Pathline glyphs

Visualization of pathlines is common and highly relevant for the analysis of unsteady flow. However, pathlines can intersect, leading to visual clutter and perceptual issues. This makes it intrinsically difficult to provide expressive visualizations of the entire domain by an arrangement of multiple pathlines, in contrast to well‐established streamline placement techniques. We present an approach to reduce these problems. It is inspired by glyph‐based visualization and small multiples: we partition the domain into cells, each corresponding to a downscaled version of the entire domain. Inside these cells, a single downscaled pathline is drawn. On the overview scale, our pathline glyphs lead to emergent visual patterns that provide insight into time‐dependent flow behavior. Zooming‐in allows us to analyze individual pathlines in detail and compare neighboring lines. The overall approach is complemented with a context‐preserving zoom lens and interactive pathline‐based exploration. While we primarily target the visualization of 2D flow, we also address the extension to 3D. Our evaluation includes several examples, comparison to other flow visualization techniques, and a user study with domain experts.     

Critical evaluation of coupling particle size distribution with the shrinking core model

The shrinking core model (SCM) is widely used to model fluid-solid reactions such as the leaching of metals from minerals. In most cases, however, the particle size distribution (PSD) of the solid material was disregarded. In this paper the erroneous shift in the control regime when neglecting PSD was quantified and the dependence of the shift on the coefficients of variation (CV) and the type of PSD was analysed. By coupling the SCM with a Gamma PSD, it was found that neglecting the PSD would shift the control regime from chemical reaction to inert/ash layer diffusion, when the CV was between 0.7 and 1.2. For a system controlled by liquid film diffusion, neglect of the PSD, would shift the control regime to chemical reaction when CV is between 0.3 and 0.7 or to inert/ash layer diffusion when CV is greater (0.9-1.5). It was therefore postulated that some researchers had unknowingly made invalid conclusions about the control regime due to the neglect of PSD. However, an inert/ash layer diffusion-controlled process was insensitive to the neglect of PSD. When CV<0.3, neglect of the PSD would not cause any erroneous shifts, irrespective of the control regime. Experimental data confirmed the observation. For a given CV, the deviation in the fraction reacted from the mono-PSD increases with CV and decreases with time. The maximum deviation, which occurs at the beginning, is about 10% with a gamma PSD of CV=0.3. The percent deviation is dependent of the type of PSDs. Gamma PSD gives the lowest deviation while Gaudin-Schuhmann results in the largest deviation (maxi. ∼19%, with CV=0.3) in the first half of dissolution process. Log-normal distribution gives a larger deviation than gamma but quickly approaches the latter with time. The deviation for Rosin-Rammler is between log-normal and Gaudin-Schuhmann. For systems with CV less than 0.3, the SCM can be fairly used without considering PSD. When CV is greater than 0.3, particularly in the early stage of a dissolution process with a PSD other than gamma, PSD should be included to avoid substantial errors.     

A comprehensive approach to evaluating watershed models for predicting river flow regimes critical to downstream ecosystem services

Selection of strategies that help reduce riverine inputs requires numerical models that accurately quantify hydrologic processes. While numerous models exist, information on how to evaluate and select the most robust models is limited. Toward this end, we developed a comprehensive approach that helps evaluate watershed models in their ability to simulate flow regimes critical to downstream ecosystem services. We demonstrated the method using the Soil and Water Assessment Tool (SWAT), the Hydrological Simulation Program–FORTRAN (HSPF) model, and Distributed Large Basin Runoff Model (DLBRM) applied to the Maumee River Basin (USA). The approach helped in identifying that each model simulated flows within acceptable ranges. However, each was limited in its ability to simulate flows triggered by extreme weather events, owing to algorithms not being optimized for such events and mismatched physiographic watershed conditions. Ultimately, we found HSPF to best predict river flow, whereas SWAT offered the most flexibility for evaluating agricultural management practices.     

