In light of the recent attention MoS2 has received regarding its possibilities for use in the photocatalytic evolution of H2, we have conducted a comparative computational investigation of some key properties that determine water reactivity such as the molecular structure and water adsorption properties of molybdenum oxide and sulfide clusters. Using density functional theory methods, we have f...

The title salt, (C(5)H(6)N)(4)[Mo(2)Cl(2)O(5)(SO(4))(2)], comprises four pyridinium cations for each [(MoClO(2))(2)(μ-O)(μ-SO(4))(2)](4-) anionic unit. The asymmetric unit consists of three aggregates of the empirical formula. The tetra-anionic bimetallic molybdenum(VI) cluster is unprecedented and contains two sulfate and one oxide bridges. This structure constitutes the first example of a non...

one distinct concentration of copper ions was embedded into the silica matrix to xerogel form using copper source cu(no3)2∙3h2o. the xerogel samples were prepared with using hydrolysis and condensation reactions of tetraethyl ortho-silicate (teos) by the sol-gel method. in this investigation, new molar ratio of h2o/teos was determined to be 11.7. also, the necessary amount of tri-hydrated coppe...

copper oxide nanostructures have been successfully synthesized via one-step solid-state thermolysis of two metal-organic frameworks, [cu3(btc)2] (1) and [cu(tpa).(dmf)] (2), (btc = benzene-1,3,5-tricarboxylate, tpa = therephtalic acid = 1,4-benzendicarboxylic acid and dmf = dimethyl formamide) under air atmosphere at 400,  500, and 600°c. it has also been found that the reaction temperature pla...

The splitting of water into hydrogen and oxygen molecules using sunlight is an attractive method for solar energy storage. Until now, photoelectrochemical hydrogen evolution is mostly studied in acidic solutions, in which the hydrogen evolution is more facile than in alkaline solutions. Herein, we report photoelectrochemical hydrogen production in alkaline solutions, which are more favorable th...

a synthesis of doped ceria by combustion method is performed. two types of fuel such asurea and glycine is used to investigate the effect of fuel reactivity and reaction rate on themorphology of the resulted powders. thermo gravimetric analysis is carried out by (tg/dta,rigaku thermalplus tg 8120) to study the exo–endo temperature of as-received powder. thecrystalline phases are identified by x...

Ammonia (NH3) is produced from atmospheric nitrogen and hydrogen from a hydrocarbon source. Natural gas is the most commonly used hydrocarbon feedstock for new plants; other feedstocks that have been used include naphtha, oil, and gasified coal. Natural gas is favored over the other feedstocks from an environmental perspective. Ammonia production from natural gas includes the following processe...

Electrochemical water splitting has been considered as a promising approach to produce clean and sustainable hydrogen fuel. However, the lack of high-performance and low-cost electrocatalysts for hydrogen evolution reaction hinders the large-scale application. As a new class of porous materials with tunable structure and composition, metal-organic frameworks have been considered as promising ca...

The micro layers micaceous iron oxide and nano-TiO 2 were incorporated into the epoxy resin by mechanical mixing and sonication process. Optical micrographs showed that the number and diameter size of nanoparticle agglomerates were decreased by sonication. The structure and composition of the nanocomposite was determined using transmission electron microscopy which showed the presence of disper...