三维无机-有机杂化骨架微孔材料Cd(HBTC)(EG)·8(H2O)的合成与结构

由于无机-有机杂化微孔晶体材料在选择性催化、分子识别和可逆性主客体分子(离子)交换等方面存在潜在的应用前景,已经越来越引起人们的广泛注意.传统的沸石和分子筛微孔晶体材料以硅酸盐、硅铝酸盐、磷铝酸盐和无机金属磷酸盐为骨架,新型的无机-有机杂化微孔晶体材料用刚性和热稳定性较好的有机分子和金属离子作为结构单元.均苯三甲酸(H3BTC)是常用的含氧有机配.     

纳米Co3O4的制备、表征及CO低温催化氧化

CO的常温催化氧化由于在消除环境污染、空气净化、CO传感器、封闭式CO₂激光器及密闭系统内消除CO等方面的实用价值而颇受关注.已报道的CO催化氧化催化剂有Hopcalite、复合氧化物、贵金属^[4,5]等.     

铁酸盐MFe2O4的氢气还原热失重分析和氧缺位铁酸盐MFe2O4-δ的制备条件

使用程序升温(298-843K)和等温(523K、573K和623K)热失重分析研究了多种方法制备的尖晶石结构铁酸盐MFe₂O₄(M=Fe、 Mn、 Co、 Ni)的还原行为,讨论了铁酸盐的制备方法、粒径和比表面积对其还原性能的影响。根据程序升温过程中和等温还原下铁酸盐的失重量分别定量地测定了其活化速度和失氧速度,得出了制备氧缺位铁酸盐MFe₂O_4-δ(0<δ≤1)的最佳温度和时间。     

沸石载体结构对甲烷无氧芳构化性能的影响

考察了担载MoO₃的沸石催化剂上甲烷的无氧芳构化性能,并与沸石结构相关联.结果表明,孔径与苯分子动态直径相当的ZSM-5、ZSM-8、ZSM-11和β沸石等是甲烷无氧芳构化催化剂的良好载体,其中3%MoO₃/HZSM-11具有最高的甲烷芳构化活性和稳定性,973K下的转化率和苯选择性分别为8.0%和90.9%;6%MoO₃/HZSM-8与7%MoO₃/H-β芳构化性能相当.以HMCM-41和HSAPO-34为载体时芳构化活性很低,以HMOR、HX和HY为载体时仅有少量乙烯生成,而以HSAPO-5和HSAPO-11为载体时未检测到烃类生成.     

镁铜合金储氢材料的制备及对高氯酸铵热分解过程的影响

采用置换-扩散法制备了镁铜合金储氢材料(Mg2Cu-H), 并对其结构进行了表征. 结果表明, Mg2Cu经过氢化得到的镁铜合金储氢材料不是单一晶相, 而是MgCu2和MgH2的混合物. 用热分析法(DSC)研究了镁铜合金储氢材料对固体火箭推进剂常用氧化剂——高氯酸铵(AP)热分解过程的影响. 结果表明, 镁铜合金储氢材料可以显著促进AP的热分解过程, 加快热分解速率, 降低高温热分解温度, 使DSC表观分解热明显增大. Mg2Cu-H对AP热分解过程的促进作用明显强于Mg2Cu. 随着加入量增加, 镁铜合金储氢材料对AP热分解的催化促进作用增强. 探讨了镁铜合金储氢材料促进AP热分解过程的作用机制.     

