Inverse modeling of multicomponent reactive transport through single and dual porosity media

Compacted bentonite is foreseen as buffer material for high-level radioactive waste in deep geological repositories because it provides hydraulic isolation, chemical stability, and radionuclide sorption. A wide range of laboratory tests were performed within the framework of FEBEX (Full-scale Engineered Barrier EXperiment) project to characterize buffer properties and develop numerical models for FEBEX bentonite. Here we present inverse single and dual-continuum multicomponent reactive transport models of a long-term permeation test performed on a 2.5 cm long sample of FEBEX bentonite. Initial saline bentonite porewater was flushed with 5.5 pore volumes of fresh granitic water. Water flux and chemical composition of effluent waters were monitored during almost 4 years. The model accounts for solute advection and diffusion and geochemical reactions such as aqueous complexation, acid-base, cation exchange, protonation/deprotonation by surface complexation and dissolution/precipitation of calcite, chalcedony and gypsum. All of these processes are assumed at local equilibrium. Similar to previous studies of bentonite porewater chemistry on batch systems which attest the relevance of protonation/deprotonation on buffering pH, our results confirm that protonation/deprotonation is a key process in maintaining a stable pH under dynamic transport conditions. Breakthrough curves of reactive species are more sensitive to initial porewater concentration than to effective diffusion coefficient. Optimum estimates of initial porewater chemistry of saturated compacted FEBEX bentonite are obtained by solving the inverse problem of multicomponent reactive transport. While the single-continuum model reproduces the trends of measured data for most chemical species, it fails to match properly the long tails of most breakthrough curves. Such limitation is overcome by resorting to a dual-continuum reactive transport model.     

Mixing-controlled biodegradation in a toluene plume--results from two-dimensional laboratory experiments

Various abiotic and biotic processes such as sorption, dilution, and degradation are known to affect the fate of organic contaminants, such as petroleum hydrocarbons in saturated porous media. Reactive transport modeling of such plumes indicates that the biodegradation of organic pollutants is, in many cases, controlled by mixing and therefore occurs locally at the plume's fringes, where electron donors and electron-acceptors mix. Herein, we aim to test whether this hypothesis can be verified by experimental results obtained from aerobic and anaerobic degradation experiments in two-dimensional sediment microcosms. Toluene was selected as a model compound for oxidizable contaminants. The two-dimensional microcosm was filled with quartz sand and operated under controlled flow conditions simulating a contaminant plume in otherwise uncontaminated groundwater. Aerobic degradation of toluene by Pseudomonas putida mt-2 reduced a continuous 8.7 mg L(-1) toluene concentration by 35% over a transport distance of 78 cm in 15.5 h. In comparison, under similar conditions Aromatoleum aromaticum strain EbN1 degraded 98% of the toluene infiltrated using nitrate (68.5+/-6.2 mg L(-1)) as electron acceptor. A major part of the biodegradation activity was located at the plume fringes and the slope of the electron-acceptor gradient was steeper during periods of active biodegradation. The distribution of toluene and the significant overlap of nitrate at the plume's fringe indicate that biokinetic and/or microscale transport processes may constitute additional limiting factors. Experimental data is corroborated with results from a reactive transport model using double Monod kinetics. The outcome of the study shows that in order to simulate degradation in contaminant plumes, detailed data sets are required to test the applicability of models. These will have to deal with the incorporation of existing parameters coding for substrate conversion kinetics and microbial growth.     

人群疏散行为仿真技术研究

提出并建立了一种人群疏散仿真模型。针对疏散空间中障碍物的动态布局,采用网格法获得各障碍物包围盒坐标,依据最短路径原则采用几何法确定每个个体起始疏散路径,解决了人群疏散的空间连续性问题。针对人群疏散时个体之间的差异性,依据个体与个体之间的作用力、摩擦力动态改变个体的行进方向,以及依据人群密度采用人群疏散速度模型实时确定每个个体的运动速度,解决了个体之间的动态避碰、绕行和超越等问题。针对人群疏散时多个出口的选择问题,提出了把出口拥挤状态与个体心理慌乱状态相结合的出口选择方法。最后采用粒子系统实现了上述人群疏散行为的二维仿真并取得了较好的效果。     

