Search results for "small-angle"

Study on the initial stages of water corrosion of fluorozirconate glasses

2004

Abstract The surface corrosion process associated with the hydrolysis of fluorozirconate glass, ZBLAN (53ZrF 4 , 20BaF 2 , 20NaF, 4LaF 2 , 3AlF 3 ) was investigated using X-ray photoelectron spectroscopy (XPS), grazing-incidence small angle X-ray scattering (GISAXS), X-ray reflectivity (XRR) and scanning electron microscopy (SEM). After a short exposure period (25 min) of the glass surface to deionized water the XPS data indicate an increase of the oxygen content accompanied by a decrease of fluorine concentration. The analysis of the chemical bonding structure identified the predominant surface reaction products as zirconium hydroxyfluoride and oxyfluoride species. The second most abundant…

Thermodiffusion anisotropy under a magnetic field in ionic liquid-based ferrofluids

2021

International audience; Ferrofluids based on maghemite nanoparticles (NPs), typically 10 nm in diameter, are dispersed in an ionic liquid (1-ethyl 3-methylimidazolium bistriflimide - EMIM-TFSI). The average interparticle interaction is found to be repulsive by small angle scattering of X-rays and of neutrons, with a second virial coefficient A2 = 7.3. A moderately concentrated sample at Φ = 5.95 vol% is probed by forced Rayleigh scattering under an applied magnetic field (up to H = 100 kA m-1) from room temperature up to T = 460 K. Irrespective of the values of H and T, the NPs in this study are always found to migrate towards the cold region. The in-field anisotropy of the mass diffusion c…

Conformational dynamics of full-length inducible human Hsp70 derived from microsecond molecular dynamics simulations in explicit solvent

2013

Human 70 kDa heat shock protein (hHsp70) is an ATP-dependent chaperone and is currently an important target for developing new drugs in cancer therapy. Knowledge of the conformations of hHsp70 is central to understand the interactions between its nucleotide-binding domain (NBD) and substrate-binding domain (SBD) and is a prerequisite to design inhibitors. The conformations of ADP-bound (or nucleotide-free) hHsp70 and ATP-bound hHsp70 was investigated by using unbiased all-atom molecular dynamics (MD) simulations of homology models of hHsp70 in explicit solvent on a timescale of .5 and 2.7 μs, respectively. The conformational heterogeneity of hHsp70 was analyzed by computing effective free-e…

1992

Zwitterionic polymers [CH 2 CR(COOR')] n (R= H, Me; R'= (CH 2 ) 11 + NMe 2 (CH 2 ) 3 SO 3 - , (CH 2 ) 2 + N(CH 3 )([CH 2 ] 3 SO 3 - )C 10 H 21 ) are studied by X-ray scattering. The structural order both in the short-range and long-range scale is investigated. The influence of the polymer backbone, of different locations of the ionic groups in isomeric polymers, of bound water and of added inorganic salts on the bulk structures is studied, and the observed rearrangements are analysed

Small angle scattering study of poly(methylmethacrylate)-blockpoly(ethylene oxide) block co-polymer in aqueous solution

2005

A combined Small Angle X ray (SAXS) and Neutron (SANS) Scattering study of aqueous solutions of a symmetric block copolymer consisting of poly(methyl methacrylate) (PMMA) and poly(ethylene oxide) (PEO) moieties is presented. The polymer forms slightly polydisperse spherical micelles in a wide range of concentration (0.03 – 6.7 w/V) and temperature (20°C ≤ T ≤ 65°C). A good description of the SANS data is obtained using a polydisperse core-shell model with a structure factor for a modified hard sphere potential. By increasing the concentration at constant T we observed a decrease of the aggregation number and an increase of solvation of PEO groups in the shell, opposite to what happens by in…

Conformational analysis of α,β-poly(N-hydroxyethyl)-dl-aspartamide (PHEA) and α,β-polyasparthydrazide (PAHy) polymers in aqueous solution

1998

Abstract α,β-Poly(N-hydroxyethyl)- dl -aspartamide (PHEA) and α,β-polyasparthydrazide (PAHy) are synthetic polymers previously studied for biomedical applications. We report here the results of a small-angle X-ray scattering analysis carried out on these two macromolecules in aqueous solution. The data obtained indicate that the two polymers assume remarkably different conformations in aqueous solution, although the backbone is supposed to be the same for the two chains. PHEA can be represented by a random coil conformation, whereas PAHy can be described in terms of an elliptical cylinder characterized by an almost planar structural arrangement with the backbone refolded on itself in a fash…

Buildup of ultrathin multilayer films by a self-assembly process: III. Consecutively alternating adsorption of anionic and cationic polyelectrolytes …

1992

A solid substrate with a positively charged planar surface is immersed in a solution containing an anionic polyelectrolyte and a monolayer of the polyanion is adsorbed. Since the adsorption is carried out at relatively high concentrations of polyelectrolyte, a large number of ionic residues remain exposed to the interface with the solution and thus the surface charge is effectively reversed. After rinsing in pure water the substrate is immersed in the solution containing a cationic polyelectrolyte. Again a monolayer is adsorbed but now the original surface charge is restored. By repeating both steps in a cyclic fashion, alternating multilayer assemblies of both polymers are obtained. The bu…

Morphology and local organization of water-containing (1R,2S)-Dodecyl(2-hydroxy-1-methyl-2-phenylethyl)dimethylammonium bromide reverse micelles disp…

2014

The structure of (1R,2S)-dodecyl(2-hydroxy-1-methyl-2-phenylethyl)dimethylammonium bromide (DMEB) reverse micelles, at various water-to-surfactant molar ratio (R-w, R-w = [water]/[DMEB]) and DMEB concentrations, has been investigated by small angle X-ray scattering (SAXS) and extended X-ray absorption fine structure spectroscopy (EXAFS). SAXS data of dry reverse micelles are consistent with a model of spherical hydrophilic core surrounded by DMEB alkyl chains whose polydispersity decreases significantly with surfactant concentration. By adding water, a sphere to cylinder transition occurs leading to a one-dimensional growth of reverse micellar cores with R-w and surfactant concentration. Th…

Neutron Scattering of Poly(ethylene terephthalate)

1986

Through the use of deuterium labeling, small angle neutron scattering (SANS) has been found to be an extremely effective tool for elucidating the structure of polymer molecules in the condensed matter state. In this study, the molecular morphology of poly(ethylene terephthalate) (PET) has been determined under four different conditions: (1) in the glassy state, (2) in the semicrystalline state, (3) after cold-drawing, and (4) after undergoing partial transesterification.

Modelling small angle neutron scattering data from polymers in supercritical fluids

2000

In this paper we report a SANS investigation of micelle formation by fluorocarbon-hydrocarbon block copolymers in supercritical CO2(scCO2) at 313K. A sharp unimer-micelle transition is obtained due to the tuning of the solvating ability of scCO2 by profiling pressure. At high pressure the copolymer is in a monomeric state with a random coil structure. By lowering the pressure aggregates are formed with the hydrocarbon segments forming the core and the fluorocarbon segments forming the corona of spherical aggregates. This aggregate-unimer transition is driven by the gradual penetration of CO2 molecules toward the core of the aggregate and is critically related to the density of the solvent, …