β-榄香烯振动光谱的量子化学从头计算

利用G98及GAMESS从头计算程序的RHF／6－31方法,对β－榄香烯的全部振动基频作了计算,并与实测红外光谱做了对比,归属了它们的振动模式,讨论了它们的特征基频,并对理论计算的振动频率进行了标度校正。     

郡县制国家现代化：中央政府如何扩大公共事务治理职能

郡县制国家的传统职能是“管人”,但是在当代,为了适应现代世界,需要加强和完善“管事”的职能。然而,加强“管事”的职能遇到的一大障碍,是“管事”与“管人”通常难以分开,带来管事与管人的冲突。在全国性公共事务上,面对管事与管人的冲突,郡县制国家的一种改革方向,即建立中央统一管理与地方属地管理相结合的体制,既扩大中央政府的治理职能,同时又发挥纵向约束机制的作用,从而能改善全国性公共事务治理。此种中央统一管理与地方属地管理相结合的体制,通常不是中央政府事先设计出来的,而是在改革过程中,经由中央政府与地方政府的策略性互动过程,逐渐建立起来的。因此,郡县制国家蕴含着一种潜力,即在公共事务治理上,包括地方公共事务和全国性公共事务,可以引入和发挥“纵向约束机制”的作用,使得国家既保持“管人”的基本体制不变,又能提高治理能力。     

Blue laser lithography for making antireflective submicron structures on silicon

The application of blue laser lithography for creating antireflective submicron structures on a crystalline silicon substrate was evaluated. The assembled blue laser lithography system was obtained by modifying a commercial blue laser optical pickup head and consisting of a 405-nm-wavelength blue laser and a 0.85-numerical-aperture objective lens. Si substrates were patterned with submicron column patterns of various periods and aspect ratios by blue laser lithography using a sputtered Ge-Sb-Sn-O layer as a resist. The reflectance of the patterned Si substrate decreased to 3% on average in the 300–1000 nm wavelength range, with a low sensitivity to the angle of incident light. Such patterned substrates showed potential for application in crystalline Si solar cells.     

Coral reef-like polyanaline nanotubes prepared by a reactive template of manganese oxide for supercapacitor electrode

Coral reef-like PANI nanotubes composed of nanopaticles were successfully synthesized by a reactive template of manganese oxide.The structure was characterized by using SEM,TEM,and FT-IR,and the supercapacitive behaviors of these nanotubes were investigated with cyclic voltammetry（CV）,and charge-discharge tests,respectively.A maximum specific capacitance of 533 F/g could be achieved in 1mol/L aqueous H₂SO₄ with the potential range of -0.2 to 0.8 V（vs.the saturated calomel electrode） in a half-cell setup configuration for PANI electrode,suggesting its potential application in the electrode material for electrochemical capacitors.     

Polystyrene-bound diethanolamine based ionic liquids for chemical fixation of CO2

Polystyrene-bound diethanolamine based ionic liquids (PS-DHEEAB and PS-THEAB) were synthesized and applied for the chemical fixation of CO₂ into cyclic carbonates without any additional co-catalyst and solvent. The effect of the catalysts with different number of hydroxyl group in the cation of the IL on the reaction was systematically investigated. Highest activity and selectivity were achieved in the presence of polystyrene supported diethanolamine ethyl bromide (PS-DHEEAB) in comparison with other catalysts employed. The catalyst was tough in stability and also found to be extended to a variety of terminal epoxides and aziridines. The relationship between high catalytic reactivity and the –OH functional groups was proposed.