Fernando V Lima , Yuhe Tian , Helen E Durand , Joel A Paulson , Lorenz T Biegler
{"title":"Innovations in chemical process control: challenges and opportunities","authors":"Fernando V Lima , Yuhe Tian , Helen E Durand , Joel A Paulson , Lorenz T Biegler","doi":"10.1016/j.coche.2025.101148","DOIUrl":"10.1016/j.coche.2025.101148","url":null,"abstract":"<div><div>This paper provides a current perspective on innovations in chemical process control based on Mid-Atlantic Process Control Academy meetings held at Carnegie Mellon University (in 2019), Ohio State University (in 2023), and West Virginia University (in 2024), with the next one scheduled at Wayne State University (in 2025). These meetings were introduced in 2019 with the main objectives of discussing the current directions on model predictive control (MPC) as well as new breakthroughs in the process systems engineering community associated with process control. Topics addressed in this paper in the context of these meetings include process operability and flexibility, quantum computing, Bayesian optimization, and nonlinear and economic model predictive control. For each topic, recent theory, applications, and software infrastructure developments are discussed, and current challenges and opportunities for future research directions are outlined.</div></div>","PeriodicalId":292,"journal":{"name":"Current Opinion in Chemical Engineering","volume":"48 ","pages":"Article 101148"},"PeriodicalIF":8.0,"publicationDate":"2025-05-30","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144168686","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Wajeha Tauqir , Pengfei Xu , George M Bollas , Matthew D Stuber
{"title":"Accurate model needs for desalination systems","authors":"Wajeha Tauqir , Pengfei Xu , George M Bollas , Matthew D Stuber","doi":"10.1016/j.coche.2025.101147","DOIUrl":"10.1016/j.coche.2025.101147","url":null,"abstract":"<div><div>Modeling serves as the nexus connecting design, control, and optimization in desalination process systems while also providing insights into the interplay between process-level and property-level phenomena. Modeling desalination processes presents challenges due to the complex thermophysical properties and nonideality of multielectrolyte solutions, especially at high concentrations. In this mini-review, we examine the current state of several widely used process modeling tools, their features, and the adaptability to modeling state-of-the-art desalination process systems. We also discuss thermodynamic models of electrolyte solutions and their ability to accurately predict the thermodynamic properties of aqueous multielectrolyte solutions. We conclude that refining and tailoring fundamental thermodynamic models to address the complexities of high-concentration regimes is essential for the design of advanced desalination systems and achieving improvements in energetic and economic efficiencies.</div></div>","PeriodicalId":292,"journal":{"name":"Current Opinion in Chemical Engineering","volume":"48 ","pages":"Article 101147"},"PeriodicalIF":8.0,"publicationDate":"2025-05-21","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144107810","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Radical-chemistry-driven polymer synthesis, modification, and recycling: trends in modeling to upgrade our knowledge and process design","authors":"Dagmar R D’hooge","doi":"10.1016/j.coche.2025.101144","DOIUrl":"10.1016/j.coche.2025.101144","url":null,"abstract":"<div><div>Polymer synthesis, modification, and recycling are important polymer reaction engineering (PRE) processes that rely in many cases on radical chemistry. The optimal settings and innovation depend strongly on the characterization degree, which is complicated by the many chain lengths, compositions, and topologies. To grasp macromolecular variations, we need to bridge experimental and modeling methods, the latter the focus of the present work. Emphasis is on (i) faster kinetic Monte Carlo simulations; (ii) the striving for universal solvers; (iii) protocols for parameter determination; (iv) modeling outputs for structure-property relationships; and (v) optimization via artificial intelligence and machine learning methods.</div></div>","PeriodicalId":292,"journal":{"name":"Current Opinion in Chemical Engineering","volume":"48 ","pages":"Article 101144"},"PeriodicalIF":8.0,"publicationDate":"2025-05-19","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144088925","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Oxidation of alcohols in photocatalytic hydrogen production: from sacrifice to valorization","authors":"Patricia Garcia-Muñoz , Fernando Fresno","doi":"10.1016/j.coche.2025.101146","DOIUrl":"10.1016/j.coche.2025.101146","url":null,"abstract":"<div><div>Photocatalytic hydrogen production, even if it should ideally be performed from pure water (i.e. <em>water splitting</em>), benefits from the presence of an <em>easily</em> oxidized reagent, either inorganic (classically sulfite/sulfide) or organic (classically methanol) that scavenges photoproduced holes and