Search results for "soft"

Viscometric behaviour of polymer blends based on poly (vinylidene fluoride)

1994

The viscosity behaviour of dilute dimethylformamide solutions of poly(vinylidene fluoride)-poly (methyl methacrylate) and poly(vinylidene fluoride)-polystyrene has been studied at 25°C. The polymer concentration ranges are such that neither phase separation nor microgel formation occurs, although we are very close to theta conditions. The intrinsic viscosity and viscosity interaction parameter of the ternary mixtures have been calculated. The estimation of the compatibility of the above polymer pairs has been studied based on: a) specific viscosities; b) viscosity interaction parameters, according to Krigbaum and Wall formalism, and c) viscosity interaction parameters of a system formed by …

Semidilute and Concentrated Polymer Solutions near Attractive Walls:  Dynamic Monte Carlo Simulation of Density and Pressure Profiles of a Coarse-Gra…

1997

Using a bead−spring model of flexible polymer chains, we study polymer adsorption from solutions onto attractive planar walls, varying both the strength of the adsorption potential e and the concentration of the solution over a wide range. Treating the case of good solvents, the profiles of density and pressure are computed and it is shown that thermal equilibrium between the adsorbed layer and the bulk solution is obtained. The case of a wall with purely repulsive potential under otherwise identical conditions is treated for comparison. It is shown that for the strongly adsorbing wall there is a pronounced layering, while a layered structure at the repulsive wall occurs only for high conce…

Nonisothermal elongational behavior of blends with liquid crystalline polymers

1994

Measurements of melt strength and breaking stretching ratio of several blends of thermoplastic polymers with liquid crystalline polymers are presented. The melt strength behavior depends not only on the viscosity of the blends but also on the temperature dependence of the viscosity. In particular, even if the viscosities of the blends are, at the extrusion temperature, lower than that of the thermoplastic matrices, the melt strength can be larger than that of the pure thermoplastics if its viscosity-temperature curve exceeds that of the matrices far from the solidification temperature. This behavior allows one to spin or film blow these blends despite the low viscosity.

Shear flow characterization of blends containing liquid crystal polymers

1992

A simple phenomenological approach is proposed in order to predict the presence of minima in the viscosity-composition curves of blends of thermoplastic with liquid crystal polymer (LCP). When the viscosity of the liquid crystal polymer is larger than that of the thermoplastic matrix, a minimum is observed. A possible explanation of the presence of yield stress in the flow curves of these blends is also given.

Recognition, Transformation, Detection of Nucleotides and Aqueous Nucleotide-Based Materials

2019

DESASS: A software tool for designing, simulating and optimising WWTPs

2008

This paper presents a very useful software tool to design, simulate and optimise wastewater treatment plants. The program is called DESASS (DEsign and Simulation of Activated Sludge Systems) and has been developed by CALAGUA research group. The mathematical model implemented is the Biological Nutrient Removal Model No.1 (BNRM1) which allows simulating the most important physical, chemical and biological processes taking place in treatment plants. DESASS calculates the performance under steady or transient state of whole treatment schemes including primary settlers, volatile fatty acid generation systems by primary sludge fermentation, activated sludge systems for biological organic matter a…

Nonlocal van der Waals Approach Merged with Double-Hybrid Density Functionals: Toward the Accurate Treatment of Noncovalent Interactions

2015

Noncovalent interactions drive the self-assembly of weakly interacting molecular systems to form supramolecular aggregates, which play a major role in nanotechnology and biochemistry. In this work, we present a thorough assessment of the performance of different double-hybrid density functionals (PBE0-DH-NL, revPBE0-DH-NL, B2PLYP-NL, and TPSS0-DH-NL), as well as their parent hybrid and (meta)GGA functionals, in combination with the most modern version of the nonlocal (NL) van der Waals correction. It is shown that this nonlocal correction can be successfully coupled with double-hybrid density functionals thanks to the short-range attenuation parameter b, which has been optimized against ref…

Dynamics of macromolecules grafted in spherical brushes under good solvent conditions

2013

Spherical polymer brushes have a structure intermediate between star polymers and polymer brushes on flat substrates, and are important building blocks of polymer nanoparticles. Molecular dynamics simulations are presented for isolated spherical polymer brushes under good solvent conditions, varying the grafting density as well as the chain length, using a coarse-grained bead-spring model of flexible chains. We complement previous work on the static properties of the same model by analyzing the chain dynamics, studying the motions of monomers in relation to their position along the grafted chains, and extract suitable relaxation times. A qualitative discussion in terms of the Rouse model is…

Surface and bulk ordering in thin films of a symmetrical diblock copolymer

2013

Amphiphilic diblock copolymers have the ability to adapt their surface's molecular composition to the hydrophilicity of their environment. In the case of about equal volume fractions of the two polymer blocks, the bulk of these polymers is known to develop a laminar ordering. We report here our investigation of the relationship between bulk ordering and surface morphology/chemical composition in thin films of such an amphiphilic diblock copolymer. Upon annealing in vacuum, the expected lamella ordering in the bulk of the film is observed and we find the morphology of the film surface to be defined by the thickness of the as-deposited film: If the as-deposited thickness matches the height of…

Precise structural investigation of symmetric diblock copolymer thin films with resonant soft X-ray reflectivity

2013

Symmetric diblock copolymers are known to form lamellar structures in the bulk of an organic thin film. Polymer/polymer and polymer/substrate interfaces play a critical role in this application. Here, we report the investigation of multiple buried interfaces by using a novel technique resonant soft X-ray reflectivity which benefits from enhanced contrast between different polymers near the carbon K-edge. This allows us to obtain a precise interface structure. We also present an alternative method to determine optical constants of polymers by fitting X-ray reflectivity of polymers with known structural parameters at specific soft X-ray energies. This approach is compared with the way of obta…