SFG study of the ethanol in an acidic medium--Pt(110) interface: effects of the alcohol concentration

Ethanol in an acidic solution-Pt(110) interface was studied by SFG spectroscopy (between 1820 and 2325 cm(-1)) to explore primarily the effects of the alcohol concentration. Stretching bands of H-Pt (ca. 1970 or 2050 cm(-1)) and CO (ca. 1980 and 2040 cm(-1)) species, produced by the ethanol oxidation, were detected during the adsorption and oxidation of 0-1 mol L(-1) ethanol in a 0.1 mol L(-1) HClO(4) solution on the electrode surface. Hydrogen and CO coadsorb stably on Pt(110) between 0.05 and 0.15 V in ethanol-containing solutions. In this potential range, the blue shift of the hydrogen resonance (ca. 80 cm(-1)) reveals a weakening of the hydrogen bonding between adsorbed hydrogen and water molecules in the double layer. After the hydrogen desorption (0.15 V), the formation of compact CO islands, depending on the ethanol concentration, lifts the Pt(110) surface reconstruction. In ethanol-free solution, the surface remains reconstructed. The lower-frequency CO band is assigned to the CO species adsorbed on (1 x 2) reconstructed Pt(110) domains, having smaller local coverages, while the higher-frequency CO band is attributed to the close-packed CO species adsorbed on (1 x 1) patches. The reaction pathway forming CO(2) is less favored with increasing ethanol concentration.     

Galerkin method for nonlocal mixed boundary value problem for the Moore‐Gibson‐Thompson equation with integral condition

In this paper, we are going to deal with the nonlocal mixed boundary value problem for the Moore‐Gibson‐Thompson equation. Galerkin method was the main used tool for proving the solvability of the given nonlocal problem.     

Gold(I)/Gold(III) Catalysis that Merges Oxidative Addition and π-Alkene Activation

Heteroarylation of alkenes with aryl iodides was efficiently achieved with a (MeDalphos)AuCl complex through Au^I/Au^III catalysis. The possibility to combine oxidative addition of aryl iodides and π-activation of alkenes at gold is demonstrated for the first time. The reaction is robust and general (>30 examples including internal alkenes, 5-, 6-, and 7-membered rings). It is regioselective and leads exclusively to trans addition products. The (P,N) gold complex is most efficient with electron-rich aryl substrates, which are troublesome with alternative photoredox/oxidative approaches. In addition, it provides a very unusual switch in regioselectivity from 5-exo to 6-endo cyclization between the Z and E isomers of internal alkenols.     

Batch and continuous fixed-bed column adsorption of Cs+ and Sr2+ onto montmorillonite–iron oxide composite: Comparative and competitive study

A montmorillonite–iron oxide composite (MIOC) was prepared to assess its effectiveness in the removal of Cs⁺ and Sr²⁺ from aqueous solution. A comparative and competitive adsorption study was conducted in single and binary systems. Used materials have been characterized by X-ray diffraction (XRD) and Infrared spectroscopy. Adsorption of Cs⁺ and Sr²⁺ as a function of contact time and pH was investigated, adsorption data of single metal solutions were well fitted to the Freundlich–Langmuir isotherm models. Equilibrium isotherms for the binary removal of Cs⁺ and Sr²⁺ by MIOC have been analyzed by using non modified and extended Langmuir models with a satisfactory R ² values. Neutral solution pH was found to be favorable for both single and binary systems. The adsorption model analysis revealed that MIOC was more selective for Sr than Cs. The maximum adsorption capacities for individual Cs⁺ and Sr²⁺ solutions were 52.6 and 55.5 mg g^?1, respectively. While the maximum uptakes in the binary system were 41.6 and 47.6 mg g^?1 for Cs⁺ and Sr²⁺, respectively. Column adsorption experiments were carried out at room temperature under the effect of various operating parameters such as bed depth, initial cation concentration and flow rate, Breakthrough curves were well fitted to the Thomas model. Desorption experiments were also conducted to assess the possibility for the reuse of adsorbent and the recovery of cations.     

Spontaneous Oxidative Addition of σ-SiSi Bonds at Gold

Gold can do it! The activation of disilanes at gold was observed experimentally and analyzed theoretically. Upon chelation with two or even only one phosphine donor, the oxidative addition of σ-Si?Si bonds proceeds readily at low temperatures. These results show an unexpected similarity between gold and the other late transition metals towards σ?bond activation.     

