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Colloids dynamic scaling length

The self-organization or assembly of nnits at the nanoscale to form supramolecnlar ensembles on mesoscopic length scales comprises the range of colloidal systems. There is a need to understand the connection between structure and properties, the evolution and dynamics of these structures at the different levels—supramolecnlar, molecular, and sub-molecular— by learning from below. ... [Pg.689]

Simulation techniques suitable for the description of phenomena at each length-scale are now relatively well established Monte Carlo (MC) and Molecular Dynamics (MD) methods at the molecular length-scale, various mesoscopic simulation methods such as Dissipative Particle Dynamics (Groot and Warren, 1997), Brownian Dynamics, or Lattice Boltzmann in the colloidal domain, Computational Fluid Dynamics at the continuum length-scale, and sequential-modular or equation-based methods at the unit operation/process-systems level. [Pg.138]

However, because ILs can act to modify the interparticle interactions between colloidal particles, the effects that different ILs have on the colloidal stability are not well understood [130], To have a proper comprehension of the colloidal stability in ILs, it is critical to understand the dynamic behaviors of such colloids. XPCS, due to its suitable time and length scale, is unquestionably a technique that can offer a unique perspective to unveil the hidden mechanism governing the colloidal stabilities. While such smdies do not yet exist, we will use the following example to illustrate the capabilities of XPCS in elucidating particle dynamics. [Pg.203]

The dynamical behavior of macromolecules in solution is strongly affected or even dominated by hydrodynamic interactions [6,104,105]. Erom a theoretical point of view, scaling relations predicted by the Zimm model for, e.g., the dependencies of dynamical quantities on the length of the polymer are, in general, accepted and confirmed [106]. Recent advances in experimental single-molecule techniques provide insight into the dynamics of individual polymers, and raise the need for a quantitative theoretical description in order to determine molecular parameters such as diffusion coefficients and relaxation times. Mesoscale hydrodynamic simulations can be used to verify the validity of theoretical models. Even more, such simulations are especially valuable when analytical methods fail, as for more complicated molecules such as polymer brushes, stars, ultrasoft colloids, or semidilute solutions, where hydrodynamic interactions are screened to a certain degree. Here, mesoscale simulations still provide a full characterization of the polymer dynamics. [Pg.46]

It seems that we are not far from a new and this time quantitative understanding of specific ion effects in colloid and surface chemistry. The key is the use of ion-surface potentials and water profiles near surfaces inferred from molecular dynamics simulation and their appropriate use in solvent-averaged models in order to derive an efficient, but physically well-based alternative to DLVO. The modified Poisson-Boltzmann equation is shown to be useful approach to calculate thermodynamic properties that depend on energies and structures at different length scales. [Pg.308]

A number of methods exist to simulate dispersed multiphase flows. When choosing a particular simulation method, it is important to consider first the relevant length scales. The most obvious length scales are, from large to small, the dimensions of the confinement (equipment dimensions), the dimensions of the discrete elements (particles, bubbles, or droplets), and the mean free path of the molecules in the continuous fluid phase. The molecular mean free path ranges firom less than a nanometer in a liquid to the order of 100 nm in a gas at ambient pressure. Discrete molecular effects such as Brownian forces and molecular slip conditions are therefore very important in nanofluidic and small microfluidic devices (Hadjiconstantinou, 2006). They are also very important for the dynamic behavior of nano (structured) particles in gas flows and colloidal particles suspended in a liquid. In these... [Pg.139]


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