Simple periodic boundary conditions for molecular simulation of uniaxial flow

DOI10.1016/j.jcp.2022.111740OpenAlexW4308469716MaRDI QIDQ2106954

Abdel Kader A. Geraldo, Matthew Dobson

Publication date: 29 November 2022

Published in: Journal of Computational Physics (Search for Journal in Brave)

Full work available at URL: https://arxiv.org/abs/2110.08342

zbMATH Keywords

extensional flowperiodic boundary conditionsnon-equilibrium molecular dynamics

Mathematics Subject Classification ID

Basic methods in fluid mechanics (76Mxx) Multiphase and multicomponent flows (76Txx) Foundations, constitutive equations, rheology, hydrodynamical models of non-fluid phenomena (76Axx)

Related Items (1)

Convergence of nonequilibrium Langevin dynamics for planar flows

Cites Work

• Unnamed Item
• Factoring polynomials with rational coefficients
• Nonlinear shear and elongational rheology of model polymer melts by non-equilibrium molecular dynamics
• Nonequilibrium Molecular Dynamics
• Extensional motions of spatially periodic lattices
• The Equation Φ(x) = k

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