建筑火灾烟气中CO迁移规律的FDS模拟

以T型"侧间-走廊"典型建筑火灾为模拟对象,分析烟气在走廊中的水平和垂直流动特征,并对火源房门高低、走廊端头启闭和多房门启闭等场景使用火灾模拟软件(FDS)进行了模拟和远距离房间CO浓度的迁移规律的分析。结果表明:烟气从火源房间经拱腹溢出在走廊中形成受限空间的顶棚射流;门檐高度决定了CO能够在走廊中的迁移量;烟气在走廊远距离封闭端头形成上部的热烟气层,中部回流层和下层的补气层;其中中部烟气回流层的高低、流速和CO浓度是影响临近非火源房间CO浓度的重要因素。走廊启闭和多房门火灾场景的模拟结果也进一步证明了CO的迁移规律。     

基于模糊层次综合法的炼铁厂评价模型及应用研究

运用模糊层次综合评价法建立炼铁厂安全评价的模型,该模型能有机地将炼铁厂的安全管理、设备设施、人员和环境等因素结合起来,依据各因素对系统安全影响的大小,决策者可对其采取相应的改进措施以有效地控制事故的发生。通过对炼铁厂安全性的分析,其评价结果和现实情况基本相符,能较为全面反映整个系统的安全性和各因素对系统安全性的影响大小,为炼铁厂的安全评价提供了一种有效的综合评价方法。     

矿井瓦斯煤尘爆炸传播数值模拟研究

基于连续相、燃烧、颗粒相数理方程建立瓦斯煤尘爆炸传播数理模型,并应用连续相、颗粒相计算方法,依据大型巷道瓦斯爆炸、瓦斯煤尘爆炸传播实验数据,借助普遍应用的流场模拟平台,成功开发瓦斯、煤尘爆炸数值模拟系统。该系统可有效地模拟煤矿瓦斯、煤尘的爆炸事故过程,对瓦斯爆炸的爆燃转爆轰、煤尘是否参与爆炸、爆炸冲击传播速度、衰减规律以及爆炸灾害的波及范围都能进行较准确的模拟。     

商业区与轻轨站厅开口处防火分隔失效时人员安全疏散评估

针对相连接部位开口处的防火分隔失效时人员能否安全疏散进行评估,研讨人员安全疏散评估过程中所采用的定性分析和定量分析方法。以某商场与轻轨站相连接开口处为例,考察当防火分隔耐火性能失效后,商场内人员和轻轨站的人员能否从火灾中得以安全疏散;通过火灾模拟的方法,采用BuildEvac和FDS软件分别对火灾时人员疏散状况和火灾烟气的蔓延情况进行人员疏散模拟和火灾烟气运动模拟。根据模拟计算结果,对商场内人员和轻轨站人员的安全性进行详细分析和讨论,从而得出实例评估结论:当排烟系统正常工作时,即使防火分隔(防火卷帘)失效,火场环境对商业区和轻轨站的人员生命安全在整个疏散过程中均不会构成威胁,所有人员都能安全疏散到安全地点。     

基于社会科学统计程序(SPSS)回归性分析的尾矿库事故预测模型

基于社会科学统计程序(SPSS)软件的分析功能,对调查研究中获取的尾矿库案例进行数据提炼和分类编码,找出相关因子并进行回归性分析。最终目的是找出尾矿库各个因素的内在联系,建立简单的尾矿库事故模型,从而可以初步预测尾矿库事故发生的可能性。该预测模型为尾矿库事故的研究提出了新方法,对于防灾减灾以及保护人民生命财产安全起到了积极作用。     

边坡变形时序非线性判定及混沌预测研究

以探讨边坡变形性质及混沌预测可行性为目的,基于混沌理论利用相空间重构技术对其变形时间序列进行混沌特征判定,试验显示变形系统具有混沌特性,可用混沌相关理论进行研究;基于混沌相空间重构技术,笔者构建了多种混沌预测模型进行混沌预计研究,分析各类模型的工程实际应用效果;针对单次监测时序预测精度较低的问题,提出累加时序预测方案,训练结果显示,短期预测精度变形累计值基本控制在5%以内,高程值预测相对误差均低于1%,预测精度较高,可以用于工程实际。     

出口角度对防烟空气幕防烟效果影响的数值模拟

利用火灾动力学模拟软件FDS,以四川消防研究所高层实验塔二层为原型,模拟在不同防烟空气幕出口角度情况下高层建筑前室烟气运动情况,获得在其他条件不变情况下,空气幕运行时的最佳出口角度。试验结果表明:空气幕角度为5°及20°时,模拟试验后期烟气基本突破了空气幕蔓延至前室内,而当出口角度为10°和15°时防烟效果较好,且15°时防烟效果优于10°,故推荐空气幕运行时的最佳出口角度为15°。