ZnxCd1-xS∶Ag纳米晶的合成及其光学性质研究

以巯基丙酸(MPA)为稳定剂, 利用共沉淀法制备了水溶性的Ag掺杂的ZnxCd1-xS合金型纳米晶. Ag掺杂后ZnxCd1-xS纳米晶产生新的发射峰, 并且发光效率得到了有效提高. 通过改变纳米粒子中Zn/Cd比例可有效地调控ZnxCd1-xS∶Ag纳米晶的吸收带隙宽度, 同时可以在425～603 nm之间实现对ZnxCd1-xS∶Ag纳米晶发射峰位的连续调控.     

六次甲基四胺与酚类化合物包结现象的研究

Bishop开发的主体化合物1,6-二甲基-1,6-二羟基二环[3,3,1]壬烷可与乙酸乙酯等形成包结物~[1,2],柏木醇通过氢键作用可与酚类化合物形成包结物~[3].比较上述两个主体分子的结构可知,其相似之处在于它们都是桥环化合物,且具有近似球状的分子结构.考虑到六次甲基四胺也是一个球状桥环化合物,且具有与客体分子形成氢键的条件,故它与酚类化合物的包结现象也有助于氢键共晶现象的研究~[4].     

微波辅助合成发光可调ZnS∶Cu纳米晶

以巯基丙酸(MPA)为稳定剂, 利用微波辐射加热方法制备了水溶性的Cu掺杂的ZnS纳米晶. 通过改变微波条件, 可以在460～572 nm之间实现对ZnS∶Cu纳米晶发射峰位的连续调控. 通过XRD、 UV-Vis、荧光及荧光衰减对ZnS∶Cu纳米晶的结构和发光性质进行了详细探索, 并利用时间分辨荧光光谱对其发光机理进行了初步研究.     

利用LB技术以寡聚DNA为模板构建CdS纳米结构

利用Langmuir-Blodgett技术制备了十八胺（ODA）／十聚腺嘌呤（oligo-A10)单分子膜，并以其为模板制备了不同形状的Cds纳米结构，结果表明以在低膜压下转移的寡聚DNA单层为模板可诱导生成线形的Cds纳米结构，而以在主膜压下转换的寡聚DNA单层膜板得到的是Cds的球形结构聚集体。     

Morphology Control over the Organic Nanoparticles of 1,3-Diphenyl-5-（9-anthryl）-2-pyrazoline

The organic nanoparticles of a blue-light-emitting molecule, 1,3-diphenyl-5-(9-anthryl)-2-pyrazuline, were prepared by reprecipitation method using acetonitrile as the solvent for the molecular precursor. Three morphologies, spherical, doughnut-shaped and cubic, could be observed on the silicon substrate forthe nanoparfides by the volume-controlled addition of acetonitrile. The evolution of particle morphology as a function of acetonitrile addition was attributed to the variation of the growth habits of the particles in the different environment. The nanoparticles exhibit the novel photoluminescence spectra as compared to those of monomer and the bulk crystals.     

A novel photoinduced ring opening and isomerization of adamantane-2-spiro isoxazolines using Mo(CO)6

The Mo(CO)₆-mediated photoinduced ring-opening reactions of adamantane isoxazolines involve novel rearrangement that provide enaminoketones as major products and β-hydroxy ketones as minor ones; in contrast, only β-hydroxy ketones and α,β-unsaturated ketones were obtained under thermal condition.     

SinH/SinH-(n=3～8)的结构和电子亲合能的研究

选用四种不同的密度泛函理论方法(B3LYP，B3P86，BLYP，BP86)，在全电子的双ξ加极化加弥散函数基组(DZP )下，对SinH／SinH^-(n=3～8)体系进行研究，获得它们的基态结构和电子亲合能。预测Si3H／Si3H^-,Si4H／Si4H^-,Si5H／Si5H^-,Si6H／Si6H^-，Si7H／Si7H^-和Si8H／Si8H^-的基态结构分别为C2v(^2B2)／C2v(1^A1)氢桥结构，Cs(^2A’)／C(^1A’)，C2v(^2B2)／C2v(^1A1)，C2v(^2B2或^2B1)／C4v(^1A1)，C5v(^2A1)／C5v(^1A1)和C5(^2A‘‘)／C3v(^1A1)。在电子亲合能方面，B3LYP方法预测的电子亲合能是最可靠的，预测Si3H，Si4H，Si5H，Si6H，Si7H和Si8H的电子亲合能分别为2．56，2．59，2．84，2．86，3．19和3．14eV。     

纳米尖晶石LixMn2O4的制备与电化学性能表征

Nano-spinel Li_xMn₂O₄(0.6 ≤x≤ 1.0) was synthesized by two steps of coprecipitation and calcination. The influences of calcination temperature, time and Li/Mn ratio on the crystal structure and the particle size of Li_xMn₂O₄ were investigated. It was shown that the higher the calcination temperature, the more complete the crystal structure, and the larger the particle size. Moreover, the influence of calcination time on the crystal structure was insignificant when it was more than 3h at 700℃. With the increase of x in Li_xMn₂O₄ in the range of 0.6～1.0, the d111 and lattice parameter a increased first and then decreased. The electrochemical properties of nano-spinel LiMn₂O₄ using as cathode material of lithium-ion battery were studied. The low discharge capacity might be due to the irreversible capacity loss brought by the large surface area and lattice vacancies of the nano-spinel.     

Asymmetric Arrangement of Monolayer in the Multilayer Films of 2-Hydroxy-4,4''''-dihexyloxy-azobenzene

IntroductionConstructionoffunctionalmolecularunitsintostruc turallywell definedsupramolecularassemblieshasattract edgreatattentionduetotheirpotentialapplicationsincomplexelectronicstructuresandmoleculardevices .1 5Amongthevariousfunctionalorganicmolecules ,azoben zenederivativeshavebeenwidelystudiedbecauseoftheirinterestingphotoresponsivebehavior .6 11Extensivestudieshaveshownthatsuitablydesignedazobenzenederivativescanformlongrangeorderedarrangementoftwo orthree dimensionalmolecularlatticeat…     

给体和受体取代的苯乙烯衍生物的π-π相互作用

具有电子给体山)和电子受体的给－受体(D－。－A)分子,由于在光诱导下可以产生分子内电荷转移(ICT)激发态,可作为非线性光学和光电转换等材料[”’j．D－。A分子由于共轭体系一端是推电子取代基,另一端是吸电子取代基,所以其HOMO能级较高,LUMO能级较低[”门,在基态容易发生 HO－