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Fluidized Bed Chemical Vapor Deposition of Copper on Micronic Alumina Powders 流化床化学气相沉积微氧化铝粉末上的铜
IF 1.8 4区 工程技术 Q3 ENGINEERING, CHEMICAL Pub Date : 2024-09-17 DOI: 10.1002/ceat.202400253
Dr. Ilyass Jellal, Dr. Hugues Vergnes, Prof. Brigitte Caussat

Uniformly coating micronic particles with metals is of main interest for a broad range of applications. This study demonstrates the feasibility of depositing pure copper on the surface of micronic alumina particles by the fluidized bed chemical vapor deposition process from the cheap and nontoxic copper acetylacetonate precursor. Thanks to the development of a preconditioning protocol, a complete fluidization of the particles organized as porous agglomerates was reached. The coating of the individual particles was favored by using conditions involving low deposition rates. The influence of key operating parameters on the process behavior and on the characteristics of the deposit was studied. The deposited copper was of cubic crystal structure without carbon nor oxide contamination.

在微米颗粒上均匀地涂覆金属是广泛应用的主要兴趣所在。本研究证明了通过流化床化学气相沉积工艺在微米氧化铝颗粒表面沉积纯铜的可行性,该工艺的前驱体为廉价且无毒的乙酰丙酮铜。由于开发了一种预处理方案,以多孔团聚体形式组织的颗粒实现了完全流化。在低沉积速率的条件下,有利于单个颗粒的涂层。研究了关键操作参数对工艺行为和沉积特性的影响。沉积的铜为立方晶体结构,没有碳或氧化物污染。
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引用次数: 0
Improved Heat Transfer Capabilities of Nanofluids—An Assessment Through CFD Analysis 提高纳米流体的传热能力--通过 CFD 分析进行评估
IF 1.8 4区 工程技术 Q3 ENGINEERING, CHEMICAL Pub Date : 2024-09-17 DOI: 10.1002/ceat.202300523
Rehan Zubair Khalid, Mehmood Iqbal, Aitazaz Hassan, Syed Muhammad Haris, Atta Ullah

Conventional fluids used in fission-based water-cooled nuclear reactors have lower heat transfer coefficients (HTCs) and thermal conductivity, which has led researchers to explore high-performance fluids that can enhance heat transfer in routine operation and prevent core meltdown in the case of accidents. It is important to investigate a wide range of fluids that can help designers improve thermal hydraulic characteristics, such as HTC, critical heat flux, and minimum departure from nucleate boiling ratio (MDNBR). In this study, the effectiveness of nanofluids in enhancing heat transfer parameters, including thermal conductivity and heat capacity, was investigated. Four different nanofluids (Al2O3–H2O, ZrO2–H2O, Ag–H2O, and Si–H2O) with pure water as the primary coolant in an HPR-1000 nuclear reactor were compared using computational methods. Due to computational limitations, only the flow channel among four fuel rods with the highest power density in the core was simulated using Eulerian computational fluid dynamics. The results of this study show that silver water (Ag–H2O) nanofluid outperformed other nanofluids and pure water. It had a higher average HTC and MDNBR, with a 67.15 % and 45.23 % improvement, respectively, compared to pure water. The fuel rod wall temperature was also reduced by 28.5 K with Ag–H2O compared to water. Comparison of current simulated results with literature data shows a good agreement.

裂变水冷式核反应堆中使用的传统流体具有较低的传热系数(HTC)和导热性,这促使研究人员探索高性能流体,以便在常规运行中提高传热性,并在发生事故时防止堆芯熔毁。研究各种能帮助设计人员改善热液压特性(如 HTC、临界热通量和最小离核沸腾比 (MDNBR))的流体非常重要。本研究调查了纳米流体在提高热传导参数(包括热导率和热容量)方面的有效性。使用计算方法比较了四种不同的纳米流体(Al2O3-H2O、ZrO2-H2O、Ag-H2O 和 Si-H2O)与纯水作为 HPR-1000 核反应堆中的主冷却剂。由于计算能力有限,只使用欧拉计算流体动力学模拟了堆芯中功率密度最高的四根燃料棒之间的流道。研究结果表明,银水(Ag-H2O)纳米流体的性能优于其他纳米流体和纯水。与纯水相比,银水的平均 HTC 和 MDNBR 分别提高了 67.15 % 和 45.23 %。与水相比,Ag-H2O 的燃料棒壁温度也降低了 28.5 K。将目前的模拟结果与文献数据进行比较,结果显示两者吻合良好。
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引用次数: 0
Mechanistic Insights and Emerging Trends in Photocatalytic Dye Degradation for Wastewater Treatment 光催化染料降解废水处理的机理认识和新趋势
IF 1.8 4区 工程技术 Q3 ENGINEERING, CHEMICAL Pub Date : 2024-09-17 DOI: 10.1002/ceat.202400142
Sahil Tak, Sanjeet Grewal,  Shreya, Peeyush Phogat,  Manisha, Ranjana Jha, Sukhvir Singh

