90 research outputs found
The Role of Culture in Business Transaction:Implications for Success in Trans-Geographical Settings
Non-oxidative dehydroaromatization of methane (MDA) is a promising catalytic process for direct valorization of natural gas to liquid hydrocarbons. The application of this reaction in practical technology is hindered by a lack of understanding about the mechanism and nature of the active sites in benchmark zeolite-based Mo/ZSM-5 catalysts, which precludes the solution of problems such as rapid catalyst deactivation. By applying spectroscopy and microscopy, it is shown that the active centers in Mo/ZSM-5 are partially reduced single-atom Mo sites stabilized by the zeolite framework. By combining a pulse reaction technique with isotope labeling of methane, MDA is shown to be governed by a hydrocarbon pool mechanism in which benzene is derived from secondary reactions of confined polyaromatic carbon species with the initial products of methane activation
INKJET PRINTING OF ALUMOOXIDE SOL FOR DEPOSITION OF ANTIREFLECTING COATINGS
Subject of Research. This work describes for the first time the formation of antireflective coating on the base of boehmite phase of AlOOH with low refractive index (1.35) by inkjet printing on the nonporous substrate. This method gives the possibility to increase the contrast of colorful interfering images by 32% obtaining by inkjet printing of titanium dioxide sol. The usage of this technology enables to obtain patterns with wide viewing angle and makes them highly stable. Methods. Traditional sol-gel method with peptizing agents and heating for 90oC was applied for sol synthesis. Then the mixture was under sonic treatment for the obtaining of viscous sol. The viscosity was determined by Brookfield HA/HB viscometer, and the surface tension by Kyowa DY-700 tensiometer. Aluminum oxide ink was deposited on polished slides (26×76 mm2, Paul Marienfeld, Germany), over titanium oxide layer. To print titania ink, we use a desktop office printer Canon Pixma IP 2840 and Dimatix DMP-2831. The thickness of an inkjet AlOOH layer after drying in the air and removal of the solvents did not exceed 150 nm with an RI not less than 1.35 in the entire visible range. Results. The stable colloidal ink was obtained for the first time on the base of aluminum oxide matrix with neutral pH. The rheology was regulated by controlling parameters of sol-gel method in the system of aqueous titanium dioxide sol and by adding ethanol that affects the charge of double electrical layer of disperse phase. The controllable coalesce of drops enables to apply antireflection coating within the thickness accuracy of 10 nm. The morphology of particles and the topology of printed structures were analyzed by optical, scanning electron and atomic-force microscopes. Practical Relevance. We have proposed the approach to obtain colorful, interference patterns using two types of high refractive inks with different refractive indexes. The inkjet printing method opens new opportunities for preparing optical waveguides and forming photon-induction panels for new generation of computers
Computational chemistry of zeolite catalysis
This chapter presents an introductory overview of the basic concepts, power, capabilities, and limitations of modern quantum-chemical techniques for studying reactivity and chemical properties of zeolites. The subjects discussed here will include the methodological aspects of computational chemistry crucial for modeling extended chemical systems as well as recent relevant examples of application of computational methodologies for developing new concepts of zeolite reactivity. Emphasis will be made on the use of computational approaches for unraveling molecular-level phenomena underlying catalytic properties of zeolites
Response to comment “On the existence of excitonic signatures in the optical response of metal–organic frameworks”
\u3cp\u3eThis is a response to a comment on the interpretation of the origin of the nonlinear changes of optical properties of van der Waals' metal–organic frameworks (MOFs). The concerns are addressed by clarifying potential pitfalls in density functional theory (DFT) simulations, careful analysis of prior literature, and additionally discussing the previous experimental results to emphasize the applicability of the excitonic concept in molecular crystals, such as MOFs.\u3c/p\u3
Engineering of transition metal catalysts confined in zeolites
Transition metal-zeolite composites are versatile catalytic materials for a wide range of industrial and lab-scale processes. Significant advances in fabrication and characterization of well-defined metal centers confined in zeolite matrixes have greatly expanded the library of available materials and, accordingly, their catalytic utility. In this review, we summarize recent developments in the field from the perspective of materials chemistry, focusing on synthesis, postsynthesis modification, (operando) spectroscopy characterization, and computational modeling of transition metal-zeolite catalysts
Single-site trinuclear copper oxygen clusters in mordenite for selective conversion of methane to methanol Citation for published version (APA)
. (2015). Singlesite trinuclear copper oxygen clusters in mordenite for selective conversion of methane to methanol. Nature Communications
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