Pore network model of deactivation of immobilized glucose isomerase in packed-bed reactors II: three-dimensional simulation at the particle level

Immobilized glucose isomerase is widely used for converting glucose to fructose by enzymatic isomerization. The process takes place in a packed-bed reactor consisting of mesoporous particles with distributed pore sizes and interconnectivities. Its efficiency is, however, significantly affected by deactivation of the mesoporous particles. In this paper, we study deactivation of the mesoporous particles using a three-dimensional pore network model of the pore space with distributed pore sizes and interconnectivities, and investigate several plausible mechanisms of deactivation of the porous particles. The results of the present study, which will be used as the input for simulation of the phenomenon at the reactor level, demonstrates the strong effect of the particles’ morphology on the deactivation process.     

CPR1000核电站三废处理控制系统仿真测试技术应用

为实现工厂测试期间,能够最大限度地模拟核电厂三废系统的工艺设备,对三废控制系统（DCS）的组态逻辑正确性进行验证,通过结构化文本语者编写仿真测试程序,对现场的工艺设备的运行状态进行仿真模拟。同时选取对核电站硼回收系统（TEP）的1号除汽器的仿真测试,验证仿真测试程序的可行性,提出了一种低成本,高效率的测试方法。     

湿浸法制备活性组分非均匀分布负载型催化剂过程的计算机模拟

对活性组分非均匀分布的负载型催化剂的湿浸法制备过程进行了计算机模拟,其模拟程度可适用于任意多个活性组分的浸渍。发现单组分浸渍时,通过控制浸渍时间可获得活性组分由薄到厚的蛋壳型分布和均匀分布,但通过预浸渍吸附至一定分布后,再在空白溶液中浸渍洗脱,控制洗脱条件也可获得蛋黄、蛋白型的分布;加入竞争吸附剂,进行双组分及多组分浸渍,通过控制浸渍溶液性质及浸渍时间可获得各种类型的活性组分分布,诸如蛋壳型、蛋白型、蛋黄型和均匀型。通过对制备过程参数(如竞争吸附剂的选择、各组分有效扩散系数、初始浓度、吸脱附速率常数等)与活性组分分布形式之间关系的分析,可实现对任一分布形式的催化剂的制备过程参数的优化。这对实际制备催化剂具有指导意义。     

Errors associated with swelling in the analysis of polymer-solvent diffusion measurements

Sorption curves are generated from a mathematical model which includes the influence of the polymer swelling for unsteady-state sorption of a vapor or liquid by a polymer. To investigate the simultaneous effects of the specific volumes of the polymer-penetrant pair and the difference between the final and initial equilibrium concentrations on the sorption curves, statistical experimental design approach is used. Simulation results obtained from the numerical solution of model equations are utilized to estimate the error that would occur if one simply evaluates the diffusion coefficient using the traditional formulas derived from the analytical solution of the sorption equation. An empirical expression is developed that describes the effects of the difference between the final and initial equilibrium concentrations and the specific volumes of the polymer and the penetrant on the magnitude of error in diffusivity associated with the use of one of these traditional formulas so called the initial slope method. The predictive ability of the regression model is tested by performing additional simulations not used in the regression analysis.     

DynamicCloudSim: Simulating heterogeneity in computational clouds

Simulation has become a commonly employed first step in evaluating novel approaches towards resource allocation and task scheduling on distributed architectures. However, existing simulators fall short in their modeling of the instability common to shared computational infrastructure, such as public clouds. In this work, we present DynamicCloudSim which extends the popular simulation toolkit CloudSim with several factors of instability, including inhomogeneity and dynamic changes of performance at runtime as well as failures during task execution. As a validation of the introduced functionality, we simulate the impact of instability on scientific workflow scheduling by assessing and comparing the performance of four schedulers in the course of several experiments both in simulation and on real cloud infrastructure. Results indicate that our model seems to adequately capture the most important aspects of cloud performance instability. The source code of DynamicCloudSim and the examined schedulers is available at https://code.google.com/p/dynamiccloudsim/.