Canadian Journal of Chemical Engineering最新文献

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A holistic approach for assessing occupational health risk due to fugitive emissions in petrochemical processes: Inherent health hazard level index (IHHLI) 评估石油化工工艺中无组织排放造成的职业健康风险的综合方法:固有健康危害水平指数(IHHLI)
IF 1.6 4区 工程技术
Canadian Journal of Chemical Engineering Pub Date : 2024-07-25 DOI: 10.1002/cjce.25404
Yousef A. Alhamdani, Mimi H. Hassim, Salim M. Shaik
{"title":"A holistic approach for assessing occupational health risk due to fugitive emissions in petrochemical processes: Inherent health hazard level index (IHHLI)","authors":"Yousef A. Alhamdani,&nbsp;Mimi H. Hassim,&nbsp;Salim M. Shaik","doi":"10.1002/cjce.25404","DOIUrl":"10.1002/cjce.25404","url":null,"abstract":"<p>Fugitive emissions from petrochemical facilities have become a major concern due to their impact on plant productivity, the environment, and health. In regard to health, petrochemical workers are at higher occupational health (OH) risk due to their continuous exposure to these harmful emissions. Inherent OH and safety indexes are the most common methods used for assessing OH risk due to fugitive emissions. These methods usually focus on the sources of health hazards, such as chemical substances, process conditions, and process equipment. Therefore, these methods are considered good for measuring the severity of the OH risk. However, based on the source, pathway, receptor (SPR) model, the OH risk due to fugitive emissions is also dependent on the pathway and receptor, where leak and exposure hazards may take place, respectively. For a holistic OH risk assessment, these hazards need to be considered. This was achieved by developing an OH risk assessment methodology that provides an effective assessment that takes into consideration hazards at the source, pathway, and receptor. This paper focuses on the source part of the SPR model, while the pathway and receptor parts will be covered in future publications. This paper presents an index-based method named the inherent health hazard level index (IHHLI) developed for evaluating the severity of the fugitive emission-induced OH risk. The IHHLI is developed by an expert-based selection of the most common and relevant health hazard indicators published in the literature. Based on industry testing, the IHHLI can provide a reliable OH hazard evaluation.</p>","PeriodicalId":9400,"journal":{"name":"Canadian Journal of Chemical Engineering","volume":null,"pages":null},"PeriodicalIF":1.6,"publicationDate":"2024-07-25","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141777190","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Generation of biosurfactants by P. aeruginosa gi |KP163922| on waste engine oil in a free and immobilized cells system 铜绿假单胞菌 gi |KP163922| 在游离和固定细胞系统中对废机油产生的生物表面活性剂
IF 1.6 4区 工程技术
Canadian Journal of Chemical Engineering Pub Date : 2024-07-22 DOI: 10.1002/cjce.25419
Mohan Jujaru, Kajol Pradhan, Shailee Gaur, Amit Jain, Sushil Kumar
{"title":"Generation of biosurfactants by P. aeruginosa gi |KP163922| on waste engine oil in a free and immobilized cells system","authors":"Mohan Jujaru,&nbsp;Kajol Pradhan,&nbsp;Shailee Gaur,&nbsp;Amit Jain,&nbsp;Sushil Kumar","doi":"10.1002/cjce.25419","DOIUrl":"10.1002/cjce.25419","url":null,"abstract":"<p>This study investigated biosurfactant production by the bacterial strain of <i>P. aeruginosa gi</i> |KP 163922| for a free and immobilized cells system using waste engine oil (WEO) as a substrate. The polyurethane foam (PUF) cubes (1 cm × 1 cm × 1 cm) were used as carriers for the immobilization. The batch experiments were performed in Erlenmeyer flasks and monitored at every 24-h interval for both cell systems. The microbial population was counted using the plate count method, and the hydrocarbon degradation percentage was calculated to evaluate the bacterial activity. Surface tension was measured at regular intervals to ensure the presence of biosurfactants. The maximum reduction was 37 and 35 mN/m in a free and immobilized cells system. Immobilization of cells using PUF was found to be efficient in supporting bacterial growth, and after 48 h of incubation, the growth was 2.5 (±0.58) × 10<sup>11</sup> CFU/mL. The chemical characterization using Fourier transform infrared (FTIR) spectroscopy confirmed the obtained product as rhamnolipid. Crude biosurfactant yield was found to be maximum in the case of the immobilized system, which was approximately 18 g/L. Scanning electron micrographs (SEM) of the used PUF cubes showed the strong adherence of biofilm to the cube surface and the potential of its reuse in multiple cycles. Gas chromatography–mass spectrometry (GC–MS) analysis confirms that the immobilized strain of <i>P. aeruginosa</i> exhibited superior biodegradation capabilities compared to free cells. Specifically, it was capable of reducing the concentration of polyaromatic hydrocarbons and converting more significant aliphatic compounds into metabolic byproducts such as alkanes, alkenes, cycloalkanes, and carbonyl groups.