Chemical composition and antimicrobial activity of essential oil of Cupressus atlantica

Cupressus atlantica Gaussen, an endemic species from Morocco, is used in traditional medicine. The chemical composition of the essential oil isolated by hydrodistillation from the leaves was investigated by capillary gas chromatography and gas chromatography/mass spectrometry, and also evaluated for in vitro antimicrobial activity. Sixty-one components, representing 98.1% of the total, were detected of which fifty-seven were identified. Germacrene D (34.8%), alpha-pinene (13.6%), delta-cadinene (6.1%), alpha-phellandrene (5.5%), gamma-cadinene (5.0%), beta-caryophyllene (4.8%) and alpha-humulene (4.4%) were the predominant compounds. The oil was characterized by a relatively high amount of oxygenated monoterpenes (66.5%). The oil, screened for antimicrobial activity against both Gram-positive and Gram-negative, showed pronounced activity against all the microbes tested, except Pseudomonas, which showed resistance.     

Chemical composition, antibacterial and antioxidant activities of the essential oils from Thymus satureioides and Thymus pallidus

This study was designed to examine the in vitro antibacterial and antioxidant activities of the essential oils (EOs) of Thymus satureioides (T.s) and T. pallidus (T.p). EOs were isolated by steam distillation and analyzed by capillary gas chromatography and gas chromatography coupled to mass spectrometry (GC-MS). The major constituents of the volatile fraction of T. satureioides were bomeol (29.5%), carvacrol (9.1%), and beta-caryophyllene (8.2%), while those of T. pallidus were camphor (29.8%), dihydrocarvone (17.6%), bomeol (7.6%) and camphene (7.5%). The essential oils were tested against a panel of Gram+ and Gram- bacteria by using agar diffusion and broth dilution methods. The data indicated that the Gram-positive Bacillus subtilis was the most sensitive strain producing an average inhibition zone of 51.7 mm. Furthermore, Pseudomonas aeruginosa, known as a resistant strain, was also sensitive. The samples were also subjected to screening for their possible antioxidant activity by using the 2,2-diphenyl-l-picrylhydrazyl (DPPH) assay. The IC50 values of the oil of T. satureioides and T. pallidus were 0.32 and 11.6 mg/mL, respectively.     

Synthesis, characterization and solution behaviour of phosphoryl complexes of tin tetrafluoride

The preparation and characterization of a series of octahedral complexes [SnF₄L₂] (L = (Me₂N)₃PO (1), L = (R₂N)₂P(O)F; R = Me (2); Et (3) or L = R₂NP(O)F₂; R = Me (4); Et (5)) are described. These new adducts have been characterised by multinuclear (¹⁹F, ³¹P and ¹¹⁹Sn) NMR, IR spectroscopy and elemental analysis. The NMR data particularly the ¹⁹F NMR spectra showed that the complexes exist in solution as mixtures of cis and trans isomers. The solution behaviour of the complexes studied by variable temperature NMR in the presence of excess ligand indicated that, unlike in the SnCl₄ analogues, the ligand exchange at room temperature is slow for 1–3 and fast only for 4 and 5. The metal–ligand exchange barriers in [SnF₄L₂] and [SnCl₄L₂] systems were estimated and compared. The results indicate that in addition to the difference in the Lewis acidity between SnF₄ and SnCl₄ the nature of the substituents (fluorine atoms) on the phosphorus atom of the ligand can contribute considerably to the lability of the complex obtained.     

Well-posedness and general decay for Moore–Gibson–Thompson equation in viscoelasticity with delay term

Ricerche di Matematica - The problem of Moore–Gibson–Thompson equation with infinite memory and time delay terms is considered. Under suitable Lyapunov functionals with an appropriate...     

An asymptotic behavior and a posteriori error estimates for the generalized Schwartz method of advection-diffusion equation

In this paper, a posteriori error estimates for the generalized Schwartz method with Dirichlet boundary conditions on the interfaces for advection-diffusion equation with second order boundary value problems are proved by using the Euler time scheme combined with Galerkin spatial method. Furthermore, an asymptotic behavior in Sobolev norm is deduced using Benssoussan-Lions' algorithm. Finally, the results of some numerical experiments are presented to support the theory.