Search results for "sorption"
showing 10 items of 4623 documents
On the difficulty of assessing the specific surface area of magnesium stearate
2001
Abstract The water content of as-received commercial magnesium stearate batches from animal and vegetable sources have been modified by ageing in humid air at room temperature or by vacuum treatment. The complete adsorption–desorption isotherms of nitrogen and krypton vapours by samples of these as received and modified materials have been measured at liquid nitrogen temperature after standardised vacuum degassing. They are greatly affected by the initial water content of the material. In particular: (a) the BET surface area values computed from the adsorption branch vary widely and is increasing with increasing water content; (b) anomalous hysteresis of varying amplitude is observed in all…
Interplay between local structure, vibrational and electronic properties on CuO under pressure
2020
The electronic and local structural properties of CuO under pressure have been investigated by means of X-ray absorption spectroscopy (XAS) at Cu K edge and ab initio calculations, up to 17 GPa. The crystal structure of CuO consists of Cu motifs within CuO4 square planar units and two elongated apical Cu-O bonds. The CuO4 square planar units are stable in the studied pressure range, with Cu-O distances that are approximately constant up to 5 GPa, and then decrease slightly up to 17 GPa. In contrast, the elongated Cu-O apical distances decrease continuously with pressure in the studied range. An anomalous increase of the mean square relative displacement (EXAFS Debye-Waller, s2) of the elong…
High-spin → low-spin relaxation in the two-step spincrossover compound [Fe(pic)3]Cl2EtOH (pic = 2-picolylamine)
1998
Abstract The spin-crossover compound [Fe(pic) 3 ]Cl 2 EtOH (pic = 2-picolylamine) shows an unusual two-step spin transition. This is thought to be caused by specific nearest-neighbour interactions and short-range correlations and requires a theoretical treatment of the elastic interactions between the spin-changing molecules beyond the mean-field approximation. Such short-range correlations also influence the high-spin → low-spin relaxation following the light-induced population of the high-spin state at cryogenic temperatures, leading to characteristic deviations from the predictions of a mean-field treatment. These deviations are directly observable by comparison of the full and unperturb…
Uptake of actinides by calcium silicate hydrate (C-S-H) phases
2018
Abstract The sorption of actinides (Th, U – Am) was studied in dependence of the solid-to-liquid (S/L) ratio (0.5–20.0 g/L) and the calcium-to-silicon (C:S) ratio. The C:S ratio was varied between 1.80 and 0.70 to simulate the changing composition of the C-S-H phases during cement degradation from high to low C:S ratios. The decrease of the calcium content in the C-S-H phases by time is accompanied by a decrease in pH in the corresponding suspensions from 12.6 to 10.2. X-ray photoelectron spectroscopy (XPS) of the C-S-H phases showed an increasing depletion of Ca on the surface with increasing C:S ratio in comparison to the composition of the solid phase as a whole. The sorption experiments…
One-pot synthesis of graphene quantum dots and simultaneous nanostructured self-assembly via a novel microwave-assisted method: impact on triazine re…
2018
One-step methods for fabricating green materials endowed with diverse functions is a challenge to be overcome in terms of reducing environmental risk and cost. We report a fast and easy synthesis of multifunctional materials composed of only fluorescent dots with structural flexibility and high sorption capability. The synthesis consists of a one-pot microwave-assisted reaction for the simultaneous formation of graphene quantum dots (GQDs) from organic precursors and their spontaneous self-assembly forming porous architectures. The GQD-assemblies are robust and no signs of degradation were observed with most organic solvents. The ensuing GQDs and their porous solids were fully characterized…
Decomposition Process of Carboxylate MOF HKUST-1 Unveiled at the Atomic Scale Level
2016
HKUST-1 is a metal-organic framework (MOF) which plays a significant role both in applicative and basic fields of research, thanks to its outstanding properties of adsorption and catalysis but also because it is a reference material for the study of many general properties of MOFs. Its metallic group comprises a pair of Cu2+ ions chelated by four carboxylate bridges, forming a structure known as paddle-wheel unit, which is the heart of the material. However, previous studies have well established that the paddle-wheel is incline to hydrolysis. In fact, the prolonged exposure of the material to moisture promotes the hydrolysis of Cu-O bonds in the paddle-wheels, so breaking the crystalline n…
Validation of a novel automatic deposition of bacteria and yeasts on MALDI target for MALDI-TOF MS-based identification using MALDI Colonyst robot
2017
Matrix-assisted laser desorption/ionization time-of-flight mass spectrometry (MALDI-TOF MS) -based identification of bacteria and fungi significantly changed the diagnostic process in clinical microbiology. We describe here a novel technique for bacterial and yeast deposition on MALDI target using an automated workflow resulting in an increase of the microbes' score of MALDI identification. We also provide a comparison of four different sample preparation methods. In the first step of the study, 100 Gram-negative bacteria, 100 Gram-positive bacteria, 20 anaerobic bacteria and 20 yeasts were spotted on the MALDI target using manual deposition, semi-extraction, wet deposition onto 70% formic …
Immobilisation of humic substances
2002
Attempts were made to immobilise humic substances (HS) by grafting them onto different carriers (styrene-divinylbenzene copolymers, cellulose and silica) as well as by their crosslinking with formaldehyde. Reaction with Merrifield resin was used for the immobilisation of HS, coupling by means of water-soluble carbodiimides to carriers containing amino-groups. Crosslinking of HS with formaldehyde (also in presence of other substances able to enter polycondensation reactions with formaldehyde) was shown to be an efficient method for their insolubilisation. Properties of the obtained immobilised HS were studied, including their potential use as sorbents for several metal ions and organic subst…
Electronic and optical properties of pristine, N- and S-doped water-covered TiO2 nanotube surfaces
2019
For rational design and improvement of electronic and optical properties of water-splitting photocatalysts, the ability to control the band edge positions relative to the water redox potentials and the photoresponse as a function of environmental conditions is essential. We combine ab initio molecular dynamics simulations with ab initio many-body theoretical calculations to predict the bandgap and band edge energies, as well as the absorption spectrum of pristine and N- and S-doped TiO2 nanotubes using the DFT+U and G0W0 approaches. Both levels of theory show similar trends, and N+S-codoping appears to be the optimal system for photocatalytic water splitting both in dry and humid conditions…
Microporous volume and external surface of Y zeolites accessible to p-xylene and m-xylene
1997
Abstract Isothermal adsorption of p-xylene and m-xylene on NaY, KY and BaY zeolites was studied by thermogravimetry at 25°C. Adsorption isotherms showed type H4 hysteresis associated with a xylenes adsorption process activated by the pressure. Experimental data were analysed with the t-method to distinguish the amounts of xylene adsorbed in the α-cages and on the external surface of crystallites. Results were compared with those previously achieved by calorimetry. Whatever may be the isomer and the Y zeolite, the adsorption capacity of α-cages at 25 °C is equal to 3.5 molecule α−1. At saturation, the amount of xylenes adsorbed on the external surface represents 13% of the total amount adsor…