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41.
甲醇氨化反应中交联皂石的催化行为 总被引:1,自引:1,他引:1
层柱材料是具有规则孔结构且其表面酸性及孔结构可调变的固体酸催化剂.本文合成了皂石,并用十三聚铝羟基络离子(Al_(13))与其交联,在醇氨化反应中研究了此层柱材料孔结构及表面酸性与催化性能间的关系. 相似文献
42.
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合成形态、大小及结构可人为调控的无机材料是现代材料科学的重要研究方向[1]. 借助于各类有机添加剂及模板剂的调控作用, 可利用溶液合成方法制备出形貌与结构受到有效调控的无机粒子[2,3]. 室温固态化学反应已被成功地应用于多种无机纳米粒子[4]及纳米线[5]的合成, 并显示出高效、节能、无污染和操作简便等优点, 因而在材料合成领域具有应用前景[6]. 相似文献
44.
MENG Jian REN Yu-Fang LI Xiao-GuangLaboratory of Rare Earth Chemistry Physics Changchun Institute of Applied Chemistry Chinese Academy of Sciences Changchun Jilin ChinaPopov V.V. Repin S.M. Smirnov LA. loffe Physicotechnical Institute Russian Academy of Sciences Saint Petersburg Russia 《中国化学》1994,12(5):419-424
YBa2Cu3-xVxO7-y(x=0, 0.1, 0.2, 0.3, 0.4, 0.5 and 0.6) superconductors have been prepared. X-ray diffraction shows that the system remains orthorhombic for all compositions studied, but for x > 0.4 V2O5 was detected as an impurity phase. Substitution of V5+ for Cu2+ occurs in the Cu(2) sites on the Cu(2)-O planes. The introduction of the high valence element, vanadium, produces the extra free-electrons. These electrons recombine with the positive carrier of the system. It makes depression of the mobility and the Hall number of YBa2Cu3-xVxO7-v and also results in a depression of TC. 相似文献
45.
Reactions of SmI2 in THF with ArSSAr produced two binuclear samarium thiolate complexes [(THF)3I2- Sm(μ-SAr)]2 [Ar=Ph (1), 4-Me2NC6H4 (2)] in high yields. The structure of 2 was characterized by single crystal X-ray crystallography. The crystal of 2 belongs to the triclinic system with space group P 1 and a=0.95705(13) nm, b= 1.22287(14) nm, c= 1.26450(14) nm, a=64.194(11)°, B=78.491(13)°, y=76.176(12)°, V= 1.2860(3) nm^3, Z= 1,μ=4.783 mm^-1, Dc= 1.964 Mg/m^3, M= 1521.19, S= 1.046, R1=0.0358, wR2=0.0910. X-ray analysis revealed that 2 is a thiolate-bridged dimer in which each Sm atom adopts a distorted pentagonal bipyramidal coordi- nation geometry. 相似文献
46.
DFT study on the geometric, electronic structure and Raman spectra of 5,15-diphenylporphine 总被引:1,自引:0,他引:1
Zhang YH Li ZY Wu Y Zhu YZ Zheng JY 《Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy》2005,62(1-3):83-91
The ground state geometric, electronic structure and Raman spectra of 5,15-diphenylporphine (H(2)DPP) have been studied using B3LYP/6-31G(d) method and compared with that of well-studied free base porphine (H(2)P) and meso-tetraphenylporphine (H(2)TPP). Calculation shows that 5,15-substitution causes remarkable in-plane distortion, whereas the resulting out-of-plane distortion is negligible. The calculated electronic structure of H(2)DPP is consistent with the absorption spectra compared with H(2)P and H(2)TPP. The calculated vibrational frequencies of H(2)DPP scaled with a single factor of 0.971 agree well with experimental data (the rms error is 8.0 cm(-1)). The assignment of experimental Raman bands of H(2)DPP was discussed on the basis of theoretical calculation and the comparison with that of H(2)P and H(2)TPP. The splitting of some vibrational modes involving the motion of C(m) atom, such as nu(1), nu(8), and nu(10), was observed and was attributed to the diversification of the environment around C(m) atoms. As the shift of absorption peaks, the shift of some structure-sensitive Raman bands of H(2)DPP form that of H(2)TPP and H(2)P was attributed to the in-plane nuclear reorganization (IPNR) induced by phenyl-substitution, though the contribution of nonplanarity mechanism could not be excluded completely. 相似文献
47.
2002年中国颁布科普法后,2003至2011年出版的化学普及书籍种数总体呈上升趋势。出版地和出版社总体上较为分散,局部集中度高。主题上基础知识类化学普及书籍最多,科学文化类次之,实用知识类较少,化学前沿类最少。涉及科普的一般法律、法规和政策对化学普及书籍的创作影响甚微。只有与国家约束性社会发展指标相关,发生涉及公民生命安全的重大社会事件,针对特定人群的具体实施政策出台,科普法规和政策才对化学普及书籍的出版起到推动作用。 相似文献
48.
Gao F Ruan WJ Chen JM Zhang YH Zhu ZA 《Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy》2005,62(4-5):886-895
A barium-containing crown ether bridged chiral heterotrinuclear salen Zn(II) complex BaZn2L(ClO4)2, where L is a folded dinuclear chiral (R,R)-salen ligand, has been synthesized and characterized by elemental analysis, 1H NMR, UV-vis, IR, circular dichroism (CD) spectra, and mass spectra. As a folded dinuclear chiral host, its recognition with achiral guests (imidazole derivatives), rigid bidentate guest (1,4-diazobicyclo[2,2,2]octane, DABCO) and chiral guests (amino acid methyl esters) was investigated by means of UV-vis spectrophotometric titration, CD spectra. The association constants of D-amino acid methyl esters are found to be higher than those of their L-enantiomer. The sandwich-type binding of BaZn2L(ClO4)2-DABCO supramolecular assembly was specially studied via 1H NMR titration and 1H ROESY. To understand the recognition on molecular level, density functional theory (DFT) calculations on B3LYP/LanL2DZ were performed on the minimal energy conformations of host, guests, and host-guest complexes. The minimal energy conformations were obtained by molecular mechanics (MM) optimization and molecular dynamics (MD) simulation. The results of single point energy, HOMO energy, and charges transfer were analyzed. The results of theoretical calculations are in good agreement with the experimental data. 相似文献
49.
主客观相结合眼波面像差分析系统 总被引:1,自引:0,他引:1
利用Hartmann-Shack波面传感器对眼出瞳位置的波面像差进行测量,根据所测像差控制可变形镜对像差进行实时补偿.眼像差以Zernike多项式表示,通过对可变形镜的精确控制,可在光路中生成特定模式和幅值的像差.因此,被测者根据视觉的主观感觉,调节视标像差,直至获得最满意的视觉效果.该系统采用移动三棱镜和柱镜的方法对离焦和散光进行预补偿,弥补了波面传感器测量范围和可变形镜矫正范围受限制的缺点.该系统把快速、客观的测量及补偿和主观调整相结合,更加符合人眼工作的特性,可用于在人眼像差与视觉分辩的基础和临床研究. 相似文献
50.