This review explores advancements, challenges, and considerations in photocatalytic dye degradation for sustainable wastewater treatment. It highlights smart photocatalyst design, visible-light-responsive materials, and co-catalyst engineering, which enhance system efficacy. Despite environmental concerns, the eco-friendly aspects of photocatalysis offer a promising alternative to traditional methods. Future perspectives emphasize nanotechnology's role in developing effective photocatalysts and integrating visible-light and solar-driven systems to meet sustainability goals. Efforts in co-catalyst engineering and reactor design aim to optimize processes, addressing kinetic and scalability challenges, while economic research focuses on reducing costs to improve competitiveness.

本综述探讨了光催化染料降解在可持续废水处理方面的进展、挑战和注意事项。它重点介绍了智能光催化剂设计、可见光响应材料和助催化剂工程,这些都能提高系统功效。尽管环境问题令人担忧,但光催化技术的生态友好性为传统方法提供了一种前景广阔的替代方法。未来展望强调纳米技术在开发有效光催化剂以及整合可见光和太阳能驱动系统以实现可持续发展目标方面的作用。在助催化剂工程和反应器设计方面的努力旨在优化工艺,解决动力学和可扩展性方面的挑战,而经济研究则侧重于降低成本以提高竞争力。
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引用次数: 0
Numerical Analysis Selecting Chemical Mechanism of Ammonia–Hydrogen Mixture Laminar Burning Velocity by RMSE 利用均方根误差选择氨氢混合物层流燃烧速度化学机制的数值分析
IF 2.1 4区 工程技术 Q3 ENGINEERING, CHEMICAL Pub Date : 2024-09-16 DOI: 10.1002/ceat.202400053
Yu Ying Lu, Xinyang Li, Herbert Une Meir, Guang Yu Yang, Yu Shuan Fan, Way Lee Cheng, Wai Siong Chai
This study employs Cantera code to investigate the laminar burning velocity of different ammonia–hydrogen mixtures. Suitable models were selected from recent literature, and the one with the lowest root mean square error (RMSE) against experimental data was identified through the error function method. Bao mechanism shows an RMSE value of 4.71 at atmospheric pressure for ammonia–hydrogen mixtures, while the Otomo mechanism exhibits an RMSE of 2.11 under high-pressure conditions. Additionally, sensitivity analysis was conducted to highlight critical reactions within each mechanism, emphasizing distinctions between different pressures. This approach aims to choose the proper mechanism to reduce computational and experimental costs in the early stages of ammonia–hydrogen research.
本研究采用 Cantera 代码研究不同氨氢混合物的层流燃烧速度。研究人员从最新文献中挑选了合适的模型,并通过误差函数法确定了与实验数据相比均方根误差(RMSE)最小的模型。对于氨氢混合物,Bao 机制在常压下的均方根误差值为 4.71,而 Otomo 机制在高压条件下的均方根误差值为 2.11。此外,还进行了敏感性分析,以突出每种机理中的关键反应,强调不同压力下的区别。这种方法旨在选择适当的机理,以降低氨-氢研究早期阶段的计算和实验成本。
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引用次数: 0
A New Bubble Image Model Based on the Recognition of Bubble Flow 基于气泡流动识别的新型气泡图像模型
IF 1.8 4区 工程技术 Q3 ENGINEERING, CHEMICAL Pub Date : 2024-09-14 DOI: 10.1002/ceat.202400009
Prof. Guohui Li, Dr. Xue Liu, Prof. Yang Liu

In this study, a new ellipse-fitting algorithm is proposed to achieve the reconstruction of bubble shapes in bubbly flow captured by a high-speed camera in the gas–liquid two-phase column reactor. Bubble flow patterns and geometric parameters in the experimental images are recognized and identified successfully, represented by means of the topological parameters. Three logical steps are carried out in detail. First, the area threshold and the circularity factors are established to identify the bubbles whether belonging to a single bubble or not. The overlapping bubbles in images can be separated from single bubbles based on a watershed segmentation algorithm. Second, a single bubble image and an overlapping bubble image are combined into one image. After that, statistical analysis for the size distributions and ellipse area bubbles is performed for further analysis and discussion. The advantage of this algorithm is that it can make use of a set of major and minor axes of an ellipse to capture the ellipse parameters more effectively. Simulation results are well agreed with experimental measurements. Moreover, it can be used to detect many ellipse-like bubbles that are dispersed in high-speed camera images, indicating that it is a better strategy for the recognition and identification of bubbly turbulent flow accurately.

