The efficient reuse of homogeneous catalyst is important. Cation complex of [Ru(η6 -p-cymene)(PPh3 )(CH3 CN) Cl]PF6 with different ligands was synthesized and characterized by infrared spectroscopy (IR), 1 H-, 13 C- and 31 P-nuclear magnetic resonance spectroscopy (1 H-, 1 3C- and 31 P-NMR), element analysis (EA), and high resolution mass spectrometry (HR-MS). The complex was used as a catalyst for the hydrogen transfer reduction of carbonyl for the first time, presenting an excellent catalytic performance of 89%–98% conversion of acetophenone and its derivatives. The catalyst may be efficiently reused by the electro-adsorption of 10 times to one catalyst recovery. The cation [Ru] complex presented advantages of both homogeneous and heterogeneous catalysts.
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In this work, first principles calculations have been performed to study the doping and distribution of Si atoms in TiC lattice. The results confirm that Si atoms prefer to occupy Ti sites and their segregation on the TiC crystal surface may occur. But in the presence of carbon vacancies on the surface, Si atoms tend to be chemically adsorbed around the vacancies rather than occupy the carbon sites. It is also shown that the diffusion of Si may be very difficult in stoichiometric TiC, in particular the diffusion from bulk to surface. However, the carbon vacancies can considerably decrease the energy barrier and enhance the diffusion of Si atoms.
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Flooding emergency capability of coal mine is influenced by personnel’s emergency quality, rescue equipment, rescue materials, rescue team and emergency management. This paper sets up a causal diagram and a flow chart model. With investigation on coal enterprises, a simulation model of flooding emergency capacity of coal mine is established using system dynamics. Results show: at the early stage of coal mine production, emergency input has hysteretic nature; increasing emergency input improves each factor’s emergency level and flooding emergency capacity of coal mine; initial emergency level affects the time flooding emergency capacity reaches to desired level; the impact of each factor on flooding emergency capacity is different. The simulation model helps a sense of emergency input direction scientifically for coal enterprises. It is good for improving flooding emergency capacity of coal mine.
PL
W artykule przedstawiono model matematyczny system ostrzegania przed powodzią w kopalniach. Przeprowadzono symulacje z uwzględnieniem dynamiki procesu.
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