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Da Quan Zhang Xing Jin Bin Xie Hyung Goun Joo Li Xin Gao Kang Yong Lee 《Surface and interface analysis : SIA》2012,44(1):78-83
The corrosion inhibition of ammonium heltamolybdate (AH) and calcium gluconate (CG) for AA6061 alloy in 3% NaCl solution was investigated by the electrochemical measurements. It indicates that AH inhibits the corrosion of AA6061 alloy and acts as an anodic inhibitor. Maximum inhibition efficiency reaches 74.3% at the concentration of 1 × 10?4 mol.l?1 AH. The results of the electrochemical studies reveal AH is physically adsorbed on the AA6061 alloy surface and the adsorption follows Langmuir isotherm. The combination of AH and CG enhances the inhibition efficiency to 95.9%. The enhanced inhibition is attributed to the promotion of AH adsorption by CG. The mixture of AH and CG is a mixed‐type inhibitor and renders the corrosion potential to more positive values. Copyright © 2011 John Wiley & Sons, Ltd. 相似文献
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An immersed smoothed point interpolation method (IS‐PIM) for fluid‐structure interaction problems 下载免费PDF全文
An immersed smoothed point interpolation method using 3‐node triangular background cells is proposed to solve 2D fluid‐structure interaction problems for solids with large deformation/displacement placed in incompressible viscous fluid. In the framework of immersed‐type method, the governing equations can be decomposed into 3 parts on the basis of the fictitious fluid assumption. The incompressible Navier‐Stokes equations are solved using the semi‐implicit characteristic‐based split scheme, and solids are simulated using the newly developed edge‐based smoothed point interpolation method. The fictitious fluid domain can be used to calculate the coupling force. The numerical results show that immersed smoothed point interpolation method can avoid remeshing for moving solid based on immersed operation and simulate the contact phenomenon without an additional treatment between the solid and the fluid boundary. The influence from information transfer between solid domain and fluid domain on fluid‐structure interaction problems has been investigated. The numerical results show that the proposed interpolation schemes will generally improve the accuracy for simulating both fluid flows and solid structures. 相似文献
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Guangxing Ping Chao Wang Da Chen Shu Liu Xiani Huang Laishun Qin Yuexiang Huang Kangying Shu 《Journal of Solid State Electrochemistry》2013,17(9):2503-2510
The photocatalytic conversion of CO2 and H2O to alcohols was achieved using self-organized TiO2 nanotube arrays (TNAs), which were prepared by electrochemical anodization of Ti foils in 1 M (NH4)2SO4 electrolyte containing 0.5 wt% NH4F. Experimental results revealed that the morphology and structure of self-organized TNAs could be strongly influenced by the applied voltage and anodization temperature, and the optimized TNAs were prepared by electrochemical anodization of Ti foils under optimal conditions (i.e., at 20 V for 2 h at 30 °C). The as-prepared TNAs were amorphous and could be transformed to anatase phase during the thermal treatment at 450 °C in air for 3 h. By using the annealed TNAs as a photocatalyst, the photocatalytic reduction of CO2 to alcohol, predominately methanol and ethanol, was demonstrated under Xenon lamp illumination. Based on the photocatalytic measurements, the production rates of methanol and ethanol were calculated to be ~10 and ~9 nmol cm?2 h?1, respectively. In addition, the formation mechanism of methanol and ethanol was also tentatively proposed. 相似文献
158.
采用B3LYP/6-31G*水平计算来研究酸性沸石上苯与乙烯的烷基化反应历程,从生成能和反应活化能角度分析并讨论了苯与乙烯的反应机理.选取4T簇模型模拟分子筛的酸性位,使用密度泛函理论对烷基化反应三种不同的反应机理(两个联合反应机理和一个分步反应机理)进行计算分析.结果表明,在联合反应机理中,乙烯的质子化和苯与乙烯间C-C键的形成同时发生;分步反应机理中,首先形成一个稳定的乙醇盐中间物种,然后与苯分子反应形成乙苯.联合机理速控步骤的活化能约为160kJ/mol,分步机理速控步骤的活化能为190.24kJ/mol,因此,酸性沸石上苯与乙烯烷基化反应机理主要以联合机理为主,但分步机理与其有一定程度的竞争。 相似文献
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Anderson A. B. C. Júnior Gustavo S. G. De Carvalho Lippy F. Marques Charlane C. Corrêa Adilson D. Da Silva Flvia C. Machado 《Acta Crystallographica. Section C, Structural Chemistry》2013,69(8):934-936
The title compound, C14H11NO4, exists in the solid phase in the zwitterionic form, 2‐{[(4‐carboxy‐3‐hydroxyphenyl)iminiumyl]methyl}phenolate, with the H atom from the phenol group on the 2‐hydroxybenzylidene ring transferred to the imine N atom, resulting in a strong intramolecular N—H...O hydrogen bond between the iminium H atom and the phenolate O atom, forming a six‐membered hydrogen‐bonded ring. In addition, there is an intramolecular O—H...O hydrogen bond between the carboxylic acid group and the adjacent hydroxy group of the other ring, and an intermolecular C—H...O contact involving the phenol group and the C—H group adjacent to the imine bond, connecting the molecules into a two‐dimensional network in the (10) plane. π–π stacking interactions result in a three‐dimensional network. This study is important because it provides crystallographic evidence, supported by IR data, for the iminium zwitterionic form of Schiff bases.<!?tpb=12pt> 相似文献
160.
Li‐Jun Yang Kun Jiang Jun‐Jie Tan Shi‐Jin Qu Hong‐Feng Luo Chang‐Heng Tan Da‐Yuan Zhu 《Helvetica chimica acta》2013,96(1):119-123
Chemical investigation on the stem and root of Melicope pteleifolia afforded three new prenylated benzene metabolites as racemic mixtures, named pteleifolins A–C ( 1 – 3 , resp.). Their gross structures were elucidated on the basis of spectroscopic analysis, especially 2D‐NMR experiments. An enantiomer resolution of (±)‐ 1 using chiral HPLC was performed, and the absolute configuration of the enantiomers were determined to be (+)‐(S)‐ 1 and (?)‐(R)‐ 1 by means of circular‐dichroism analysis. 相似文献