Hazard evaluation for chlorination and amination reactions of fluorocytosine production process

Reaction thermal runaway is one of the most important reasons leading to chemical accidents. With the rapid development of the chemical industry in the world, especially the fine chemical industry, various safety accidents also occur frequently. Therefore, it is necessary to study the exothermic behavior of the reaction process. In this study, reaction calorimeter was used to study the exothermic phenomena during the chlorination reaction and amination reaction. Differential scanning calorimetry was performed on the reactants, and thermogravimetric experiments were performed on the products. In addition, adiabatic experiment was performed to study the thermal runaway behavior of amination products under adiabatic conditions. The results showed that the target reactions generated a large amount of heat in the initial stage. The maximum temperature of amination reaction is higher than the initial decomposition temperature of the amination product under adiabatic condition. The pyrolysis of amination product was divided into three stages. The product had a high apparent activation energy at the beginning of decomposition, and the apparent activation energy decreased as the decomposition progressed.     

Effects of nitrogen and carbon dioxide on hydrogen explosion behaviors near suppression limit

By varying inert gas content, equivalence ratio and initial pressure, this study is aimed at investigating flame propagation behaviors and explosion pressure characteristics near suppression limit. For carbon dioxide, the weakest flame floating phenomenon is observed at Φ = 1.5 and the buoyant instability is enhanced when the equivalent ratio deviates to the rich and lean sides. For nitrogen, the buoyant instability decreases with increasing equivalent ratio. Both maximum explosion pressure and maximum pressure rise rate increase firstly and then decrease with the increase of equivalence ratio, and they decrease significantly with increasing content of carbon dioxide and nitrogen. For carbon dioxide, the critical suppression ratio of Φ = 0.6, 0.8, 1.0, 1.5 and 2.0 is 7.50, 7.18, 5.74, 3.83, and 2.87. For nitrogen, the critical suppression ratio of Φ = 0.6, 0.8, 1.0, 1.5 and 2.0 is 15.83, 11.87, 9.50, 6.33 and 4.75. Compared to nitrogen, the carbon dioxide is more effective on suppressing hydrogen explosion pressure. The adiabatic flame temperature, thermal diffusivity and mole fraction of active radicals continue to decrease with increasing content of carbon dioxide and nitrogen, which contributes to the decrease of laminar burning velocity.     

Recent application of Computational Fluid Dynamics (CFD) in process safety and loss prevention: A review

In recent years, significant progress has been made to ensure that process industries are among the safest workplaces in the world. However, with the increasing complexity of existing technologies and new problems brought about by emerging technologies, a strong need still exists to study the fundamentals of process safety and predict possible scenarios. This is attained by conducting the corresponding consequence modeling and risk assessments. As a result of the continuous advancement of Computational Fluid Dynamics (CFD) tools and exponentially increased computation capabilities along with better understandings of the underlying physics, CFD simulations have been applied widely in the areas of process safety and loss prevention to gain new insights, improve existing models, and assess new hazardous scenarios. In this review, 126 papers from 2010 to 2020 have been included in order to systematically categorize and summarize recent applications of CFD for fires, explosions, dispersions of flammable and toxic materials from accidental releases, incident investigations and reconstructions, and other areas of process safety. The advantages of CFD modeling are discussed and the future of CFD applications in this research area is outlined.     

Study of the influence of melamine polyphosphate and aluminum hydroxide on the flame propagation and explosion overpressure of aluminum magnesium alloy dust

When aluminum magnesium alloy dust floats in the air, a certain ignition energy can easily cause an accidental explosion. To prevent and control the occurrence of accidental explosions and reduce the severity of accidents, it is necessary to carry out research on the explosion suppression of aluminum magnesium alloy dust. This paper uses a vertical glass tube experimental device and a 20 L spherical explosive experimental device to carry out experimental studies on the suppression of the flame propagation and explosion overpressure of aluminum magnesium alloy dust with melamine polyphosphate (MPP) and Al(OH)₃. With increasing MPP and Al(OH)₃ concentrations, the flame brightness darkened, the flame velocity and propagation distance gradually decreased, and P_max and (dp/dt)_max decreased significantly. When the amount of MPP added reached 60%, the flame propagation distance decreased to 188 mm, which is a decrease of 68%, and the explosion overpressure decreased to 0.014 MPa, effectively suppressing the explosion of aluminum magnesium alloy dust. The experimental results showed that MPP was more effective than Al(OH)₃ in inhibiting the flame propagation and explosion overpressure of the aluminum magnesium alloy dust. Finally, the inhibitory mechanisms of the MPP and Al(OH)₃ were further investigated. The MPP and Al(OH)₃ endothermic decomposition produced an inert gas, diluted the oxygen concentration and trapped active radicals to terminate the combustion chain reaction.     

