.
  • van Wijland F; Department of Chemistry, Colorado State University, Fort Collins, Colorado 80523, USA.
Phys Rev Lett ; 131(25): 257101, 2023 Dec 22.
Article em En | MEDLINE | ID: mdl-38181341
ABSTRACT
Sampling the Boltzmann distribution using forces that violate detailed balance can be faster than with the equilibrium evolution, but the acceleration depends on the nature of the nonequilibrium drive and the physical situation. Here, we study the efficiency of forces transverse to energy gradients in dense liquids through a combination of techniques Brownian dynamics simulations, exact infinite-dimensional calculation, and a mode-coupling approximation. We find that the sampling speedup varies nonmonotonically with temperature, and decreases as the system becomes more glassy. We characterize the interplay between the distance to equilibrium and the efficiency of transverse forces by means of odd transport coefficients.

Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Ano de publicação: 2023 Tipo de documento: Article

Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Ano de publicação: 2023 Tipo de documento: Article