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Register a new userVibrational model of thermal conduction for fluids with soft interactions
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Authors
S. A. Khrapak
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A vibrational model of heat transfer in simple liquids with soft pairwise interatomic interactions is discussed. A general expression is derived, which involves an averaging over the liquid collective mode excitation spectrum. The model is applied to quantify heat transfer in a dense Lennard-Jones liquid and a strongly coupled one-component plasma. Remarkable agreement with the available numerical results is documented. A similar picture does not apply to the momentum transfer and shear viscosity of liquids.
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Ethyl-hexyl substituted polyfluorene (PF) with its high level of molecular disorder can be described very well by one-carrier space-charge-limited conduction for a discrete set of trap levels with energy $sim$ 0.5 eV above the valence band edge. Sweeping the bias above the trap-filling limit in the as-is polymer generates a new set of exponential traps, which is clearly seen in the density of states calculations. The trapped charges in the new set of traps have very long lifetimes and can be detrapped by photoexcitation. Thermal cycling the PF film to a crystalline phase prevents creation of additional traps at higher voltages.
Thermal conductivities (TCs) of the vast majority of amorphous polymers are in a very narrow range, 0.1 $sim$ 0.5 Wm$^{-1}$K$^{-1}$, although single polymer chains possess TC of orders-of-magnitude higher. Entanglement of polymer chains plays an important role in determining the TC of bulk polymers. We propose a thermal resistance network (TRN) model for TC in amorphous polymers taking into account the entanglement of molecular chains. Our model explains well the physical origin of universally low TC observed in amorphous polymers. The empirical formulae of pressure and temperature dependence of TC can be successfully reproduced from our model not only in solid polymers but also in polymer melts. We further quantitatively explain the anisotropic TC in oriented polymers.
A computational approach is introduced for the study of the rheological properties of complex fluids and soft materials. The approach allows for a consistent treatment of microstructure elastic mechanics, hydrodynamic coupling, thermal fluctuations, and externally driven shear flows. A mixed description in terms of Eulerian and Lagrangian reference frames is used for the physical system. Microstructure configurations are represented in a Lagrangian reference frame. Conserved quantities, such as momentum of the fluid and microstructures, are represented in an Eulerian reference frame. The mathematical formalism couples these different descriptions using general operators subject to consistency conditions. Thermal fluctuations are taken into account in the formalism by stochastic driving fields introduced in accordance with the principles of statistical mechanics. To study the rheological responses of materials subject to shear, generalized periodic boundary conditions are developed where periodic images are shifted relative to the unit cell to induce shear. Stochastic numerical methods are developed for the formalism. As a demonstration of the methods, results are presented for the shear responses of a polymeric fluid, lipid vesicle fluid, and a gel-like material.
According to extensive experimental findings, the Ginzburg temperature $t_{G}$ for ionic fluids differs substantially from that of nonionic fluids [Schroer W., Weig{a}rtner H. 2004 {it Pure Appl. Chem.} {bf 76} 19]. A theoretical investigation of this outcome is proposed here by a mean field analysis of the interplay of short and long range interactions on the value of $t_{G}$. We consider a quite general continuous charge-asymmetric model made of charged hard spheres with additional short-range interactions (without electrostatic interactions the model belongs to the same universality class as the 3D Ising model). The effective Landau-Ginzburg Hamiltonian of the full system near its gas-liquid critical point is derived from which the Ginzburg temperature is calculated as a function of the ionicity. The results obtained in this way for $t_{G}$ are in good qualitative and sufficient quantitative agreement with available experimental data.
We describe a high-resolution, high-bandwidth technique for determining the local viscoelasticity of soft materials such as polymer gels. Loss and storage shear moduli are determined from the power spectra of thermal fluctuations of embedded micron-sized probe particles, observed with an interferometric microscope. This provides a passive, small-amplitude measurement of rheological properties over a much broader frequency range than previously accessible to microrheology. We study both F-actin biopolymer solutions and polyacrylamide (PAAm) gels, as model semiflexible and flexible systems, respectively. We observe high-frequency omega^(3/4) scaling of the shear modulus in F-actin solutions, in contrast to omega^(1/2) scaling for PAAm.
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