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Flow properties of magnetorheological (MR)fluids are greatly altered by the application of a magnetic field. The design, optimization, and control of novel devices that exploit MR fluid behavior in multidegree of freedom applications require three dimensional models characterizing the coupling of magnetic behavior to mechanical behavior in MR fluids. The authors have derived 3D MR fluid models based on multiscale kinetic theory. The underlying bases of the models are summarized, with phenomenological empiricism distinguished from multiscale first principles, and the models' ability to capture the experimentally measured mechanical response of a MR fluid-based damper to specified magnetic fields is assessed. The results of this comparison are that the kinetic theory-based models both relate macroscale MR fluid behavior to a first-principles description of magnetomechanical coupling at the microscale and possess the flexibility to best match the measured behavior of a particular MR fluid device observed in our experiments. [DOI: 10.1115/1.2979001] Keywords: magnetorheological fluid, multiscale model, kinetic theory, constitutive equation

Because of their remarkable performance properties and technological promise, polymer nanocomposites reinforced with single-walled carbon nanotubes (SWCNTs) have attracted considerable attention in the engineering, applied physics, and materials science communities. Recent experimental and computational investigations have shown that the presence of nanoscale defects in CNTs can significantly impact their electrical, mechanical, and thermal properties. In this article, for the first time, we examine the effect of defective CNTs on the interfacial characteristics and mechanical properties of CNT/polyethylene (PE) nanocomposites. Our molecular dynamics simulations show that as few as five vacancy defects in each CNT in a high-volume-fraction CNT/PE nanocomposite can decrease the longitudinal Young's modulus of the nanocomposite by as much as 18%, and the shear stress at the CNT/polymer interface by as much as 38%. By accounting for nanoscale defects and their effect on the CNT/polymer interfacial mechanics, our findings provide a practical guide for designing nanocomposites that are capable of attaining a desired set of elastic performance properties. [ABSTRACT FROM AUTHOR]

In the present study, the temperature-dependent coefficient of thermal expansion (CTE) of a graphene sheet (GS) is determined using molecular dynamics (MD) simulations. Our simulations show that the CTE of a GS (i) varies non-linearly with temperature, (ii) is negative over a temperature range of 0–500 K and (iii) differs by no more than 9% in the armchair and zigzag directions. We find good agreement between our MD results and recent experimental data. The present study also investigates the effect of missing atoms (vacancy defects) on the CTE of a GS. In our MD simulations of a 4.9 nm × 4.9 nm GS, we find that the presence of two vacant atoms (about 1.56% by volume) increases the negative CTE by as much as 40%. Correlations between the CTE and the number of missing atoms have been developed based on MD simulation results for a perfect GS and a GS with 1.56% defects by volume. Predictions of the CTE of a defective GS from the correlations compare favourably with MD simulations at 3.13% defects by volume. [ABSTRACT FROM AUTHOR]

The resistance to flow of magnetorheological (MR) fluids is greatly increased by the application of a magnetic field. At present, most devices exploiting this MR fluid behavior are pistons executing straight-line motion. The MR fluids in these devices are subjected to shear flow, and are modeled by either the Bingham plastic or Herschel-Buckley models, both 1D, phenomenological continuum-level forms relating strain rate, magnetic field magnitude, and stress magnitude, and fit to continuum-level empirical measurements. We employ a multiscale model of the MR fluid introduced in an earlier paper, which integrates nanoscale behavior over a mesoscale volume to deduce continuum properties. This approach replaces many of the phenomenological features of the Bingham plastic and Herschel-Buckley models with first principles, and isolates those few phenomenological features that remain into a single scalar term. The model is compared to the Bingham plastic and Herschel-Buckley models, assessing each model's ability to capture the experimentally measured mechanical response of a particular MR fluid-based damper to specified magnetic fields. The result of this comparison is that, our model possesses the flexibility to best match the measured behavior of the MR fluid device observed in our experiments, with fewer required experimental measurements. [ABSTRACT FROM AUTHOR]