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941.
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利用基于多组态Dirac-Fock(MCDF)方法的原子结构性质计算程序包GRASP 2K,在考虑和不考虑相对论效应的情况下,分别计算了超铀元素镎的外壳层电子轨道波函数和轨道束缚能,分析了相对论效应对轨道波函数以及束缚能的影响,并讨论了相对论效应对锕系元素原子半径收缩的影响. 相似文献
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947.
Sheng-Li Chen Haitao Wang Guimei Yuan Zhiqing Wang Zhi Cai 《Transition Metal Chemistry》2011,36(4):441-445
Macro-/mesoporous Al2O3 supports were prepared by using monodisperse polystyrene (PS) microspheres as a template. The pore volume and BET surface
area of the Al2O3 supports increased considerably with increasing amounts of the PS microspheres; further investigation showed that PS template
only increased the volume of macro-pores but did not change the volume of meso-pores or micro-pores. Macro-/mesoporous Re2O7/Al2O3 metathesis catalysts were prepared through loading Re2O7 onto the as-prepared macro-/mesoporous Al2O3 supports, and their catalytic performance was tested in a fixed-bed tubular reactor using the metathesis of normal butylenes
as a probe reaction. The results showed that the prepared macro-/mesoporous Re2O7/Al2O3 catalyst had high activity with consistent selectivity; propylene and pentene accounted for more than 90 wt% of the metathesis
products, while the amount of ethylene plus hexane was less than 10 wt%, the majority of which was hexane. These Re2O7/Al2O3 catalysts had not only higher activity, but also longer working life span and higher tolerance to carbon residues than conventional
Re2O7/Al2O3 catalysts. 相似文献
948.
Ran X Zhang P Qu S Wang H Bai B Liu H Zhao C Li M 《Langmuir : the ACS journal of surfaces and colloids》2011,27(7):3945-3951
We studied hydrogen-bonding assemblies in a series of dumbbell-shaped hydrazine derivatives, namely oxalyl N',N'-bis(3,4-dialkoxybenzoyl)-hydrazide (BFH-n, n = 4, 6, 8, 10) and oxalyl N',N'-dibenzoyl-hydrazide (FH-0). It has been demonstrated that NH-1 protons of BFH-n precipitated from tetrahydrofuran (THF) or dimethylformamide (DMF) were involved in intramolecular H-bonding to form 6-membered rings. Meanwhile, NH-2 protons of BFH-n precipitated from THF formed intermolecular hydrogen bonds with C═O groups of neighboring molecules, while NH-2 protons of BFH-n precipitated from DMF formed intermolecular hydrogen bonds with C═O group of neighboring DMF molecules. C═O, -CH(3), and -CH groups of DMF molecules participated in multiple intermolecular hydrogen bonds with the -N-H and -C═O groups of FH-0 molecules in single-crystals formed in DMF, leading to a double helix morphology with a pitch of 24.2 ? along the c direction. Both left- and right-handed helical micrometer-length ribbons with nonuniform helical pitches were observed in an achiral BFH-10 xerogel precipitated from DMF. 相似文献
949.
Cheng M Gao H Zhang Y Tremel W Chen JF Shi F Knoll W 《Langmuir : the ACS journal of surfaces and colloids》2011,27(11):6559-6564
The formation of ordered complex structures is one of the most challenging fields in the research of biomimic materials because those structures are promising with respect to improving the physical and mechanical properties of man-made materials. In this letter, we have developed a novel approach to fabricating complex structures on the mesoscale by combining magnetic-field-induced locomotion and supramolecular-interaction-assisted immobilization. We have employed a magnetic field to locomote the glass fiber, which was modified by the layer-by-layer self-assembly of magnetic nanoparticles, to desired positions and have exploited the supramolecular interaction to immobilize glass fiber onto the appointed position. By magnetically induced micromanipulation, we can drive another fiber across the former one and finally obtain a crossing structure, which can lead to more complex structures on the mesocale. Moreover, we have constructed a mesoscale structure, termed "CHEM", to demonstrate further the application of this method. 相似文献
950.
结合方差分析(ANOVA)和偏最小二乘法判别分析(PLS-DA)两种分析技术,对素食和普食人群的尿液1H NMR谱进行分析.利用ANOVA方法将数据矩阵分解为几个独立因素矩阵,滤除干扰因素后,再利用PLS-DA对单因素数据进行建模分析.实验结果表明,ANOVA/PLS-DA方法可以有效地减少饮食因素和性别因素之间的相互... 相似文献