Viscosity Mixing Rules for Binary Systems Containing One Ionic Liquid

In this work the applicability of four of the most commonly used viscosity mixing rules to [ionic liquid (IL)+molecular solvent (MS)] systems is assessed. More than one hundred (IL+MS) binary mixtures were selected from the literature to test the viscosity mixing rules proposed by 1) Hind (Hi), 2) Grunberg and Nissan (G–N), 3) Herric (He) and 4) Katti and Chaudhri (K–C). The analyses were performed by estimating the average (absolute or relative) deviations, AADs and ARDs, between the available experimental data and the predicted ideal mixture viscosity values obtained by means of each rule. The interaction terms corresponding to the adjustable parameters inherent to each rule were also calculated and their trends discussed.     

Ion beam mixing of α-MoSi2

Abstract

Using molecular dynamics simulation, we study the mixing of an α-MoSi₂ crystal by 1 keV Ar ions. The observed order of magnitude of the mixing is compatible with a spike model of ion beam mixing. The influence of the target surface and of chemical effects are discussed.     

用于单分子动力学实验的微流控混合器

设计制作了用于单分子动力学实验的微流控混合器, 该混合器用聚二甲基硅氧烷(PDMS)芯片和石英载玻片密封而成, 具有低的荧光背景, 广泛的生物相容性, 结合激光共聚焦显微镜能够在非平衡态下进行单分子荧光探测. 我们设计的压力控制系统和进样流路方便而稳定, 保证了微流路中流形的长时间稳定, 从而实现了样品流速和流量的精准控制. 这些技术特点保证了单分子探测得到准确和高信噪比的结果. 利用蛋白质的塌缩过程远快于混合过程的特点,采用荧光标记的金黄色葡萄球菌核酸酶作为指示物,分辨出蛋白质变性态的特征峰,并利用变性态的荧光共振能量传递效率随时间的变化表征出混合器在适合于单分子探测条件下的混合时间为150 ms.     

A Single-Atom Manipulation Approach for Synthesis of Atomically Mixed Nanoalloys as Efficient Catalysts

Synthesis of well-defined atomically mixed alloy nanoparticles on desired substrates is an ultimate goal for their practical application. Herein we report a general approach for preparing atomically mixed AuPt, AuPd, PtPd, AuPtPd NAs(nanoalloys) through single-atom level manipulation. By utilizing the ubiquitous tendency of aggregation of single atoms into nanoparticles at elevated temperatures, we have synthesized nanoalloys on a solid solvent with CeO₂ as a carrier and transition-metal single atoms as an intermediate state. The supported nanoalloys/CeO₂ with ultra-low noble metal content (containing 0.2 wt % Au and 0.2 wt % Pt) exhibit enhanced catalytic performance towards complete CO oxidation at room temperature and remarkable thermostability. This work provides a general strategy for facile and rapid synthesis of well-defined atomically mixed nanoalloys that can be applied for a range of emerging techniques.     

Direct Derivation of Free Energies of Membrane Deformation and Other Solvent Density Variations From Enhanced Sampling Molecular Dynamics

We report a methodology to calculate the free energy of a shape transformation in a lipid membrane directly from a molecular dynamics simulation. The bilayer need not be homogeneous or symmetric and can be atomically detailed or coarse grained. The method is based on a collective variable that quantifies the similarity between the membrane and a set of predefined density distributions. Enhanced sampling of this “Multi-Map” variable re-shapes the bilayer and permits the derivation of the corresponding potential of mean force. Calculated energies thus reflect the dynamic interplay of atoms and molecules, rather than postulated effects. Evaluation of deformations of different shape, amplitude, and range demonstrates that the macroscopic bending modulus assumed by the Helfrich–Canham model is increasingly unsuitable below the 100-Å scale. In this range of major biological significance, direct free-energy calculations reveal a much greater plasticity. We also quantify the stiffening effect of cholesterol on bilayers of different composition and compare with experiments. Lastly, we illustrate how this approach facilitates analysis of other solvent reorganization processes, such as hydrophobic hydration. Published 2019. This article is a U.S. Government work and is in the public domain in the USA.     

Solid Particle Distribution in Centrifugal Impeller Contactors

The recently developed centrifugal impeller is examined to investigate the solid–liquid mixing in a mechanically agitated contactor. Using the sample withdrawal method, the effects of impeller geometrical parameters, impeller rotational speed (200–700 rpm), solid particle size (500–1100 µm), and solid loading (2–10 vol%) on the degree of homogeneity are studied. The axial and the radial solid concentration profiles and the minimum impeller speed for the complete homogenization are also determined. In comparison with a widely used propeller impeller, considerably higher homogeneity values in lower impeller speeds are obtained (90% homogeneity against 16% homogeneity at 200 rpm at the same conditions). Having also lower power consumption makes this a superior impeller in solid–liquid mixing processes especially in shear-sensitive systems.      

混凝土搅拌车搅拌筒磨损数值分析

混凝土运输过程中搅拌筒的磨损一直是一种常见潜在危害,磨损严重时会导致叶片失效,对搅拌的质量和出料匀质性产生影响。通过实验获取搅拌筒内部的磨损费时费力,因此有必要采取一种数值分析方法对搅拌筒的磨损进行预测并提出改进。本文采用摩擦磨损实验的方法来标定颗粒与搅拌筒之间的Archard磨损常数,采用JKR接触模型表征混凝土的流动性能,采用离散元方法(DEM)对搅拌筒筒体及叶片磨损进行预测分析。通过法向接触能量与切向接触能量的对比,证明搅拌筒中的磨损主要为伴有冲击作用的磨粒磨损,搅拌车搅拌筒中搅拌叶片顶部的磨损较为严重。针对磨损比较严重的叶片顶部进行改进,采用T型耐磨结构等改进叶片结构,叶片顶部结构改进后搅拌筒使用寿命能得到明显提升。     

二波混频高功率单频窄线宽光纤激光器

设计并制造了一种基于二波混频的高功率单频窄线宽光纤激光器.激光器采用长线形腔结构,以Er3+/Yb3+双包层光纤作为增益介质,利用输出信号光分束反馈注入,与腔内振荡激光混频干涉,形成分布的增益光栅与折射率光栅共同作用选模,获得稳定的1550.63 nm单频高功率激光输出.在975 nm多模激光二极管(LD)抽运下,激光...     

New approaches in computational dynamics of the mixing flow

Between the most mature interdisciplinary areas, computational fluid dynamics (CFD) comes recently into focus. In the same time, it becomes more and more difficult to contribute fundamental research to it. However, although it remains unpredictable how CFD develops, it is part of what makes it an exciting and attractive discipline.This paper aims to exhibit some part of recent work in CFD. It concerns the qualitative approach of the turbulent behaviour of a mixing flow in an excitable media. Studying a mixing for a flow implies the analysis of successive stretching and folding phenomena for its particles, the influence of parameters and initial conditions. In the previous works, the study of the 3D non-periodic models exhibited a quite complicated behaviour. In agreement with experiments, there were involved some significant events, the so-called “rare events”. The variation of parameters had a great influence on the length and surface deformations. The experiments were realized with a special vortex installation, it was used a well-known aquatic algae as biologic material, and the water as basic fluid.In the paper there are presented some features of a qualitative comparative analysis of the model associated to the vortex flow technology. In the computational analysis there were used the fast analysis tools of MAPLE11 soft, in order to check the “rare events” and to complete the statistical analysis of the behaviour of the model.