</p>","PeriodicalId":9400,"journal":{"name":"Canadian Journal of Chemical Engineering","volume":null,"pages":null},"PeriodicalIF":1.6,"publicationDate":"2024-07-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://onlinelibrary.wiley.com/doi/epdf/10.1002/cjce.25419","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141785685","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Transesterification reactions as a means to produce esters: A critical review 酯化反应是生产酯的一种方法:重要综述
IF 1.6 4区 工程技术
Canadian Journal of Chemical Engineering Pub Date : 2024-07-14 DOI: 10.1002/cjce.25414
Reshma R. Devale, Yogesh S. Mahajan
{"title":"Transesterification reactions as a means to produce esters: A critical review","authors":"Reshma R. Devale,&nbsp;Yogesh S. Mahajan","doi":"10.1002/cjce.25414","DOIUrl":"10.1002/cjce.25414","url":null,"abstract":"<p>Esters are important chemicals used in fine and bulk chemical industry with numerous applications: solvents, paints, varnishes, dyes, and cosmetics. Ester formation is dominated mainly by Fischer esterification and transesterification. Fischer reaction is generally used for ester production, but in certain cases, transesterification can be used with advantage. It is useful when the acid is less soluble in the alcohol or in the solvent used, thus forming two layers. Water formation creates purification problems during esterification reactions due to azeotrope formation and transesterification can be useful in such cases. Commercially, cheaply available methyl and ethyl esters can be conveniently used as raw materials for value added ester production by transesterification. Transesterification is also useful when the parent acids are highly reactive and pose difficulty in separation. Transesterifications are slow reactions and a catalyst is used: acids and bases, ion exchange resins, zeolites, and clays. Homogeneous catalysts were used in the past which are now replaced by their heterogeneous counterparts. Heterogeneous catalysts offer added advantages like reusability, lesser corrosion, and ease of separation. Transesterification can be commercially used to produce a number of esters of industrial importance like acrylics and biodiesel. This review considers all these aspects in considerable detail. A large literature set was scanned and its judicious extract is presented.</p>","PeriodicalId":9400,"journal":{"name":"Canadian Journal of Chemical Engineering","volume":null,"pages":null},"PeriodicalIF":1.6,"publicationDate":"2024-07-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141650272","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Kinetics of cashew apple drying through mechanistic models and analysis of the effects of drying conditions on the retention of bioactive compounds 通过机理模型分析腰果苹果干燥动力学以及干燥条件对生物活性化合物保留的影响
IF 1.6 4区 工程技术
Canadian Journal of Chemical Engineering Pub Date : 2024-07-14 DOI: 10.1002/cjce.25395
Vikramaditya R. Shirsat, Prakash D. Vaidya, Vishwanath H. Dalvi, Rekha S. Singhal, Anil K. Kelkar, Jyeshtharaj B. Joshi
{"title":"Kinetics of cashew apple drying through mechanistic models and analysis of the effects of drying conditions on the retention of bioactive compounds","authors":"Vikramaditya R. Shirsat,&nbsp;Prakash D. Vaidya,&nbsp;Vishwanath H. Dalvi,&nbsp;Rekha S. Singhal,&nbsp;Anil K. Kelkar,&nbsp;Jyeshtharaj B. Joshi","doi":"10.1002/cjce.25395","DOIUrl":"10.1002/cjce.25395","url":null,"abstract":"<p>Global cashew nut production is nearly 4 million tons per year, valued at 7 billion US dollars. Remarkably, almost the entire cashew apple crop, amounting to 20 million tons annually, goes to waste. However, the cashew apple contains valuable nutraceutical compounds, including tannins, polyphenols, and carotenoids, estimated to be worth 150 million US dollars annually. Due to the highly perishable nature of cashew apples, degradation is a significant issue. In response, the current work has established drying as an effective preservation technique for these bioactive components. The effect of drying temperature on bioactive compounds has been thoroughly investigated. The non-random two liquid (NRTL) activity coefficient model effectively captures the thermodynamics of the drying process. To