Numerical study on premixing characteristics and explosion process of starch in a vertical pipe under turbulent flow

Fire and explosion accidents are frequently caused by combustible dust, which has led to increased interest in this area of research. Although scholars have performed some research in this field, they often ignored interesting phenomena in their experiments. In this paper, we established a 2D numerical method to thoroughly investigate the particle motion and distribution before ignition. The optimal time for the corn starch dust cloud to ignite was determined in a semi-closed tube, and the characteristics of the flame propagation and temperature field were investigated after ignition inside and outside the tube. From the simulation, certain unexpected phenomena that occurred in the experiment were explained, and some suggestions were proposed for future experiments. The results from the simulation showed that 60–70 ms was the best time for the dust cloud to ignite. The local high-temperature flame clusters were caused by the agglomeration of high-temperature particles, and there were no flames near the wall of the tube due to particles gathering and attaching to the wall. Vortices formed around the nozzle, where the particle concentration was low and the flame spread slowly. During the explosion venting, particles flew out of the tube before the flame. The venting flame exhibited a “mushroom cloud” shape due to interactions with the vortex, and the flame maintained this shape as it was driven upward by the vortex.     

缝洞型管道瓦斯爆炸特性数值模拟研究

为探究采空区遗煤、松散破碎岩块对瓦斯爆炸的影响,建立缝洞型管道模型,采用数值模拟与理论分析结合方法研究采空区内缝洞型管道内瓦斯爆炸的传播规律及管道长径比对瓦斯爆炸过程中速度与冲击波的影响。研究结果表明:在缝洞型结构内,随着火焰沿管道向前传播,各监测点速度逐渐变大、压力先增加后降低,而压力上升速率则表现出不规则的变化;缝洞结构加剧了火焰燃烧的剧烈程度,提高了管道内各监测点的温度峰值;在缝洞型管道内随长径比r增加,各监测点最大压力峰值以及速度大小依次降低。     

基于人工神经网络的气体泄爆最大超压预测研究

为解决传统经验公式在预测气体泄爆中最大超压出现时的较大偏差或过于保守的问题,提出使用人工神经网络预测气体泄爆最大超压。基于124组实验数据,采用BP与RBF神经网络,通过优化算法计算与迭代循环对泄爆样本中的影响因素进行降维与选择,并确定2类神经网络本身在学习与计算气体泄爆样本时的相关参数。结果表明:PCA（主成分分析法）在当前样本条件下的降维效果较差,而通过迭代对比确认气体泄爆样本中的5类特征全部保留时神经网络的训练模拟效果最好;通过对124组实验数据进行随机挑选训练集与测试集的训练模拟结果发现,神经网络对气体泄爆中最大超压的预测效果较好;通过对比Molkov提出的和经Fakandu等改进的NFPA 68经验公式以及2类神经网络的预测结果表明,神经网络相比于传统气体泄爆经验公式具有明显优势。     

爆炸冲击波作用下圆形通风设施的动态破坏特性

为了研究瓦斯爆炸对通风设施造成的严重破坏及其导致的通风系统紊乱与灾情迅速扩展问题,基于LS-DYNA有限元软件,模拟研究巷道中瓦斯爆炸冲击波作用下圆形通风设施的动态破坏特性,分析应力、应变、速度、位移的动态特征及其破坏过程,并对圆形通风设施动态破坏机理进行初步探索。研究结果表明:爆炸冲击波作用下,圆形通风设施正、反面出现压应力与拉应力分布圆环,且压应力与拉应力峰值处于在外部受约束边界径向圆环附近区域与圆心位置,应变、速度和位移最大值均分布在次区域;爆炸冲击波作用下,通风设施表面形成多圈的正向和反向的应变相互交替,呈现W型的褶皱变形;爆炸冲击波作用下,环向裂纹集中在受约束的边界区域附近,发生脆性破坏,其他区域会出现较多的径向裂纹,可发生韧性破坏,整个断裂过程是脆性与韧性断裂的混合型断裂。     

铝粉爆炸无火焰泄压技术及装备研究

为有效防止粉尘爆炸泄爆引起的二次爆炸及火灾问题,基于泄压理论、消火机理,设计开发无火焰泄压装置,装置主要由消火结构、底座、爆破片及夹持机构组成,消火结构由不锈钢金属丝网组成。选择铝粉尘为测试粉尘,通过自建除尘系统试验平台进行试验研究。结果表明:无火焰泄压装置可成功阻止火焰传播,装置释放的冲击波在5 m外均小于5 kPa,除尘系统内部最大泄爆压力为0.1 MPa,装置前端火焰传播速度均大于100 m/s。     

抛光铝粉爆炸及ABC粉体抑爆特性的实验研究

为研究抛光铝粉的爆炸危险和ABC粉体的抑爆特性,在对实验粉体粒径分布进行分析的基础上,采用20 L粉尘爆炸特性实验装置,分别对不同铝粉尘浓度、不同抑爆剂浓度条件下的爆炸特性参数进行测试。研究结果表明:在实验条件下,铝粉的爆炸下限为45 g/m3＜C＜60 g/m3;随铝粉浓度增加,爆炸烈度呈现出先增强后减弱的变化趋势,在浓度为400 g/m3时爆炸烈度最大。ABC抑爆剂能够有效抑制铝粉爆炸超压和爆炸反应进程,随着惰性粉体浓度的增加,抑制效果愈加明显,爆炸逐渐减弱。当ABC惰性粉体的质量占比增加到50%时,相较单一铝粉爆炸,反应过程时间由72 ms增加至785 ms,爆炸最大压力、最大压力上升速率分别下降了61.7%,89.5%;当ABC粉体质量占比为53%时,铝粉被完全惰化,未发生爆炸。