Predicting Flory-Huggins χ from Simulations
نویسندگان
چکیده
منابع مشابه
Predicting the Flory-Huggins χ Parameter for Polymers with Stiffness Mismatch from Molecular Dynamics Simulations
The Flory–Huggins χ parameter describes the excess free energy of mixing and governs phase behavior for polymer blends and block copolymers. For chemically-distinct nonpolar polymers, the value of χ is dominated by the mismatch in cohesive energy densities of the monomers. For blends of chemically-similar polymers, the entropic portion of χ, arising from non-ideal local packing, becomes more si...
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The pressure dependence of the Flory Huggins interaction parameter of two binary polymer blends was investigated by small angle neutron scattering (SANS). We studied the polymer blends deutero PoIystyrene / Polyvinylmethylether (d PS / PVME) and deutero Polystyrene / Polyphenylmethylsiloxane (d PS / PPMS), exhibiting decomposition at high and at low temperatures, respectiveIy. In both cases the...
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This study linked the chemical potential change to high specific filtration resistance (SFR) of gel layer, and then proposed a novel membrane fouling mechanism regarding gel layer filtration, namely, Flory-Huggins based filtration mechanism. A mathematical model for this mechanism was theoretically deduced. Agar was used as a model polymer for gel formation. Simulation of the mathematical model...
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A simple analytic theory for mixtures of hard spheres and larger polymers with excluded volume interactions is developed. The mixture is shown to exhibit extensive immiscibility. For large polymers with strong excluded volume interactions, the density of monomers at the critical point for demixing decreases as one over the square root of the length of the polymer, while the density of spheres t...
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Boehm and Martire have shown that the Flory-Huggins (FH) lattice model applied to mixtures of squares and rigid rods in solvent on a two dimensional lattice gives different results depending on whether rods or squares are placed first onto the lattice. This correct derivation places the validity of the FH model itself into question since the final result should be independent of the order of pl...
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ژورنال
عنوان ژورنال: Physical Review Letters
سال: 2017
ISSN: 0031-9007,1079-7114
DOI: 10.1103/physrevlett.119.017801