Zobrazeno 1 - 10
of 94
pro vyhledávání: '"Zhe-ming Ni"'
Publikováno v:
Journal of Fuel Chemistry and Technology. 47:688-696
The reaction path and the reaction mechanism of water gas shift reaction (WGSR) on the Cu-Pt-Au catalyst surface were investigated using density functional theory (DFT). The stability and electron activity of binary and ternary catalysts composed of
Publikováno v:
Journal of Fuel Chemistry and Technology. 45:1473-1480
The stability and catalytic activity of Au10, Au13 and Au20 clusters in water gas shift (WGS) reaction were investigated by density functional theory (DFT); the adsorption behavior of reaction species and the reaction mechanism of WGS on various Aun
Publikováno v:
Journal of Fuel Chemistry and Technology. 45:34-42
The adsorption behavior, decarbonylation and hydrogenation reaction mechanisms of furfural on best Pd/Cu(111) bimetallic model were investigated by density functional theory method. The results show that the initial adsorption at O3-Pd-top and O7-Cu-
Publikováno v:
Journal of Inorganic Materials. :8
Publikováno v:
Advanced Materials Research. :343-346
The organic-inorganic composite of oleic acid embedded layered magnesium borate was synthesized by low temperature hydrothermal method with magnesium chloride (MgCl2•6H2O), borax (Na2B4O7•10H2O) as reactants, oleic acid as the embedded agent. The
Publikováno v:
Advanced Materials Research. :2102-2105
A double-sheets model was proposed to investigate the interlayer structure and properties of hydrotalcite (HT) containing CO32-, CrO42-, SO42- and NO3- using density functional theory, and the configuration and distribution of four anions in the inte
Publikováno v:
Journal of Molecular Structure: THEOCHEM. 915:122-131
Density functional theory has been used to investigate microscopic structures and electronic properties of LDHs containing F−, Cl−, Br−, I−, OH−, NO 3 - , IO 3 - , ClO 4 - . Both electrovalent bonds and covalent bonds were found in the laye
Publikováno v:
Journal of Physics and Chemistry of Solids. 70:632-638
We report an improved absorbent material for NO x , a major component of acid rain and other environmentally hazardous chemicals. This new material is based on the hydrotalcite-like compounds and incorporating Mg and Zn markedly enhances the capacity
Publikováno v:
Journal of Solid State Chemistry. 181:2610-2619
Zn/Al layered double hydroxides (LDHs) were intercalated with the anionic antihypertensive drugs Enalpril, Lisinopril, Captopril and Ramipril by using coprecipitation or ion-exchange technique. TG-MS analyses suggested that the thermal stability of E
Publikováno v:
Analytica Chimica Acta. 577:288-294
A novel method for the determination of Al, Ca, Cr, Cu, Fe, Mg, Mn, Ni and Ti in high purity silicon carbide (SiC) using slurry introduction axial viewed inductively coupled plasma optical emission spectrometry (ICP-OES) was described. The various si