Search results for "Metals"
showing 10 items of 2013 documents
Unprecedented use of silver(I) N-heterocyclic carbene complexes for the catalytic preparation of 1,2-bis(boronate) esters.
2005
Catalytic diboration of internal and terminal alkenes with Ag(I) N-heterocyclic carbene complexes leads to 1,2-bis(boronate) esters as single intermediates, that can be oxidised towards the corresponding diols. Sanau Torrecilla, Mercedes, Mercedes.Sanau@uv.es
Urinary metals and metal mixtures and oxidative stress biomarkers in an adult population from Spain: The Hortega Study
2019
Introduction: Few studies have investigated the role of exposure to metals and metal mixtures on oxidative stress in the general population. Objectives: We evaluated the cross-sectional association of urinary metal and metal mixtures with urinary oxidative stress biomarkers, including oxidized to reduced glutathione ratio (GSSG/GSH), malondialdehyde (MDA), and 8-oxo-7,8-dihydroguanine(8-oxo-dG), in a representative sample of a general population from Spain (Hortega Study). Methods: Urine antimony (Sb), barium (Ba), cadmium (Cd), chromium (Cr), cobalt (Co), copper (Cu), molybdenum (Mo), vanadium (V) and zinc (Zn) were measured by ICPMS in 1440 Hortega Study participants. Results: The geometr…
Metal-Free and User-Friendly Regioselective Hydroxyfluorination of Olefins
2018
A simple, user-friendly, metal-free protocol for the regioselective anti-Markovnikov hydrofluorination of olefins using readily available and inexpensive reagents has been developed. This new approach displays a broader scope than previously reported methodologies and has been applied to the late-stage fluorination of a complex molecule, giving rise to a fluorosteroid derivative. The stereochemistry of the process has also been studied in some detail.
Hydroponic Lettuce Cultivation Using Organic Nutrient Solution from Aerobic Digested Aquacultural Sludge
2021
The aim of this study was to demonstrate how aquacultural sludge can be processed and utilized as an organic nutrient solution (ONS) for hydroponic lettuce production. By using a previous developed method, approximately 80% of the processed sludge was reclaimed as a clear, nutrient-rich solution. The performance of the recovered nutrient solution on lettuce growth was assessed in a nutrient film hydroponic system. The results were compared to the results obtained using a conventional nutrient solution (CNS). Yield, fresh weight, water consumption, and nutrient and heavy metal content in leaf tissue were measured. In spite of a 16% lower average fresh weight obtained in ONS compared to the w…
A solar photothermo-catalytic combined process for the VOCs combustion and the subsequent CO2 valorization using noble metal-free catalysts
2023
We here investigated a solar photothermo-catalytic combined process where the toluene (as volatile organic compound model) was first oxidized to CO2 which was subsequently converted into solar fuels in a second reactor. For this aim two noble-metal free catalytic systems were used, namely MnOx-ZrO2, which gave the best results for the toluene removal, and brookite TiO2-CeO2 mixed oxides which were the most efficient in the subsequent CO2 conversion. This latter reaction was further improved by the addition of small amounts of copper-based materials on brookite-ceria, acting as co-catalysts. The key point for both the examined reactions was the synergism between the thermocatalytic and the p…
X-ray powder diffraction study of the stability of solid solutions in LaO(Cl1−xBrx)
1997
Abstract The formation of solid solutions in the LaO(Cl 1− x Br x ) series was studied by X-ray powder diffraction (XPD), Rietveld profile refinement and bond valence calculations. The LaO(Cl 1− x Br x ) (0 ≤ x ≤ 1, step 0.2, and x = 0.5) powder samples were prepared by the solid state reaction between La 2 O 3 and a mixture of ammonium chloride and bromide. The X-ray powder diffraction patterns were collected at room temperature between 5 and 125° in 2Θ using Cu K α 1 radiation (λ = 1.5406 A). The XPD data between 20 and 90° were analyzed with the DBWS-9006PC Rietveld profile refinement program. All the LaO(Cl 1− x Br x ) phases studied crystallize in the tetragonal PbFCl-type structure wi…
VEH electronic structure of Si60
1993
Abstract We present a valence effective Hamiltonian (VEH) theoretical investigation on the electronic structure of Si60. The VEH one-electron energy level distribution calculated for Si60 is used to predict the ionization potential (7.86 eV), electron affinity (6.62 eV) and HOMO-LUMO energy gap (1.24 eV) of Si60. We also report the first allowed electronic transitions of Si60. The results are compared with other theoretical levels and with those calculated for C60.
Valence electronic structure of C60: Theoretical analysis of photoemission data
1993
Abstract We present a theoretical investigation of the valence band photoemission spectra of C 60 using the nonempirical valence effective Hamiltonian (VEH) method. The VEH-DOVS curves calculated for the C 60 molecule are found to be in excellent agreement with synchrotron-radiation photoemission spectra reported for C 60 films. A detailed interpretation of all the photoemission bands is performed in the light of the VEH results.
Theoretical study on the effect of backbone conformation on the electronic structure of poly(di-n-butylsilane)
1993
Abstract We present the results of valence effective Hamiltonian (VEH) calculations on the electronic structure of poly(di-n-butylsilane) in its all-trans and 7/3 conformations. The band structure of all-trans conformation is analyzed in detail and the effects of the backbone conformation on the electronic and optical properties are studied. The VEH results for the 2/1 and 7/3 conformations are in excellent quantitative agreement with photoemission and UV-absorption data and show the reliability of the VEH method to deal with organopolysilanes.
Valence instabilities and inhomogeneous mixed valence in some ternary europium compounds
1997
Abstract Photoemission spectra and TB-LMTO-ASA band structure calculations of some mixed valency europium compounds hve been studied. The band structures are compared with the band structures of the isostructural lanthanum and strontium compounds. Surprisingly a 4f density of states in the vicinity of the Fermi level is observed in inhomogenous mixed valency EuPd 3 B, Eu 3 S 4 , and EuPdP. Indeed a van Hove Singularity (vHS) derived from the d states of La and Pd or p states of boron or phosphorous are found in La 3 S 4 , LaPd 3 B and SrPdP. The valence instability in the Eu compounds is thus not necessarily due to Eu 4f states. The results also provide some ground for the assumption that i…