本研究提出了一种新的椭圆拟合算法,用于实现气液两相柱反应器中高速摄像机捕获的气泡流中气泡形状的重建。实验图像中的气泡流动形态和几何参数通过拓扑参数的方式被成功识别和鉴定。具体分为三个逻辑步骤。首先,建立面积阈值和圆度系数,以识别气泡是否属于单个气泡。基于分水岭分割算法,可将图像中重叠的气泡从单个气泡中分离出来。其次,将单一气泡图像和重叠气泡图像合并为一张图像。然后,对气泡的大小分布和椭圆面积进行统计分析,以便进一步分析和讨论。该算法的优点是可以利用椭圆的一组主轴和次轴来更有效地捕捉椭圆参数。仿真结果与实验测量结果十分吻合。此外,它还能用于检测高速相机图像中分散的许多椭圆形气泡,这表明它是准确识别和鉴定气泡湍流的一种较好策略。
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引用次数: 0
Evaluation of Bi-reforming Performance of Bi-disperse Catalyst in a Packed Bed Reactor 评估双分散催化剂在填料床反应器中的双转化性能
IF 1.8 4区 工程技术 Q3 ENGINEERING, CHEMICAL Pub Date : 2024-09-13 DOI: 10.1002/ceat.202400276
Yaochen Zhu, Prof. Shuai Wang, Dr. Qinghong Zhang

Bi-reforming hydrogen production has its potential in the reduction of greenhouse gas emissions. In this work, methane bi-reforming process in a packed bed reactor using bi-disperse catalyst particles is numerically investigated via a particle-resolved modeling. The impacts of macropore fraction, porosity and macropore size on temperature and reaction rate distribution in the bed are evaluated. The results demonstrate that there exists a peak of the maximum temperature difference in the bed with the catalyst macropore fraction. Increasing the macropore fraction of the catalyst can weaken the non-uniformity of coke formation in the bed. The increase in the macropore size of the catalyst particle can promote the hydrogen production, especially when the macropore size of particle is smaller.

双转化制氢在减少温室气体排放方面具有潜力。在这项研究中,通过颗粒分辨建模对使用双分散催化剂颗粒的填料床反应器中的甲烷双转化过程进行了数值研究。评估了大孔隙率、孔隙率和大孔隙尺寸对床层中温度和反应速率分布的影响。结果表明,随着催化剂大孔率的增加,床层中的最大温差会出现一个峰值。增加催化剂的大孔率可以减弱床层中焦炭形成的不均匀性。催化剂颗粒大孔尺寸的增加可促进氢气的产生,尤其是当颗粒大孔尺寸较小时。
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引用次数: 0
Modeling of Dual-Factor Drag Correction Model for Bubbly Flow under Elevated Pressure 高压力下气泡流的双因素阻力修正模型建模
IF 1.8 4区 工程技术 Q3 ENGINEERING, CHEMICAL Pub Date : 2024-08-29 DOI: 10.1002/ceat.202300477
Yibo Gao, Linlin Geng, Patrick G. Verdin, Ibra Fall, Ruijie Zhang, Zhongjie Tian, Desheng Zhang

A pressure correction method is proposed considering the influence of a dual factor. The applicability of a pressure correction method coupled with a drag model is discussed along with the accuracy of the simulation results obtained by such a pressure correction method. It is found that the present pressure correction method combined with the DBS (dual bubble size) drag model can accurately reflect the changing trend of gas holdup distribution with pressure. It is also established that results from this model applied to a bubble column match well with the experimental data. Finally, when compared with other pressure correction models, the proposed model shows better robustness in three-dimensional simulations and can predict radial gas holdup distributions with better accuracy.

考虑到双重因素的影响,提出了一种压力校正方法。讨论了压力校正方法与阻力模型相结合的适用性,以及这种压力校正方法所得到的模拟结果的准确性。研究发现,本压力修正方法与 DBS(双气泡尺寸)阻力模型相结合,能够准确反映气体滞留分布随压力变化的趋势。研究还证实,该模型应用于气泡柱的结果与实验数据非常吻合。最后,与其他压力校正模型相比,所提出的模型在三维模拟中表现出更好的鲁棒性,并能更准确地预测径向气体滞留分布。
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引用次数: 0
Liquid–Liquid Equilibrium with Ab Initio Molecular Dynamics Simulation and NRTL Parameter Estimation 利用 Ab Initio 分子动力学模拟和 NRTL 参数估计实现液-液平衡
IF 1.8 4区 工程技术 Q3 ENGINEERING, CHEMICAL Pub Date : 2024-08-28 DOI: 10.1002/ceat.202400080
Su Yeong Jeong, Byoung Chul Kim, Jeom Soo Kim, Young Han Kim

In this study, we propose a method for estimating liquid–liquid equilibrium with ab initio molecular dynamics (MD) simulation. Additionally, we determined the non-random two-liquid model parameters for the systems applicable to the extraction design using a commercial software. The minimized energy of separate liquid phases yielded equilibrium data from a more versatile procedure than the existing MD simulation. Although many experimental measurements with the parameters have been published, the parameters are not always compatible with the software. The performances are graphically illustrated for example systems including ionic liquid and deep eutectic solvent, and the results indicated that the proposed procedures of the estimation and the model parameter determination were satisfactory.