facilitate the selection and design of drying equipment, two mechanistic mass transfer models were developed. The first model employs the Maxwell-Stefan framework to account for internal diffusion, with external mass transfer resistance appearing as a boundary condition. While this model works well for products like grapes, it proved inadequate for explaining the drying behaviour of cashew apples. Consequently, a second model was developed, postulating rapid moisture transport by capillary action within the cashew apple. This model effectively captures the effects of a wide range of operating conditions, using only external mass transfer resistance as the tuneable kinetic parameter. This mechanistic model is more suitable for dryer design compared to conventional phenomenological models like the logarithmic model and the two-term exponential model.</p>","PeriodicalId":9400,"journal":{"name":"Canadian Journal of Chemical Engineering","volume":null,"pages":null},"PeriodicalIF":1.6,"publicationDate":"2024-07-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141650253","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Effect of ceria morphology on hydrogen production via methane steam reforming for membrane reformer 铈形态对膜式转化炉甲烷蒸汽转化制氢的影响
IF 1.6 4区 工程技术
Canadian Journal of Chemical Engineering Pub Date : 2024-07-09 DOI: 10.1002/cjce.25396
Anjali Baudh, Meenakshi Garjola, Rahul Sharma, Sweta Sharma, Rajesh Kumar Upadhyay
{"title":"Effect of ceria morphology on hydrogen production via methane steam reforming for membrane reformer","authors":"Anjali Baudh,&nbsp;Meenakshi Garjola,&nbsp;Rahul Sharma,&nbsp;Sweta Sharma,&nbsp;Rajesh Kumar Upadhyay","doi":"10.1002/cjce.25396","DOIUrl":"10.1002/cjce.25396","url":null,"abstract":"<p>Hydrogen is a potential energy carrier in comparison to conventional fuels due to its high energy content. Methane is an attractive source for ‘on-site’ production of hydrogen by using membrane reformer due to its low cost. However, such reformers are not well studied and high temperature operation of steam methane reforming (SMR) makes the integration with membrane separation difficult. Further, the main product of SMR is CO and H<sub>2</sub> in which CO has an inhibition effect on the membrane separation process. Therefore, it is vital to synthesize a low temperature and low CO selective catalyst for a suitable integration with membrane reformer. Nickel-based catalyst is widely used for SMR due to its low cost and high catalytic activity. CeO<sub>2</sub> is a favoured support as it mobilizes the lattice oxygen and reduces the coke formation and CO selectivity. Though several studies are reported on CeO<sub>2</sub> based support, the effect of CeO<sub>2</sub> surface morphology is not studied for SMR. In the current work, Ni/CeO<sub>2</sub> of different shapes (nanocube and nanorod) are synthesized. The complete characterization of the support was performed. The effect of support shape, calcination temperature, and reduction temperature on SMR activity is found at different operating temperatures. For each condition conversion, CO, CO<sub>2</sub> selectivity, and hydrogen yield are calculated. The results show the CeO<sub>2</sub> morphology has a considerable effect on conversion, CO selectivity, and hydrogen yield. It is found that ceria nanocube calcined at 550°C provides better performance at high temperature.</p>","PeriodicalId":9400,"journal":{"name":"Canadian Journal of Chemical Engineering","volume":null,"pages":null},"PeriodicalIF":1.6,"publicationDate":"2024-07-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141570095","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Identifying design criteria for implementing inherent safety in chemical process industries part 1: Design reasoning 确定化工工艺行业固有安全的设计标准,第 1 部分:设计推理
IF 1.6 4区 工程技术
Canadian Journal of Chemical Engineering Pub Date : 2024-07-09 DOI: 10.1002/cjce.25405
Zafirah Zakaria, Kamarizan Kidam, Mimi H. Hassim
