两种气相色谱固定相的研究

使用硫杂冠醚、穴醚[2.2.2]作气相色谱固定相制备毛细管柱,考察两种固定相的使用比例、极性、热稳定性,并对甲苯-苯、乙苯-甲苯、甲基苯酚（o/p）、二氯苯（o/p,m）、硝基氯化苯（m,o）、苯-环己烷、庚醇-辛醇、苯胺-N,N二甲基苯胺等混合样品进行色谱分离.实验结果表明：两种固定相在OV-1701中的比例均为15%时有较好的分离效果,都属于中等极性的固定相.硫杂冠醚、穴醚[2.2.2]的平均极性分别为815、832,其中硫杂冠醚固定相的热稳定性较好,有较高的使用温度（185℃）,而穴醚[2.2.2]的最高使用温度为120℃,因此穴醚[2.2.2]的使用温度受到一定的限制.从它们较好的分离性能看,固定相硫杂冠醚、穴醚[2.2.2]均具有较好的应用前景.     

Current Reversal Due to Coupling Between Asymmetrical Driving Force and Ratchet Potential

Transport of a Brownian particle moving in a periodic potential is investigated in the presence of an asymmetric unbiased external force. The asymmetry of the external force and the asymmetry of the potential are the two ways of inducing a net current. It is found that the competition of the spatial asymmetry of potential with the temporal asymmetry of the external force leads to the phenomena like current reversal. The competition between the two opposite driving factors is a necessary but not a sufficient condition for current reversals.     

缓冲层ZnPc对有机电致发光器件特性的影响

本文研究了酞菁锌(ZnPc)薄膜的表面形貌及ZnPc薄膜作为缓冲层对有机电致发光器件(OLEDs)光电特性的影响.对比两组样品的AFM图像,ZnPc薄膜相比于ITO薄膜,其表面的岛面积较大,薄膜表面更连续平整,基本上覆盖了ITO膜表面针孔,减少了表面的缺陷.另外,ZnPc薄膜的岛分布均匀有序.使用ZnPc作为缓冲层的器件性能明显好于未使用ZnPc修饰的器件,在7.42V的驱动电压下的最大发光亮度达到1.428kcd/m2,在4.3V电压驱动下时,最大光功率效率为1.411m/W;而未使用缓冲层的器件在8V的驱动电压下达到最大发光亮度达到1.212kcd/m2,在5.5V电压驱动下时,最大光功率效率为0.931m/W.     

In situ observation of NaBi(WO4)2 dendrite growth and the study on microstructure of solidification

The dendrite growth process of transparent NaBi(WO4)2 with small prandtl and high melting point was studied by using the in-situ observation system. According to the dynamic images and detailed information, there are two kinds of restriction effect on the dendrite growth, the competition between arms and branches and the convection in the melt. The dendrite growth rate was time dependent, and the rate of arm growth reached the maximum 5.8 mm/s in the diffusive-advective region and rapidly decreased in the diffusive-convective region. The growth rate of branch had the same change trends as the arm's. Based on the EPMA-EDS data of solidification structure of quenched NaBi(WO4)2 melt, it was found that there were component differences from stoichiometric concentration in the melt near the interface during the growth process.     

端部周期加热下管内气温奇异分布的实验研究

设计搭建了端部周期加热时管内气体热声对流的实验平台,对端部周期加热引起的气体热声对流作用下管内气体的温度分布进行了实验研究。该实验以氩气为工质,利用三极管控制加热电路实现周期性加热;测量了不同加热频率下管内的气体温度,并与常热流加热时的温度分布进行对比,结果表明端部周期加热时管内气体的温度分布与同功率下常热流加热时存在明显的差异,并且在某些测点出现了温度的奇异分布。本实验验证了超温现象的存在,为管内气体热声对流现象的进一步研究奠定了基础。     

离子液体辅助水热法合成六方WO3纳米棒束

提出了利用简单的离子液体1-甲基-3-乙基-咪唑溴辅助水热法合成六方WO₃纳米棒束的方法,对其结构进行了表征,并讨论其形成机理。TEM照片表明：WO₃纳米棒束由长200~300 nm、直径25~30 nm的纳米棒组装而成。离子液体1-甲基-3-乙基-咪唑溴在纳米棒的形成过程中起到了结构导向剂的作用。     

N-Doped Carbon Nanofibers Encapsulating CoO@Co9S8 Nanoparticles: Preparation from S-Rich Co32 Coordination Cluster Precursors by Electrospinning and Application for Superior Li-ion Storage

Thiacalixarene-supported Co₃₂nanoclusters encapsulated in polyacrylonitrile nanofibers(Co₃₂@PAN-NFs) by electrospinning have been utilized as precursors to fabricate N-doped CoO@Co₉S₈ carbon nanofibers(CoO@Co₉S₈@CNFs) for superior Li-ion storage. The S-rich Co₃₂ clusters capped by organic sheets afforded the well dispersed cobalt oxide/sulfide nanoparticles embedded in carbon nanofiber composites by direct calcination. The N-doped CoO@Co₉S₈@CNFs nanocomposites have been utilized as anode materials for lithium ion battery with the reversible capabilities being of 1051.8, 967.6, 894.7, 782.7, 669.5 and 525.4 mA·h/g at 0.1, 0.2, 0.5, 1, 2 and 3 A/g, respectively. The CoO@Co₉S₈@CNFs also showed a relatively high stable capacity of 551.7 mA·h/g at the current density of 1 A/g after 200 cycles of rate experiments. The as-obtained N-doped CoO@Co₉S₈@CNFs nanocomposites exhibited superior reversible capacity, rate performance, Coulomb efficiency(74.5% vs. 63.9%) and cyclic stability comparing with the CoO@Co₉S₈@C derived from simple annealing of Co₃₂ templates.     

利用高吸水树脂优化3个中学化学实验*

尝试利用高吸水树脂对“酸碱中和反应、碳酸钠和碳酸氢钠分别与稀盐酸反应、探究分子运动现象”这3个实验进行创新改进,充分利用了高吸水树脂特殊的结构作用,使3个实验的现象更加显著。改进实验操作简便,高效简洁,值得推广到一线化学课堂的演示实验或学生分组实验。     

ω-芋螺毒素的定量构效关系与虚拟筛选

ω-芋螺毒素属于海洋生物活性多肽,由24-31个氨基酸残基组成.特异性作用于电压敏感的钙离子通道(VGCCs),能够直接开发成药物或作为先导化合物进行新药开发.本文应用新型氨基酸残基结构描述符cscales和遗传偏最小二乘算法,对ω-芋螺毒素进行定量构效关系(QSAR)研究,并设计、构建了容量为2244个化合物的N-型和P/Q-型VGCC拮抗剂虚拟组合多肽库,然后分别采用QSAR模型预测和相似性搜索方法对组合多肽库进行了虚拟筛选.研究结果表明,建立的N-型和P/Q-型VGCC拮抗剂QSAR模型均具有较好的预测能力,交叉验证相关系数(CV-r2)均大于0.89.主成分分析和聚类分析结果表明,虚拟组合多肽库中化合物具有较好的结构多样性和差异性.通过虚拟筛选,得到了具有高预测活性的6个N-型和19个P/Q-型钙离子通道拮抗剂,为进一步的合成和活性评价奠定了理论基础.同时,本文建立的多肽QSAR预测模型和虚拟筛选策略,为其它多肽类化合物的定量构效关系研究和虚拟筛选提供了参考.