在本研究中,我们提出了一种利用原子分子动力学(MD)模拟估算液液平衡的方法。此外,我们还使用商业软件确定了适用于萃取设计的系统的非随机双液模型参数。与现有的 MD 模拟相比,最小化分离液相的能量可通过更通用的程序获得平衡数据。虽然已经公布了许多参数实验测量结果,但这些参数并不总是与软件兼容。对包括离子液体和深共晶溶剂在内的示例系统的性能进行了图表说明,结果表明所建议的估算和模型参数确定程序是令人满意的。
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引用次数: 0
Metal–Organic Frameworks as a Catalyst and Catalyst Support in Fuel Cells: From Challenges to Catalytic Application 金属有机框架作为燃料电池的催化剂和催化剂载体:从挑战到催化应用
IF 1.8 4区 工程技术 Q3 ENGINEERING, CHEMICAL Pub Date : 2024-08-28 DOI: 10.1002/ceat.202300580
Dr. Iswary Letchumanan, Dr. Ajaz Ahmad Wani, Dr. Norazuwana Shaari, Dr. Mahnoush Beygisangchin, Prof. Siti Kartom Kamarudin, Dr. Nabila A. Karim

The innovation of high-performance, stable electrocatalysts for clean energy systems faces significant challenges. Metal-organic frameworks (MOFs), with their porous nature, flexible structures, and homogeneous active site dispersion, have gained interest as unique precursors for carbon-based catalysts. MOFs' properties significantly enhance catalytic performance in fuel cells. This review highlights recent advancements in MOF design for oxygen electrocatalysis in fuel cells, while also discussing perspectives for future material innovations to improve catalytic activity in this emerging field.

为清洁能源系统开发高性能、稳定的电催化剂面临着巨大的挑战。金属有机框架(MOFs)具有多孔性、柔性结构和均匀的活性位点分散等特点,作为碳基催化剂的独特前驱体,已经引起了人们的兴趣。MOFs 的特性大大提高了燃料电池的催化性能。本综述重点介绍了用于燃料电池中氧电催化的 MOF 设计的最新进展,同时还讨论了未来材料创新的前景,以提高这一新兴领域的催化活性。
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引用次数: 0
Energy-Efficient Hydrogen Liquefaction Process with Ortho-Para Conversion and Boil-Off Gas Recovery 采用正原转换和沸腾气体回收技术的高能效氢液化工艺
IF 1.8 4区 工程技术 Q3 ENGINEERING, CHEMICAL Pub Date : 2024-08-23 DOI: 10.1002/ceat.202400150
Prof. Jian Wen, Haolin Xie, Xin Zhao, Ke Li

Hydrogen liquefaction is essential for the efficient storage and transportation of hydrogen. In the liquefaction process, catalytic ortho-para conversion is crucial to achieve a product with at least 95 % para-hydrogen to reduce boil-off losses. The proposed hydrogen liquefaction process using a catalyst-filled heat exchanger for continuous ortho-para conversion is modeled through steady-state thermal simulations in Aspen HYSYS. Additionally, an ejector is integrated to reliquefy boil-off gas. The proposed design achieves a specific energy consumption (SEC) of 10.50 kWh ()−1 and an exergy efficiency (EXE) of 30.1 %, which is 18 % lower in SEC compared to processes with separate converters. The integrated approach enhances energy utilization and offers references for future hydrogen liquefiers.

氢气液化对高效储存和运输氢气至关重要。在液化过程中,催化正副转化对于获得至少 95% 对氢产品以减少沸腾损失至关重要。通过在 Aspen HYSYS 中进行稳态热模拟,对使用催化剂填充热交换器进行连续对位转换的拟议氢液化工艺进行了建模。此外,还集成了一个喷射器来疏解沸腾气体。拟议设计的比能耗 (SEC) 为 10.50 kWh()-1,放能效率 (EXE) 为 30.1%,与使用独立转换器的工艺相比,比能耗 (SEC) 降低了 18%。这种集成方法提高了能源利用率,为未来的氢气液化器提供了参考。
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引用次数: 0
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