580 research outputs found
Two-dimensional perturbations in a scalar model for shear banding
We present an analytical study of a toy model for shear banding, without
normal stresses, which uses a piecewise linear approximation to the flow curve
(shear stress as a function of shear rate). This model exhibits multiple
stationary states, one of which is linearly stable against general
two-dimensional perturbations. This is in contrast to analogous results for the
Johnson-Segalman model, which includes normal stresses, and which has been
reported to be linearly unstable for general two-dimensional perturbations.
This strongly suggests that the linear instabilities found in the
Johnson-Segalman can be attributed to normal stress effects.Comment: 16 pages, 10 figures, to appear in EPJE, available online first,
click DOI or http://www.springerlink.com/content/q1q0187385017628
Water-Ethanol and Methanol-Ethanol Separations Using in Situ Confined Polymer Chains in a Metal-Organic Framework
On the inner workings of Monte Carlo codes
We review state-of-the-art Monte Carlo (MC) techniques for computing fluid coexistence properties (Gibbs simulations) and adsorption simulations in nanoporous materials such as zeolites and metal-organic frameworks. Conventional MC is discussed and compared to advanced techniques such as reactive MC, configurational-bias Monte Carlo and continuous fractional MC. The latter technique overcomes the problem of low insertion probabilities in open systems. Other modern methods are (hyper-)parallel tempering, Wang-Landau sampling and nested sampling. Details on the techniques and acceptance rules as well as to what systems these techniques can be applied are provided. We highlight consistency tests to help validate and debug MC codes
Design, Parameterization, and Implementation of Atomic Force Fields for Adsorption in Nanoporous Materials
Design, Parameterization, and Implementation of Atomic Force Fields for Adsorption in Nanoporous Materials
Behavior of the Enthalpy of Adsorption in Nanoporous Materials Close to Saturation Conditions
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