Search results for "Fourier transform"
showing 10 items of 1138 documents
Growth of a colloidal crystallite of hard spheres
1997
Abstract We examine the growth of a single nucleus of hard spheres in a super-saturated colloidal dispersion of hard spheres. A model developed by Bruce Ackerson and Klaus Schatzel based on a Wilson-Frenkel growth law is used. Our emphasis is on the profile of the radial density distribution around the growing (but still spherically symmetric) grain and its Fourier transform, the grain's form factor, which can be observed under small scattering angles in a dynamic light scattering experiment. Depending on the value of the supersaturation we can identify two limiting cases of different growth exponents and density profiles: one is the Frank theory of diffusion-limited growth and the other is…
From a fixed bed Ag–alumina catalyst to a modified reactor design: how to enhance the crucial heterogeneous–homogeneous reactions in HC-SCR
2004
Abstract A highly active Ag/alumina catalyst for continuous reduction of NO to nitrogen with n-octane under lean conditions was prepared. It was observed in the reactor set-up experiments for optimization of the converter, that surface generated gas phase species are crucial for obtaining high conversion. EPR and matrix isolated FTIR studies at low temperature (10–18 K) were performed for identification of the radicals. Experimental data, observed at steady state conditions in the temperature range 300–550 °C, was used to produce an artificial neural network model of the catalytic converter with four catalyst beds.
Rotational Isomerism in Acetic Acid: The First Experimental Observation of the High-Energy Conformer
2003
The high-energy conformer of acetic acid (cis-AA) is produced in an Ar matrix by vibrational excitation of the OH stretching overtone of the ground conformational state (trans-AA). IR-absorption spectroscopy provides a clear identification of the reaction product. cis-AA converts back to trans-AA in a time scale of minutes at 8 K by tunneling. http://dx.doi.org/10.1021/ja038341a
Synthesis, structure, and nuclease properties of several binary and ternary complexes of copper(II) with norfloxacin and 1,10 phenantroline
2007
Three new binary Cu(II) complexes of norfloxacin have been synthesized and characterized. We also report the synthesis, characterization and X-ray crystallographic structures of a new binary compound, [Cu(HNor)(2)]Cl(2).2H(2)O (2) and two new ternary complexes norfloxacin-copper(II)-phen, [Cu(Nor)(phen)(H(2)O)](NO(3)).3H(2)O (4), and [Cu(HNor)(phen)(NO(3))](NO(3)).3H(2)O (5). The structure of 2 consists of two crystallographically independent cationic monomeric units of [Cu(HNor)(2)](2+), chloride anions, and uncoordinated water molecules. The Cu(II) ion is placed at a center of symmetry and is coordinated to two norfloxacin ligands which are related through the inversion center. The struct…
Syntheses, spectroscopic and structural properties of phenoxysilyl compounds : X-ray structures, FT-IR and DFT calculations
2013
Abstract The reaction of silicon disulfide with alkylphenols yields tetraphenoxysilane, cyclodisilthiane and silanethiol. The outcome of the reaction depends on the presence of the steric hindrance in the ortho position on the reacting phenol. New products of the reaction of silicon disulfide with phenols are characterized by FT-IR, NMR, X-ray diffraction and DFT calculations. The intramolecular interactions in the compounds are mainly XH---π (X = C, S) whereas the intermolecular interactions are either very weak CH---π/CH---O contacts found in aryloxysilane or electrostatic dipole–dipole attraction in cyclodisilthiane and silanethiol. The S–H---π interactions in the obtained silanethiol ar…
Study of Confined 5-Aza[5]helicene in Ytterbium(III) Bis(2-ethylhexyl) Sulfosuccinate Reversed Micelles
2007
Some relevant physicochemical properties of 5-aza[5]helicene (H5) in solutions of ytterbium bis(2-ethylhexyl) sulfosuccinate (Yb(DEHSS)3) reversed micelles have been investigated by UV-vis-NIR, photoluminescence, and FT-IR techniques with the aim of emphasizing the role played by specific Yb(III)/H5 interactions and confinement effects as driving forces of its binding to reversed micelles, preferential solubilization site, and local photophysical properties. It has been found that the binding strength of 5-aza[5]helicene to reversed micelles, triggered by steric and orientational constrains as well as the water content, is mainly regulated by its interaction with the Yb(III) counterion. Mor…
In-Situ DRIFT Spectroscopic Investigation on the Chemical Evolution of Zinc Phosphate Acid−Base Cement
2000
Diffuse reflectance infrared Fourier transform (DRIFT) spectroscopy has been used to follow the chemical evolution of zinc phosphate acid−base cement (ZPC), which has been prepared from unmodified, as well as from aluminum- and zinc-modified orthophosphoric acid. For the first time, amorphous dizinc cyclotetraphosphate octahydrate, Zn2P4O12·8H2O, although hydrolytically instable, has been observed as precursor phase prior to crystallization of α-hopeite, α-Zn3(PO4)2·4H2O, in both systems. Within minutes from onset of mixing the infrared spectrum of unmodified ZPC is dominated by the characteristic vibrations of α-hopeite, due to matrix crystallization. Setting of modified ZPC is strongly af…
Reactive Surface Coatings Based on Polysilsesquioxanes: Controlled Functionalization for Specific Protein Immobilization
2009
The key designing in reliable biosensors is the preparation of thin films in which biomolecular functions may be immobilized and addressed in a controlled and reproducible manner. This requires the controlled preparation of specific binding sites on planar surfaces. Poly(methylsilsesquioxane)-poly(pentafluorophenyl acrylates) (PMSSQ-PFPA) are promising materials to produce stable and adherent thin reactive coatings on various substrates. Those reactive surface coatings could be applied onto various materials, for example, gold, polycarbonate (PC), poly(tetrafluoroethylene) (PTFE), and glass. By dipping those substrates in a solution of a desired amine, specific binding sites for protein ads…
Self-assembled aggregates of amphiphilic perylene diimide-based semiconductor molecules: effect of morphology on conductivity.
2011
Abstract Two amphiphilic perylenetetracarboxylic diimide derivatives modified with different side chains at imide nitrogen, N- n -hexyl-N′-(2-hydroxyethyl)-1,7-di(4′-t-butyl)phenoxy-perylene-3,4:9,10-tetracarboxylic diimide ( PDI 1 ) and N,N′-di(2-hydroxyethyl)-1,7-di(4′-t-butyl)phenoxy-perylene-3,4:9,10-tetracarboxylic diimide ( PDI 2 ), were fabricated into organic nanostructures via solution-phase self-assembly. Their self-assembling properties in methanol and n -hexane have been comparatively studied by electronic absorption, fluorescence, and Fourier transform infrared spectroscopy (FT-IR). The morphologies and structures of the self-assemblies were examined by scanning electronic micr…
An infrared spectroscopic tool for process monitoring: sugar contents during the production of a depilatory formulation.
2012
Abstract A fast, reliable and economical methodology has been developed to control the production process of sugar-based depilatories. The method is based on the use of attenuated total reflectance—Fourier transform infrared (ATR-FTIR) spectroscopy in combination with multivariate data analysis. A very simple sample preparation process involving the dissolution of samples in water was applied. Employing a multivariate calibration model established from data of 15 well characterized samples, prediction errors equal or below 3.04 mg mL−1 for the quantitative determination of fructose, glucose, sucrose, maltose and maltotriose were obtained. Results found in this preliminary study indicate a g…