Simple periodic boundary conditions for molecular simulation of uniaxial flow

DOI10.1016/J.JCP.2022.111740OpenAlexW4308469716MaRDI QIDQ2106954FDOQ2106954

Authors: M. Dobson, Abdel Kader A. Geraldo 

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

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zbMATH Keywords

periodic boundary conditionsextensional flownon-equilibrium molecular dynamics

Mathematics Subject Classification ID

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

Cites Work

• Title not available (Why is that?)
• Factoring polynomials with rational coefficients
• Extensional motions of spatially periodic lattices
• Nonlinear shear and elongational rheology of model polymer melts by non-equilibrium molecular dynamics
• The Equation Φ(x) = k
• Nonequilibrium Molecular Dynamics

Cited In (2)

• Convergence of nonequilibrium Langevin dynamics for planar flows
• Simple Periodic Boundary Conditions for Molecular Simulation of Uniaxial Flow

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