A mesoscopic model for the rheology of dilute and semidilute solutions of wormlike micelles
arXiv:2504.08354 · doi:10.1122/8.0001030
Abstract
The concept of a `persistent worm' is introduced, representing the smallest possible length of a wormlike micelle, and modelled by a bead-spring chain with sticky beads at the ends. Persistent worms are allowed to combine with each other at their sticky ends to form wormlike micelles with a distribution of lengths, and the semiflexibility of a wormlike micelle is captured with a bending potential between springs, both within and across persistent worms that stick to each other. Multi-particle Brownian dynamics simulations of such polydisperse and `polyflexible' wormlike micelles, with hydrodynamic interactions included and coupled with reversible scission/fusion of persistent worms, are used to investigate the static and dynamic properties of wormlike micellar solutions in the dilute and unentangled semidilute concentration regimes. The influence of the sticker energy and persistent worm concentration are examined and simulations are shown to validate theoretical mean-field predictions of the universal scaling with concentration of the chain length distribution of linear wormlike micelles, independent of the sticker energy. The presence of wormlike micelles that form rings is shown not to affect the static properties of linear wormlike micelles and mean-field predictions of ring length distributions are validated. Linear viscoelastic storage and loss moduli are computed and the unique features in the intermediate frequency regime compared to those of homopolymer solutions are highlighted. The inclusion of hydrodynamic interactions (HI) enables the distinction between Rouse and Zimm dynamics in wormlike micelle solutions to be elucidated. While the neglect of HI is justified in the case of entangled wormlike micelle solutions, here the concentration at which the onset of the screening of hydrodynamic interactions occurs is clearly identified.
arXiv comment34 pages, 24 figures, to appear in the Journal of Rheology
References in corpus (17)
- Rheology of giant micelles
- Rapid Sampling of Stochastic Displacements in Brownian Dynamics Simulations
- Dynamical Monte Carlo Study of Equilibrium Polymers : Static Properties
- Shear banding in time-dependent flows of polymers and wormlike micelles
- Optimisation of a Brownian dynamics algorithm for semidilute polymer solutions
- Dynamic vorticity banding in discontinuously shear thickening suspensions
- Dynamical Monte Carlo Study of Equilibrium Polymers (II): The Role of Rings
- Universal dynamics of dilute and semidilute solutions of flexible linear polymers
- Vorticity structuring and Taylor-like velocity rolls triggered by gradient shear bands
- Scale-free Monte Carlo method for calculating the critical exponent of self-avoiding walks
- Dynamical Monte Carlo Study of Equilibrium Polymers: Effects of High Density and Ring Formation
- Quantized bounding volume hierarchies for neighbor search in molecular simulations on graphics processing units
- Non-axisymmetric instability of shear-banded Taylor-Couette flow
- Constitutive modeling of dilute wormlike micelle solutions: shear-induced structure and transient dynamics
- Universality of the collapse transition of sticky polymers
- Dilute polymer solutions under shear flow: comprehensive qualitative analysis using a bead-spring chain model with a FENE-Fraenkel spring
- Evanescent Gels: Competition Between Sticker Dynamics and Single Chain Relaxation