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101.
建立了处理双原子分子-表面相互作用的推广的LEPS势.借助推广的LEPS势,系统研究了一氧化碳分子在铂低指数表面吸附的动力学特性,重现了低指数表面的分子吸附热、吸附几何及本征振动等实验数据;鉴定了某些不合理的文献信息,预测了实验尚未探测到的重要信息:预测到Pt(100)表面四重洞位的C-O伸缩振动频率为1 962.60 cm-1;预测到Pt(110)表面吸附态的C-O及C-Pt键长分别为115.1、147 pm. 相似文献
102.
Single and binary adsorption behaviors of salicylic acid and 5-sulfosalicylic acid onto hypercrosslinked polymeric adsorbents, i.e. NDA-101 and NDA-99 were investigated. The Freundlich model can successfully describe all the adsorption isotherms tested, which indicates a favorable and exothermic adsorption process. The adsorption of salicylic acid relies on π-π interaction, while the electrostatic interaction further influences the adsorption of 5-sulfosalicylic acid onto NDA-99. The adsorptive capacity of salicylic acid on NDA-99 decreases but increases on NDA-101 with 5-sulfosalicylic acid as the background component in a binary solute system. The amount of 5-sulfosalicylic acid adsorbed was decreased with the increase in initial concentration of salicylic acid on both adsorbents. The competition for the adsorption sites is considered to be predominant in the solid-to-liquid interaction process. The adsorption selectivity of salicylic acid onto NDA-101 is higher than onto NDA-99 by more than an order of magnitude. Thus, combination technique involving NDA-101 followed by NDA-99 can be effectively applied to separate and recover salicylic acid and 5-sulfosalicylic acid from wastewater. 相似文献
103.
Let be a Kähler surface and be a -symplectic critical surface in . If is bounded for some , then we give a uniform upper bound for the Kähler angle on . This bound only depends on and the functional of . For , this estimate is known and we extend the scope of . 相似文献
104.
Marc Soret 《Annals of Global Analysis and Geometry》1995,13(2):101-116
The main result of this paper is the following maximum principle at infinity:Theorem.Let M
1
and M
2
be two disjoint properly embedded complete minimal surfaces with nonempty boundaries, that are stable in a complete flat 3-manifold. Then dist(M
1,M
2)=min(dist(M
1,M
2), dist(M
2,M
1)).In case one boundary is empty, e.g. M
1,then dist(M
1,M
2)=dist(M
2,M
1).If both boundaries are empty, then M
1
and M
2
are flat. 相似文献
105.
We completely classify all the twistor holomorphic Lagrangian immersions in the complex projective plane 2, i.e. those Lagrangian immersions such that their twistor lifts to the twistor space over 2 are holomorphic. This classification provides a one-parameter family of examples of Lagrangian spheres in 2.Research partially supported by a DGICYT grant No. PB91-0731. 相似文献
106.
M. Bekkar 《Proceedings of the American Mathematical Society》1996,124(10):3077-3083
We establish the system of partial differential equations satisfied by the riemannian metrics on open subsets of which admit planes as minimal surfaces. This is a nonlinear system of 10 partial differential equations, with the euclidian metric as a particular solution. In a previous work, we solved this system for axially symmetrical metrics. In this paper we linearize the system at the euclidian metric and solve the linear system. We obtain a 20-dimensional space of solutions.
107.
The heat effects and the rates and equilibrium quantities of H2O vapour sorbed and desorbed on polymeric perfluorinated materials (functional groups -SO3H, -SC3Na, -SO3K) and on material treated with FeCl3 solution as sorbent were investigated.Sorbed H2O may be completely desorbed in vacuum at 443 K. The material bearing -SO3H has maximum sorption affinity: the molar heat of -SO3H wetting is close to that of H2SO4 wetting. The differential heat of sorption decreases from 68 kJ mol–1 atn0(n=H2O/-SO3H) to 45 kJ mol–1 atn5, but not below the heat of H2O condensation. The -SO3H samples sorb H2O vapour in the presence of liquid H2O at 293 K up ton=17. The -SO3K material has minimum affinity for H2O: the equilibrium quantity sorbed in room air is less by a factor of 4 than that for the -SO3H material. The spatial arrangement of H2O molecules near the sulpho groups is considered. 相似文献
108.
Limberg C 《Angewandte Chemie (International ed. in English)》2003,42(48):5932-5954
The oxo-functionalization of organic substrates with the aid of metal oxo moieties is of fundamental importance not only in nature but also in academic and industrial research. Nevertheless the corresponding reaction mechanisms remain among the most enigmatic in chemistry and few of them are understood in detail. Recent research efforts have resulted in significantly improved information: in the cases of many oxygenation reactions evidence has been provided for the occurrence radical intermediates, even though the high selectivity observed suggests to a different mechanism. Examples stem from various areas of chemistry and include processes involving molecular metal oxo complexes, gas-phase and matrix-isolated species, metalloenzymes, and solid-state oxide surfaces. This review treats this seemingly wide variety of systems with the aim of providing an overview of common reactivity patterns and principles, as well as open problems. 相似文献
109.
V. M. Tapilin 《Journal of Structural Chemistry》2005,46(1):9-15
Electronic structure calculations have been performed for flat graphite sheets and periodically distorted sheets with different values of deformation angle and hydrogen adsorption. These characteristics do not all behave monotonically with increasing deformation angle. At small deformation angles, the electrons pass from the atoms of terraces to those of edges, while at larger angles the reverse pattern is observed. The position of the Fermi level also varies nonmonotonically. The binding energy of hydrogen depends significantly on the adsorption site, and the difference can be doubled. Based on the ata obtained, it was concluded that a priori statements derived from the “general concepts” on the difference in the physicochemical properties of, for example, terrace and edge atoms on high-index facets are unreliable. 相似文献
110.
Seven polystyrene-type adsorbents (Ⅰ—Ⅶ) were synthesized by the modification of styrene-divinylbenzene copolymer respectively with hydroxymethyl, aminomethyl, methoxymethyl, phenoxymethyl, (4-hydroxy phenoxy)methyl, (4-acetylphenoxy)methyl, and acetyl groups. Their structures were characterized with chemical methods and physical techniques. The adsorption capacities of the adsorbents to stevioside and gypenosides were determined via batch test in which the HPLC method was used for the analysis of Saponin concentration of solution. The results showed that all the adsorbents could adsorb these saponins to a certain extent, but Ⅵ and Ⅶ had large capacities owing to their moderate polarities. 相似文献