{"title":"Identifying design criteria for implementing inherent safety in chemical process industries part 1: Design reasoning","authors":"Zafirah Zakaria,&nbsp;Kamarizan Kidam,&nbsp;Mimi H. Hassim","doi":"10.1002/cjce.25405","DOIUrl":"10.1002/cjce.25405","url":null,"abstract":"<p>Recurrence of similar accidents is evidenced by past accidents, which show that accidents are not decreasing globally. It is recommended to implement the concept of inherent safety design (ISD) in the chemical process industry as a component of accident prevention strategies. This study aims to identify potential indicators of ISD for each inherent safety (IS) keyword, which will be referred to later as design reasoning (DR), based on 529 selected cases that suggest design changes that enhance the safety of processes, materials, or equipment. The cases were collected from accident cases, IS handbooks, chemical engineering journals, new product brochures, and chemical engineering magazines. The cases have to demonstrate that the new design is safer than the previous design. The design changes were evaluated to extract the corrective action and determine the common strategy employed. This information was then interpreted as DR. The collected DR were subsequently categorized and measured in terms of frequency according to IS keywords. From the statistical analysis, the highest percentage of DR is improve mixing (18%) which accounted from 95 out of 529 cases. The second is loose proximity (15.5%) and the third is fewer equipment (14.9%). For the IS keyword ranking, it can be summarized that: moderation (40%) &gt;minimization (27%) &gt;simplification (21%) &gt;substitution (12%). Results showed that moderation inherent safety is a popular strategy used to implement IS. The findings serve as a valuable reference for designers or engineer attempting to implement ISD in their design task.</p>","PeriodicalId":9400,"journal":{"name":"Canadian Journal of Chemical Engineering","volume":null,"pages":null},"PeriodicalIF":1.6,"publicationDate":"2024-07-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141584712","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Issue Highlights 发行亮点
IF 1.6 4区 工程技术
Canadian Journal of Chemical Engineering Pub Date : 2024-07-08 DOI: 10.1002/cjce.24995
{"title":"Issue Highlights","authors":"","doi":"10.1002/cjce.24995","DOIUrl":"https://doi.org/10.1002/cjce.24995","url":null,"abstract":"","PeriodicalId":9400,"journal":{"name":"Canadian Journal of Chemical Engineering","volume":null,"pages":null},"PeriodicalIF":1.6,"publicationDate":"2024-07-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141565876","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Development of new correlation for the prediction of power number for closed clearance impellers using machine learning methods trained on literature data 使用根据文献数据训练的机器学习方法,开发用于预测闭式间隙叶轮功率数的新相关性
IF 1.6 4区 工程技术
Canadian Journal of Chemical Engineering Pub Date : 2024-07-02 DOI: 10.1002/cjce.25385
Sumit S. Joshi, Vishwanath H. Dalvi, Vivek S. Vitankar, Jyeshtharaj B. Joshi, Aniruddha J. Joshi
{"title":"Development of new correlation for the prediction of power number for closed clearance impellers using machine learning methods trained on literature data","authors":"Sumit S. Joshi,&nbsp;Vishwanath H. Dalvi,&nbsp;Vivek S. Vitankar,&nbsp;Jyeshtharaj B. Joshi,&nbsp;Aniruddha J. Joshi","doi":"10.1002/cjce.25385","DOIUrl":"10.1002/cjce.25385","url":null,"abstract":"<p>The accurate estimation of the power number for closed clearance impellers holds significant importance in industries such as chemical, biochemical, paper and pulp, as well as paints, pigments, and polymers. Existing state-of-the-art correlations for predicting power numbers, however, are inaccurate for impeller Reynolds number <span></span><math>\u0000 <mrow>\u0000 <mfenced>\u0000 <mrow>\u0000 <mi>R</mi>\u0000 <msub>\u0000 <mi>e</mi>\u0000 <mi>I</mi>\u0000 </msub>\u0000 </mrow>\u0000 </mfenced>\u0000 <mo>&gt;</mo>\u0000 <mn>100</mn>\u0000 </mrow></math>. In this study, we compiled a dataset of 1470 data points from 15 research articles in the open literature, covering five types of impellers: (i) anchor; (ii) gate; (iii) single helical ribbon; (iv) double helical ribbon; and (v) helical ribbon with screw. Six machine learning models, namely artificial neural networks (ANN), CatBoost regressor, extra tree regressor, support vector regressor, random forest, and XGBoost regressor, were developed and compared. The results revealed that ANN emerged as the most efficient model, demonstrating the highest testing <i>R</i><sup>2</sup> value of 0.99 and the lowest testing MAPE of 7.3%. Further, we used the ANN model to develop a novel set of process correlations to estimate impeller power numbers for the industrially important anchor and double helical ribbon impellers: which significantly outperform the existing state-of-the-art correlations available in literature.</p>","PeriodicalId":9400,"journal":{"name":"Canadian Journal of Chemical Engineering","volume":null,"pages":null},"PeriodicalIF":1.6,"publicationDate":"2024-07-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141552754","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Data-driven battery capacity estimation using support vector regression and model bagging under fast-charging conditions 在快速充电条件下使用支持向量回归和模型袋法进行数据驱动的电池容量估算
