Search results for "Collision dynamics"
showing 5 items of 5 documents
Field effect in the viscosity of magnetic colloids studied by multi-particle collision dynamics
2019
Abstract Colloidal solutions of magnetic nanoparticles are usually employed when the fluidity and magnetic properties are required at the same time, either in technical or biomedical applications. However, when the magnetic size of the nanoparticles is large enough (>12–15 nm) the colloid may form an equilibrium structure with or without the external magnetic field, which can significantly influence its rheology. Using multi-particle collision dynamics we study the internal structure and viscosity of the magnetic colloids at varying magnitudes of the externally applied field. We show a generalized structural behavior across all studied regimes and an appreciable increase of flow resistance …
Self-assembly and rheology of dipolar colloids in simple shear studied using multi-particle collision dynamics.
2017
Magnetic nanoparticles in a colloidal solution self-assemble in various aligned structures, which has a profound influence on the flow behavior. However, the precise role of the microstructure in the development of the rheological response has not been reliably quantified. We investigate the self-assembly of dipolar colloids in simple shear using hybrid molecular dynamics and multi-particle collision dynamics simulations with explicit coarse-grained hydrodynamics, conduct simulated rheometric studies and apply micromechanical models to produce master curves, showing evidence of the universality of the structural behavior governed by the competition between the bonding (dipolar) and erosive …
Statistical mechanics of fullerene coalescence growth
2006
Among the different carbon allotropes fullerenes are exceptionally intriguing for their spheroidal topology out of pentagons and hexagons. However, the dominant formation mode is still ambiguous. Here, we analyze the fullerene formation process by the statistical analysis of fullerene sizes produced in a laser-induced microplasma finding that a simple two-parameter lognormal distribution describes impressively well the cluster frequencies under various conditions. Our findings clearly reveal coalescent growth following a classical collision dynamics and disagree with several earlier assumptions.
Modeling hydrodynamic interactions in soft materials with multiparticle collision dynamics
2019
Multiparticle collision dynamics (MPCD) is a flexible and robust mesoscale computational technique for simulating solvent-mediated hydrodynamic interactions in soft materials. Here, we provide a critical overview of the MPCD method and summarize its current strengths and limitations. The capabilities of the method are highlighted by reviewing its recent applications to simulate diverse phenomena, ranging from the flow of complex fluids and thermo-osmotic transport to bacterial swimming and active particle self-assembly. We also discuss outstanding challenges and emerging methodological developments that are expected to greatly expand the applicability of MPCD to other systems of technologic…
Stratification of polymer mixtures in drying droplets: Hydrodynamics and diffusion
2020
We study the evaporation-induced stratification of a mixture of short and long polymer chains in a drying droplet using molecular simulations. We systematically investigate the effects of hydrodynamic interactions (HI) on this process by comparing hybrid simulations accounting for HI between polymers through the multiparticle collision dynamics technique with free-draining Langevin dynamics simulations neglecting the same. We find that the dried supraparticle morphologies are homogeneous when HI are included but are stratified in core--shell structures (with the short polymers forming the shell) when HI are neglected. The simulation methodology unambiguously attributes this difference to th…