Search results for "THERMODYNAMICS"

Ion conduction in the KcsA potassium channel analyzed with a minimal kinetic model.

2004

We use a model by Nelson to study the current-voltage and conductance-concentration curves of bacterial potassium channel KcsA without assuming rapid ion translocation. Ion association to the channel filter is rate controlling at low concentrations, but dissociation and transport in the filter can limit conduction at high concentration for ions other than ${\mathrm{K}}^{+}$. The absolute values of the effective rate constants are tentative but the relative changes in these constants needed to qualitatively explain the experiments should be of significance.

Morphology, reorganization and stability of mesomorphic nanocrystals in isotactic polypropylene

2006

Abstract The morphology and thermodynamic stability of crystals of isotactic polypropylene (iPP) were analyzed as a function of the path of crystallization by atomic force microscopy (AFM) and differential scanning calorimetry (DSC). Samples were melt-crystallized at different rates of cooling using a “controlled rapid cooling technique”, and subsequently annealed at elevated temperature. Mesomorphic equi-axed domains with a size less than 20 nm were obtained by fast cooling from the melt at a rate larger about 100 K s−1. These domains stabilize on heating by growing in chain direction and cross-chain direction, to reach a maximum size of about 40–50 nm at a temperature of 433 K, with the q…

Investigation of eutectic transformation of Zn−Al alloy by DTA

1995

The paper discusses the investigation of crystallization of metals and alloys by differential thermal analysis (DTA). It was assumed that this method allows determination of the mechanism and kinetics of volumetric crystallization underiso conditions (e.g. anisothermal) on the basis of the parameters of the equation expressing an integral form of the DTA curve. From DTA, a course of eutectic transformation was determined for a technical Zn−Al alloy containing 4wt% Al. Investigations were carried out under continuous cooling at various rates and the kinetics parameters were determined with the KEKAM equation:-ln(1-x)=kln

Elastic Properties and Line Tension of Self-Assembled Bilayer Membranes

2013

The elastic properties of a self-assembled bilayer membrane are studied using the self-consistent field theory, applied to a model system composed of flexible amphiphilic chains dissolved in hydrophilic polymeric solvents. Examining the free energy of bilayer membranes with different geometries allows us to calculate their bending modulus, Gaussian modulus, two fourth-order membrane moduli, and the line tension. The dependence of these parameters on the microscopic characteristics of the amphiphilic chain, characterized by the volume fraction of the hydrophilic component, is systematically studied. The theoretical predictions are compared with the results from a simple monolayer model, whic…

2018

Abstract When electrochemical techniques are used to probe the surface of corroding magnesium with the aim of obtaining quantitative information on the corrosion process, two peculiarities are generally observed: i) with anodic polarization, the rate of hydrogen evolution increases instead of decreasing and ii) during electrochemical impedance spectroscopy measurements, an inductive contribution is often observed at the low-frequency end of the spectra. The presence of these two phenomena clearly has an impact on the methodology that should be applied to correctly estimate corrosion rates from electrochemical data. The aim of this work is to provide a general mathematical description of the…

Magnetic Domain Structure and Intrinsic Magnetic Material Parameters of Ternary Intermetallic RMn2Ge2 Compounds (R ? La, Ce, Pr and Nd)

2000

Applying a powder pattern method the magnetic domain structures of polycrystalline intermetallic RMn2Ge2 (where R ≡ La, Ce, Pr, Nd) compounds were studied. The domain structures observed are typical for uniaxial materials. The domain wall energy density γ was determined from analysis of domain structure patterns, using different models of the domain structure. The obtained values are used to determine the intrinsic magnetic material parameters: domain wall width δB, critical diameters of single domain particles Dc and exchange constants A.

Cooperativity Scaling and Free Volume in Plasticized Polylactide

2019

The authors would like to thank the region Haute Normandie for their financial support and the acquisition of the Broadband Dielectric Spectrometer. R.G. acknowledges U.S. National Science Foundation (Grant no. DMR-1725188) for the acquisition of PAL spectrometer. The experimental evidence of the increase of activation energy associated with the super Arrhenius behavior governing amorphous polylactide by free volume variations has been obtained through a combination of calorimetric, dielectric, and positron annihilation lifetime measurements. The amount of free volume in polylactide was controlled by the amount of acetyltributylcitrate plasticizer in the composition. Plasticization is shown…

Chain Conformations and Phase Behavior in Confined Polymer Blends

2007

We investigate the chain conformations and phase separation in binary polymer blends. Using large scale semi-grandcanonical Monte Carlo simulations and finite size scaling, we investigate the molecular extension and the intermolecular paircorrelation function in thin films with hard, non-preferentially adsorbing surfaces. The interplay between chain conformations, demixing and the validity of mean field theory is investigated for a large variation of chain lengths 16 ≤ N ≤ 512. Three regimes of film thickness D can be distinguished: (i) For film thicknesses much larger than the unperturbed chain extension R e, bulk behavior is observed, i.e., the critical temperature of demixing T c increas…

Spinodal Decomposition in Binary Polymer Blends: Monte Carlo Simulations and Dynamic Mean Field Theory

2001

Using large scale computer simulations we have investigated the interplay between single chain dynamics and the kinetics of phase separation in a symmetric binary polymer blend. In the framework of a coarse grained lattice model — the bond fluctuation model on a three dimensional lattice — we monitor the growth of concentration fluctuations after a quench from the one phase region into the miscibility gap. Chains of 64 effective segments are simulated in a cell of linear dimension L = 160, i.e., each simulation box contains 256 000 particles. The growth rate of composition fluctuations is averaged over 64 realizations of the temperature quench.

Behaviour of tritium in breeding materials

2005

Abstract The tritium release from ceramic materials of the HCPB under real DEMO operating conditions will depend not only on temperature and neutron flux but also on an intense magnetic field (MF) of 7–9 T. The delay in the tritium release induced by the MF is proportional to the grain size of the ceramics, the squared MF intensity and the abundance ratio of charged tritium forms (T + , T − ) in the grain volume of the ceramics. The effect of MFs of different intensity on the tritium release from the Li 4 SiO 4 pebbles irradiated in the EXOTIC-8 experiment (neutron fluence 2.4 × 10 25  n m −2 , irradiation temperature up to 700 K) was investigated in this study. As a result of the irradiati…