Efficient adaptive phase field simulation of directional solidification of a binary alloy

Efficient adaptive phase field simulation based on a finite volume method is carried out to study the morphological development during directional solidification of a nickel/copper alloy. The adaptive nature of the method allows the calculation to cover different length scales for the interface, solute diffusion, and heat conduction. With the frozen temperature approximation, our calculated results are in reasonable agreement with previous ones (J. Crystal Growth 200 (1999) 583). However, the use of a much larger domain allows us to perform simulation at low speed near the onset of constitutional supercooling, where both solutal boundary layer and cell wavelength are large. For the same domain size, the calculated results without using the frozen temperature approximation remain about the same, even though the release of latent heat lowers the steady interface position and the thermal gradient in the melt side.     

Effect of a premelted film on the dynamics of particle–solidification front interactions

Numerical simulations are performed to study the interaction of a solidification front with an embedded particle. A sharp-interface method is used to track both the phase boundary and the particle. The solidification front dynamics is fully coupled with particle motion. The main objective of the paper is to distinguish the role played by the premelted layer between the solidification front and the particle in determining conditions for particle engulfment. Results are obtained by assuming a premelted layer exists in the gap between the particle and the solidification front and compared to those assuming no premelted layer. In the absence of a premelted layer, arbitrary cut-off values for particle-front gap thickness need to be invoked in order to define the critical velocity for which the pushing–engulfment transition occurs. When a premelted layer is assumed to exist, the prediction of the critical velocity is determined solely from the dynamics of the coupled front–particle interaction. In addition, model predictions for the critical velocity based on a steady-state heat transfer analysis are shown to differ from that when the full dynamics of the phase boundary are taken into account.     

染料敏化太阳电池用聚合物电解质

综述了本研究小组近年来用于染料敏化太阳电池中聚合物电解质的研究概况.设计合成了几类性能优良的聚合物电解质,较好地改进了液体电解质染料敏化太阳电池(DSSC)的使用稳定性,研究结果具有实际应用的价值,并提出了此领域研究今后的发展方向.     

Deep eutectic solvent-based modified quick,easy, cheap,effective, rugged,and safe extraction combined with solidification of floating organic droplet-dispersive liquid–liquid microextraction of some pesticides from canola oil followed by gas chromatography analysis

Herein, a modified quick, easy, cheap, effective, rugged, and safe extraction was developed based on deep eutectic solvent for the extraction of several pesticides from canola oil samples. In this work, first, different sorbents were selected to remove the sample interferences, and the composition of the sorbents was optimized by simplex centroid design. The extracted analytes were more concentrated by solidification of floating deep eutectic solvent droplet-dispersive liquid–liquid microextraction. Low limits of detection (0.15–0.23 ng/g) and quantification (0.49–0.76 ng/g), high extraction recoveries (74–87%) and enrichment factors (224–263), and good repeatability (relative standard deviation equal to or less than 5.1 and 4.7% for intra- and interday precisions, respectively) were achieved using the proposed method. The suggested approach was used for the quantification of the analytes in different canola oil samples. Additionally, the effects of microwave irradiations exposure and sonication in decontamination of the samples were evaluated. In this method, there was no need for centrifugation and toxic solvents. Also, effective extraction of the analytes and minimizing interferences were achieved through the use of various sorbents.     

Dispersive liquid–liquid microextraction based on solidification of floating organic droplet for the determination of triazine and triazoles in mineral water samples

A simple, rapid, and sensitive method for the determination of atrazine, simazine, cyproconazole, tebuconazole, and epoxiconazole in mineral water employing the dispersive liquid–liquid microextraction with solidification of a floating organic drop with determination by liquid chromatography tandem mass spectrometry has been developed. A mixed solution of 250 μL 1‐dodecanol and 1250 μL methanol was injected rapidly into 10 mL aqueous solution (pH 7.0) with 2% w/v NaCl. After centrifugation for 5 min at 2000 rpm, the organic solvent droplets floated on the surface of the aqueous solution and the floating solvent solidified. The method limits of detection were between 3.75 and 37.5 ng/L and limits of quantification were between 12.5 and 125 ng/L. The recoveries ranged from 70 to 118% for repeatability and between 76 and 95% for intermediate precision with a relative standard deviation from 2 to 18% for all compounds. Low matrix effect was observed. The proposed method can be successfully applied in routine analysis for determination of pesticide residues in mineral water samples, allowing for monitoring of triazine and triazoles at levels below the regulatory limits set by international and national legislations.     

CALCULATION OF THE YOUNG’S MODULUS OF AN ADSORBED POLYMER LAYER

 Polymer layers adsorbed to a surface or in a confined environment often change their mechanical properties. There is even the possibility of solidification of the confined layer. To judge the stiffness of such a layer, we used the Hertz model to calculate the Young’s modulus of the polymer layer in the confinement of AFM experiments with silicon nitride tip with a radius of curvature of R » 50 nm and a glass sphere attached to the cantilever R = 5 mm. Since there is no visible indentation of the layer in the AFM experiments, the layer is either penetrated very easily, or the indentation is too small to be seen in a force curve. The latter would be the case for a polymer layer with a Young’s modulus above 4 ´ 10⁸ Pa in case of an experiment with a silicon nitride tip and 4 ´ 10⁵ Pa in case of a glass sphere.     

高分子凝聚态的若干基本物理问题研究

本项目在高分子凝聚态的研究中取得了许多重要成果,并提出了若干新概念。主要创新点有高分子单链凝聚态（单链玻璃态和单链单晶）、高分子链的凝聚缠结、分子链大尺度高度取向而小尺度无规取向的非晶态、动态接触浓度C8、固化诱发条带织构等。     

Numerical simulation of thermal problems coupled with magnetohydrodynamic effects in aluminium cell

A system of partial differential equations describing the thermal behavior of aluminium cell coupled with magnetohydrodynamic effects is numerically solved. The thermal model is considered as a two-phases Stefan problem which consists of a non-linear convection–diffusion heat equation with Joule effect as a source. The magnetohydrodynamic fields are governed by Navier–Stokes and by static Maxwell equations. A pseudo-evolutionary scheme (Chernoff) is used to obtain the stationary solution giving the temperature and the frozen layer profile for the simulation of the ledges in the cell. A numerical approximation using a finite element method is formulated to obtain the fluid velocity, electrical potential, magnetic induction and temperature. An iterative algorithm and 3-D numerical results are presented.     

Measuring the solidification time of silicone rubber using optical inspection technology

A room temperature vulcanization silicone rubber was widely used as the mold making material due to its high elasticity, good heat-resistance and low surface energy. To enhance the efficiency of making the silicone rubber mold, accurately measuring the solidification time is an important issue. This study demonstrated a non-invasive measurement system to measure the solidification time of silicone rubber. The solidification time can be determined rapidly from the thickness of silicone rubber according to the predicted equation. The maximum relative error of the predicted equation is about 8.26%. The temperature rise of the silicone during the solidification process is an important phenomenon to determine the solidification behavior of silicone rubber. The solidification mechanism of silicone rubber mold is demonstrated.