IF 1.6 4区 工程技术
Canadian Journal of Chemical Engineering Pub Date : 2024-07-02 DOI: 10.1002/cjce.25394
Yixiu Wang, Qiyue Luo, Liang Cao, Arpan Seth, Jianfeng Liu, Bhushan Gopaluni, Yankai Cao
{"title":"Data-driven battery capacity estimation using support vector regression and model bagging under fast-charging conditions","authors":"Yixiu Wang,&nbsp;Qiyue Luo,&nbsp;Liang Cao,&nbsp;Arpan Seth,&nbsp;Jianfeng Liu,&nbsp;Bhushan Gopaluni,&nbsp;Yankai Cao","doi":"10.1002/cjce.25394","DOIUrl":"10.1002/cjce.25394","url":null,"abstract":"<p>Lithium-ion batteries offer significant advantages in terms of their high energy and power density and efficiency, but capacity degradation remains a major issue during their usage. Accurately estimating the remaining capacity is crucial for ensuring safe operations, leading to the development of precise capacity estimation models. Data-driven models have emerged as a promising approach for capacity estimation. However, existing models predominantly focus on constant current charging conditions, limiting their applicability in real-world scenarios where fast-charging conditions are commonly employed. The primary objective of this work is to develop a more versatile machine learning model (i.e., support vector regression [SVR]) capable of estimating battery capacity under fast-charging conditions, with broader applicability across various work conditions. Genetic algorithm and cross-validation techniques are employed to simultaneously optimize feature extraction hyperparameters and SVR hyperparameters. A model bagging method is further implemented to address prediction challenges under unknown fast-charging conditions. The effectiveness of the developed model is validated on a cycling dataset of lithium-ion batteries under different two-stage fast-charging conditions.</p>","PeriodicalId":9400,"journal":{"name":"Canadian Journal of Chemical Engineering","volume":null,"pages":null},"PeriodicalIF":1.6,"publicationDate":"2024-07-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://onlinelibrary.wiley.com/doi/epdf/10.1002/cjce.25394","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141548584","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Experimental methods in chemical engineering: Monte Carlo 化学工程中的实验方法蒙特卡罗
IF 1.6 4区 工程技术
Canadian Journal of Chemical Engineering Pub Date : 2024-06-26 DOI: 10.1002/cjce.25374
Ergys Pahija, Soonho Hwangbo, Thomas Saulnier-Bellemare, Gregory S. Patience
{"title":"Experimental methods in chemical engineering: Monte Carlo","authors":"Ergys Pahija,&nbsp;Soonho Hwangbo,&nbsp;Thomas Saulnier-Bellemare,&nbsp;Gregory S. Patience","doi":"10.1002/cjce.25374","DOIUrl":"10.1002/cjce.25374","url":null,"abstract":"<p>Monte Carlo (MC) methods employ a statistical approach to evaluate complex mathematical models that lack analytical solutions and assess their uncertainties. To this end, techniques such as Markov chain Monte Carlo (MCMC), bootstrap, and sequential MC methods repeat the same operations over a specified range of conditions. Consequently, both the frequentist and Bayesian statistical approaches are computationally intensive, depending on the problem formulation. Improving sampling techniques and identifying sources of error reduce the computational demand but do not guarantee that the solution reaches the global optimum. Moreover, efficient algorithms and advances in hardware continue to decrease computation time. MC methods are applicable to a plethora of problems ranging from medicine to computational chemistry, economics, and industrial safety, making them integral to the ongoing industrial digitalization by evaluating the quality of applied models. In chemical engineering, MC simulations are used in four clusters of research: design, systems, and optimization; molecular simulation, including CO<sub>2</sub> and carbon capture; adsorption and molecular dynamics; and thermodynamics. There is limited cross-referencing between the design cluster and the other three, which presents an interesting area for future research. This mini-review presents two applications within chemical engineering: emissions and energy forecasting.</p>","PeriodicalId":9400,"journal":{"name":"Canadian Journal of Chemical Engineering","volume":null,"pages":null},"PeriodicalIF":1.6,"publicationDate":"2024-06-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://onlinelibrary.wiley.com/doi/epdf/10.1002/cjce.25374","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141514163","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
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