Solutions of a class of Hamiltonian elliptic systems in

We study the existence of ground state solutions for the following elliptic systems in R^N

where b=(b₁,…,b_N) is a constant vector and HC¹(R^N×R²,R) is nonperiodic in variables x and super-quadratic as |z|→∞. By a recent critical point theorem for strongly indefinite problem, we obtain the existence of at least one ground state solution.     

Continuous liquid-liquid extraction combined on-line with capillary gas chromatography-atomic emission detection for environmental analysis

The on-line coupling of a liquid-liquid extraction system with capillary gas chromatography using atomic emission detection (GC-AED) has been studied. The required large volumes of about 100 μl of an iso-octane solution can be introduced into the GC-AED system by using the AED solvent vent and a solvent vapor exit in front of the capillary analytical column. Test solutions containing several pesticides were detected using the carbon, chlorine, nitrogen and sulfur channels. Analyte detectability (in concentration units) was improved significantly and low concentractions of the test compounds could be determined (1–5 ng/ml). Aqueous samples were on-line extracted and analyzed. The precision of the large-volume injection itself as well as the total extraction-GC-AED system was satisfactory (RSD of ca. 2 and 4%, respectively). As a real-life application, several ground water samples were screened.     

Membrane-assisted solvent extraction of seven phenols combined with large volume injection-gas chromatography-mass spectrometric detection

Membrane-assisted solvent extraction (MASE) was applied for the determination of seven phenols (phenol, 2-chlorophenol, 2,4-dimethylphenol, 2,4-dichlorophenol, 4-chloro-3-methylphenol, 2,4,6-trichlorophenol and pentachlorophenol) with log Kow (octanol-water-partition-coefficient) between 1.46 (phenol) and 5.12 (pentachlorophenol) in water. The extraction solvents cyclohexane, ethyl acetate and chloroform were tested and ethyl acetate proved to be the best choice. The optimisation of extraction conditions showed the necessity of adding 5 g of sodium chloride to each aqueous sample to give a saturated solution (333 g/L). The pH-value of the sample was adjusted to 2 in order to convert all compounds into their neutral form. An extraction time of 60 min was found to be optimal. Under these conditions the recovery of phenol, the most polar compound, was 11%. The recoveries of the other analytes ranged between 42% (2-chlorophenol) and 98% (2,4-dichlorophenol). Calibration was performed using large volume injection (100 microL injection volume). At optimised conditions the limits of detection were between 0.01 and 0.6 microg/L and the relative standard deviation (n = 3) was on average about 10%. After the method optimisation with reagent water membrane-assisted solvent extraction was applied to two contaminated ground water samples from the region of Bitterfeld in Saxony-Anhalt, Germany. The results demonstrate the good applicability of membrane-assisted solvent extraction for polar analytes like phenols, without the necessity of derivatisation or a difficult and time-consuming sample preparation.     

Determination of triazine compounds in ground water samples by micellar electrokinetic capillary chromatography

In this work, a capillary electrophoresis (CE) method for the determination of a group of eleven triazine compounds by micellar electrokinetic capillary chromatography (MEKC) with diode array detection was developed. The eleven herbicides studied were: desethylatrazin-2-hydroxy (DEA), simazine, prometon, atrazine, simetryn, ametryn, propazine, prometryn, trietazine, terbutylazine, and terbutryn The separation of these compounds was optimised as a function of buffer concentration and pH, concentration of sodium dodecyl sulphate (SDS) and voltage applied. To increase the selectivity of the separation and the resolution of the solutes, different organic solvents were tested as buffer additives, obtaining the best results when 1-propanol was used. The optimised buffer (24 mM of sodium borate, 18 mM of disodium hydrogen phosphate, 25 mM of SDS, pH 9.5, and 5% of 1-propanol) provides the best separation in terms of resolution and migration time. This method allowed the determination of these compounds at concentrations of 0.05 μg l⁻¹ in ground water samples pretreated using solid-phase extraction (SPE).     

On phase segregation in nonlocal two-particle Hartree systems

We prove the phase segregation phenomenon to occur in the ground state solutions of an interacting system of two self-coupled repulsive Hartree equations for large nonlinear and nonlocal interactions. A self-consistent numerical investigation visualizes the approach to this segregated regime.      

Instability of standing waves for Klein-Gordon-Zakharov equations with different propagation speeds in three space dimensions

This paper is concerned with the standing wave for Klein-Gordon-Zakharov equations with different propagation speeds in three space dimensions. The existence of standing wave with the ground state is established by applying an intricate variational argument and the instability of the standing wave is shown by applying Pagne and Sattinger's potential well argument and Levine's concavity method.     

三-(2-苯基吡啶)-铱及其衍生物电子结构、电子光谱及取代基效应的密度泛函理论研究

采用密度泛函理论(DFT)B3LYP/LanL2dz方法,对一类重要的磷光材料三-(2-苯基吡啶)-铱[Ir(ppy)₃]及其衍生物的电子结构与电子光谱进行了研究,讨论了取代基对配合物的能级和LUMO-HOMO能隙的影响,发现吸电子基(-CN)使能级降低,HOMO-LUMO之间能隙减小,而推电子基(-OCH₃)使能级升高,HOMO-LUMO之间能隙变化不大.     

西安地裂缝活动趋势分析

西安地裂缝的形成及活动主要受构造活动及人类活动因素影响, 而近来地裂缝的超常活动主要与过量抽取地下水引起的地面不均匀沉降有关。根据对抽水及地面荷载引起地层压密固结过程的分析、地下水位变化趋势的分析以及应用 Ver-hulst模型计算、预测结果, 西安地裂缝的强烈活动将有减缓或逐渐稳定的趋势。有关地裂缝活动的最新实际监测数据已显示出一些相应的征兆。     

临汾地面沉降数值模拟及其与地裂缝灾害关系研究

临汾市区是继西安、大同等地区之后又一地裂缝灾害比较严重的地区, 已经严重影响着临汾市经济的可持续性发展。经研究表明, 地下水超采为影响该区地裂缝灾害的第二大因子, 它是通过地面沉降来促使地裂缝的形成和发展。本文通过对临汾市区地面沉降进行数值模拟, 总结出了地面沉降的变化规律。分析认为, 地裂缝灾害的易出现部位为沉降梯度陡变带, 即沉降梯度最大处。     

Classification of VxOyq Clusters by △=2y+q-5x

Vanadium oxide clusters V_xO_y^q (x≤8, q=0,±1) are classified according to the oxidation index (△=2y+q-5x) of each cluster. Density functional calculations indicate that clusters with the same oxidation index tend to have similar bonding characters, electronic structures, and reactivities. This general rule leads to the findings of new possible ground state struc-tures for V₂O₆ and V₃O₆⁺ clusters. This successful application of the classification method on vanadium oxide clusters proves that this method is very effective in studying the bonding properties of early transition metal oxide clusters.