三维无机-有机杂化骨架微孔化合物[Co3(BDC)3(EG)4]·2DMF的合成与结构

传统的微孔晶体材料是以硅酸盐、硅铝酸盐、磷铝酸盐和无机金属磷酸盐等作为结构的骨架[1,2]. 近几年来, 出现了一类新型的无机-有机杂化微孔晶体材料, 这类晶体材料是用刚性和热稳定性较好的有机分子(如芳香多酸和多碱)和金属离子作为骨架的结构单元. 它们能够在去除孔道中的溶剂分子后仍然保持骨架的完整性, 而且其孔道的直径在0.4～1.0 nm之间, 比表面积远大于相似孔道的分子筛. 因此, 这类材料具有许多潜在的特殊性能, 在选择性催化、分子识别和可逆性主客体分子(离子)交换等方面具有诱人的应用前景. Yaghi等[3～11]利用不同的有机分子和各种金属制备出了许多这类晶体材料. 对苯二酸是常见的有机配体, 以它和金属离子为结构骨架所形成的无机-有机杂化微孔晶体有Zn3(BDC)3*(CH3OH),Zn(BDC)*(DMF)(H2O),(TPT)(Py)Cd和Zn4O(BDC)3*(DMF)8(C6H5Cl)等[12～15], 但在对苯二酸与金属构成的骨架中, 由于有多个乙二醇分子配位, 很少形成稳定的三维骨架结构的无机-有机杂化微孔晶体.     

Sectional power-law correction for the accurate determination of lutetium by isotope dilution multiple collector-inductively coupled plasma-mass spectrometry

In this study, we employ a sectional power-law (SPL) correction that provides accurate and precise measurements of ¹⁷⁶Lu/¹⁷⁵Lu ratios in geological samples using multiple collector-inductively coupled plasma-mass spectrometry (MC-ICP-MS). Three independent power laws were adopted based on the ¹⁷⁶Lu/¹⁷⁶Yb ratios of samples measured after chemical chromatography. Using isotope dilution (ID) techniques and the SPL correction method, the measured lutetium contents of United States Geological Survey rock standards (BHVO-1, BHVO-2, BCR-2, AGV-1, and G-2) agree well with the recommended values. Results obtained by conventional ICP-MS and INAA are generally higher than those obtained by ID-TIMS and ID-MC-ICP-MS; this discrepancy probably reflects oxide interference and inaccurate corrections.     

近垒能区32S+90,96Zr势垒分布的研究

精确测量了³²S+^90,96Zr两系统的背角准弹散射激发函数, 总体误差小于1%, 从中分别抽取了它们的势垒分布, 对比观测到³²S+⁹⁶Zr的势垒结构扁平且向低能区展宽, 这种 势垒可导致在垒下能区该体系的熔合截面的大大增强. ³²S+⁹⁶Zr与³²S+⁹⁰Zr相比 存在较强的中子转移反应, 且转移Q值为正. ³²S+⁹⁶Zr势垒的扁平结构可能是中子转移道耦合所致, 这会导致³²S+⁹⁶Zr垒下熔合截面大的增强.     

Discrete Dipole Approximation Aided Design Method for Nanostructure Arrays

A discrete dipole approximation （DDA） aided design method is proposed to determine the parameters of nanostructure arrays. The relationship between the thickness, period and extinction efficiency of nanostructure arrays for the given shape can be calculated using the DDA. Based on the calculated curves, the main parameters of the nanostructure arrays such as thickness and period can be determined. Using this aided method, a rhombic sliver nanostructure array is designed with the determinant parameters of thickness （40 nm） and period （440 nm）. We further fabricate the rhombic sliver nanostructure arrays and testify the character of the extinction spectra. The obtained extinction spectra is within the visible range and the full width at half maximum is 99nm, as is expected.     

Surface rumples and band gap reductions of cubic BaZrO3 （001） surface studied by means of first-principles calculations

Electronic properties of the （001） surface of cubic BaZrO3 with BaO and ZrO2 terminations have been studied using first-principles calculations. Surface structure, partial density of states, band structure and surface energy have been obtained. We find that the largest relaxation appears in the first layer of atoms, and the relaxation of the BaO-terminated surface is larger than that of the ZrO2-terminated surface. The surface rumpling of the BaO-terminated surface is also larger than that of the ZrO2-terminated surface. Results of surface energy calculations reveal that the BaZrO3 surface is likely to be more stable than the PbZrO3 surface.