Search results for "Transform"
showing 10 items of 3975 documents
Heterogeneous Interactions between Gas-Phase Pyruvic Acid and Hydroxylated Silica Surfaces: A Combined Experimental and Theoretical Study
2019
The adsorption of gas-phase pyruvic acid (CH3COCOOH) on hydroxylated silica particles has been investigated at 296 K using transmission Fourier transform infrared (FTIR) spectroscopy and theoretical simulations. Under dry conditions (<1% relative humidity, RH), both the trans-cis (Tc) and trans-trans (Tt) pyruvic acid conformers are observed on the surface as well as the (hydrogen bonded) pyruvic acid dimer. The detailed surface interactions were further understood through ab initio molecular dynamics simulations. Under higher relative humidity conditions (above 10% RH), adsorbed water competes for surface adsorption sites. Adsorbed water is also observed to change the relative populations …
Matrix isolation and quantum chemical studies on the H2O2–SO2complex
2004
Complexation and photochemical reactions of hydrogen peroxide and sulfur dioxide have been studied in solid Ar, Kr and Xe. Complexes between H2O2 and SO2 are characterized using Fourier transform infrared spectroscopy and ab initio calculations. In solid Ar, the H2O2–SO2 complex absorptions are found at wavenumbers of 3572.8, 3518.7, 3511.2, 3504.3, 1340.3, 1280.2 and 1149.9 cm−1. In Kr and Xe matrices, the bonded OH stretching frequencies deviate from the values in Ar, and we propose that the matrix surrounding influences the structure of the H2O2–SO2 complex. UV photolysis of the H2O2–SO2 was also studied in solid Ar, Kr and Xe. This photolysis produces mainly a complex between sulfur tri…
Equipping metallo-supramolecular macrocycles with functional groups: Assemblies of pyridine-substituted urea ligands
2012
A series of di-(m-pyridyl)-urea ligands were prepared and characterized with respect to their conformations by NOESY experiments and crystallography. Methyl substitution in different positions of the pyridine rings provides control over the position of the pyridine N atoms relative to the urea carbonyl group. The ligands were used to self-assemble metallo-supramolecular M(2)L(2) and M(3)L(3) macrocycles which are generated in a finely balanced equilibrium in DMSO and DMF according to DOSY NMR experiments and ESI FTICR mass spectrometry. Again, crystallography was used to characterize the assemblies. Methyl substitution in positions next to the pyridine nitrogen prevents coordination, while …
Corrosion inhibition performance of a structurally well-defined 1,2,3-triazole derivative on mild steel-hydrochloric acid interface
2021
Abstract In the present work, a new 1,4-disubstituted-1,2,3-triazole product, named 4-[1-(4-methoxy-phenyl)-1H-[1,2,3]triazol-4-ylmethyl]-morpholine (MPTM) was successfully synthesized under click chemistry regime. The structure of the new compound that has a rigid triazole moiety and a flexible morpholine ligand has been characterized using 1H NMR, 13C NMR, HRMS, and FTIR spectroscopy. Its inhibition performance for mild steel in acidic medium 1 M HCl has been studied by utilizing a combination of experimental, spectroscopic and computational methods. The electrochemical characterization was carried out by a gravimetric study, electrochemical impedance spectroscopy (EIS), and potentiodynam…
Optimized Class-Separability in Hyperspectral Images
2016
International audience; Image visualization techniques are mostly based on three bands as RGB color composite channels for human eye to characterize the scene. This, however, is not effective in case of hyper-spectral images (HSI) because they contain dozens of informative spectral bands. To eliminate redundancy of spectral information among these bands, dimensionality reduction (DR) is applied while at the same trying to retain maximum information. In this paper, we propose a new method of information-preserved hyper-spectral satellite image visualization that is based on fusion of unsupervised band selection techniques and color matching function (CMF) stretching. The results show consist…
Efficient remote sensing image classification with Gaussian processes and Fourier features
2017
This paper presents an efficient methodology for approximating kernel functions in Gaussian process classification (GPC). Two models are introduced. We first include the standard random Fourier features (RFF) approximation into GPC, which largely improves the computational efficiency and permits large scale remote sensing data classification. In addition, we develop a novel approach which avoids randomly sampling a number of Fourier frequencies, and alternatively learns the optimal ones using a variational Bayes approach. The performance of the proposed methods is illustrated in complex problems of cloud detection from multispectral imagery.
A geological field trip to the Côte d'Ivoire-Ghana transform margin
1998
Abstract During the Equanaute survey (June 1992), fourteen submersible dives were performed between 4950 and 2250 m water depths across the southern slope of the Cote d'Ivoire-Ghana Marginal Ridge (CIGMR), in the eastern Equatorial Atlantic. The CIGMR, a high-standing topographic marginal ridge along the Cote d'Ivoire-Ghana transform margin, is believed to result from a complex structural evolution due to the specific wrench-related rifting between Western Equatorial Africa and Northeastern Brazil, in Early Cretaceous times. In this paper we report and discuss geological observations made during dives, and sample analyses to resolve the lithology, paleoenvironmental conditions, age and orig…
Spectral alignment of multi-temporal cross-sensor images with automated kernel canonical correlation analysis
2015
In this paper we present an approach to perform relative spectral alignment between optical cross-sensor acquisitions. The proposed method aims at projecting the images from two different and possibly disjoint input spaces into a common latent space, in which standard change detection algorithms can be applied. The system relies on the regularized kernel canonical correlation analysis transformation (kCCA), which can accommodate nonlinear dependencies between pixels by means of kernel functions. To learn the projections, the method employs a subset of samples belonging to the unchanged areas or to uninteresting radiometric differences. Since the availability of ground truth information to p…
GIGJ: a crustal gravity model of the Guangdong Province for predicting the geoneutrino signal at the JUNO experiment
2019
Gravimetric methods are expected to play a decisive role in geophysical modeling of the regional crustal structure applied to geoneutrino studies. GIGJ (GOCE Inversion for Geoneutrinos at JUNO) is a 3D numerical model constituted by ~46 x 10$^{3}$ voxels of 50 x 50 x 0.1 km, built by inverting gravimetric data over the 6{\deg} x 4{\deg} area centered at the Jiangmen Underground Neutrino Observatory (JUNO) experiment, currently under construction in the Guangdong Province (China). The a-priori modeling is based on the adoption of deep seismic sounding profiles, receiver functions, teleseismic P-wave velocity models and Moho depth maps, according to their own accuracy and spatial resolution. …
High-resolution spectroscopy and analysis of the nu3/2nu4 dyad of CF4
2011
International audience; CF4 is a strong greenhouse gas of both anthropogenic and natural origin [D.R. Worton et al., Environ. Sci. Technol. 41, 2184 (2007)]. However, high-resolution infrared spectroscopy of this molecule has received only a limited interest up to now. Until very recently, the public databases only contained cross-sections for this species, but no detailed line list. We reinvestigate here the strongly absorbing ν3 region around 7.8 μm. New Fourier transform infrared (FTIR) spectra up to a maximal resolution of 0.0025 cm−1 have been recorded: (i) room-temperature spectra in a static cell and (ii) a supersonic expansion jet spectrum at a 23 K estimated temperature. Following …