11 citations · 11 across the 4 of their papers we have counts for
5 papers
From Single-Chain Dynamics to Structure Formation: Dynamic Self-Consistent Field Theory and Molecular Dynamics of (Co)polymer Melts across Entanglement Regimes
Alireza F. Behbahani, Jafar Cheraghalizadeh, Friederike Schmid
Dynamic self-consistent field theory (DSCFT) provides an efficient continuum framework for studying structure formation in inhomogeneous polymer systems, but its predictive accurac…
Stress Relaxation in Monodisperse Entangled Polymer Melts: Correlation Between Viscoelastic Response and Single-Chain Relaxation via Molecular Dynamics Simulations
Alireza F. Behbahani
We study stress relaxation in several types of entangled monodisperse linear polymer melts by comparing the shear stress relaxation modulus, , with the end-to-end vector auto…
Relaxation Dynamics of Entangled Linear Polymer Melts via Molecular Dynamics Simulations
Alireza F. Behbahani, Friederike Schmid
We present an extensive analysis of the relaxation dynamics of entangled linear polymer melts via long-time molecular dynamics simulations of a generic bead-spring model. We study…
Relaxation Dynamics of a Liquid in the Vicinity of an Attractive Surface: The Process of Escaping from the Surface
Alireza F. Behbahani, Vagelis Harmandaris
We analyze the displacements of the particles of a glass-forming molecular liquid perpendicular to a confining solid surface, using extensive molecular dynamics simulations with at…
Dynamics and Rheology of Polymer Melts via Hierarchical Atomistic, Coarse-grained, and Slip-spring Simulations
Alireza F. Behbahani, Ludwig Schneider, Anastassia Rissanou +9
A hierarchical (triple scale) simulation methodology is presented for the prediction of the dynamical and rheological properties of high molecular weight entangled polymer melts. T…