alleviates the process form the kinetically hindered, multi-electron process of water oxidation to molecular oxygen. Even if pioneering works of the photocatalytic reaction between alcohols and water examined the outcome of the oxidation branch of the reaction, the use of these reagents passed through a period in which reporting only hydrogen evolution became common practice, assuming total oxidation and taking the consumption of the organic as a <em>sacrifice</em> for hydrogen production. However, in more recent years, the oxidation outcome of the reaction has regained attention, mainly because of the interest in coupling photocatalysis with biomass utilization. Thus, the <em>valorization</em> of biomass-derived alcohol hole scavengers has become an interesting topic in photocatalysis research. Here, we highlight some recent works on this topic, selecting those that have received more attention in the last 2–5 years: polyol (glycerol, glucose) valorization, transformations of furfuryl alcohol and 5-hydroxymethyl furfural, and C-C coupling reactions starting from alcohols. In our opinion, these represent promising niches for the application of photocatalytic processes.</div></div>","PeriodicalId":292,"journal":{"name":"Current Opinion in Chemical Engineering","volume":"49 ","pages":"Article 101146"},"PeriodicalIF":8.0,"publicationDate":"2025-05-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143943484","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Role of dynamic gravity in marinized multiphase packed bed applications","authors":"Ion Iliuta, Faïçal Larachi","doi":"10.1016/j.coche.2025.101143","DOIUrl":"10.1016/j.coche.2025.101143","url":null,"abstract":"<div><div>Innovative, energy-efficient technologies for the capture and conversion of CO<sub>2</sub> from marine emissions offer a promising path to reducing CO<sub>2</sub> emissions in a circular economy. This emerging research area envisions CO<sub>2</sub> capture and conversion in multiphase packed columns and trickle beds on ships and floating production, storage, and offloading units. However, the associated marine environments, characterized by instability and motions, such as tilting, rolling, and heaving, disrupt fluid dynamics, mass transfer, and reaction performance. This contribution examines recent advances in modeling fluid dynamics in (random/structured) packed columns and trickle beds under simulated marine conditions and highlights the role of dynamic gravity in these marinized multiphase packed bed applications. Using transient three-dimensional Computational Fluid Dynamics CFD modeling and simulation, this work explores the effects of tilt angle, heave, and roll motion parameters to quantitatively address the influence of changing sea/ocean conditions. It attempts to shed light on the design and operation of marine/offshore unit operations. Of particular interest is the study's focus on the multiphase flow hydrodynamics under dynamic gravitational forces (high to zero gravity in radial/azimuthal directions or high to low gravity in axial direction of porous medium), resulting in unique patterns, such as axial asymmetric two-phase flows and oscillatory two-phase flows.</div></div>","PeriodicalId":292,"journal":{"name":"Current Opinion in Chemical Engineering","volume":"49 ","pages":"Article 101143"},"PeriodicalIF":8.0,"publicationDate":"2025-05-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143947450","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Solar energy–based sonophotocatalysis for intensified wastewater treatment","authors":"Manisha V Bagal , Parag R Gogate","doi":"10.1016/j.coche.2025.101145","DOIUrl":"10.1016/j.coche.2025.101145","url":null,"abstract":"<div><div>Sonophotocatalysis has gained attention recently for the effective treatment of wastewater, mainly based on the expected synergy from sonication and photocatalysis. The current work focuses on the guidelines related to the mechanisms for synergy, optimization of operating parameters, and reactor designs. The influence of operational parameters, including pH (acidic or alkaline conditions), pollutant concentration, catalyst loading, temperature, and irradiation duration, on degradation extent has been explained. In addition, the effect of reactor characteristics such as ultrasonic frequency and power has been discussed. A significantly higher synergistic pollutant removal has indeed been observed in sonophotocatalysis compared to conventional treatment methods. The incorporation of various doping materials and catalyst supports further enhances degradation efficiency. The expected advancement underscores the potential of sonophotocatalysis as a promising wastewater treatment technology, particularly for the effective elimination of recalcitrant organic contaminants. The review also presents the challenges of the current process and offers recommendations for its future expansion.</div></div>","PeriodicalId":292,"journal":{"name":"Current Opinion in Chemical Engineering","volume":"49 ","pages":"Article 101145"},"PeriodicalIF":8.0,"publicationDate":"2025-05-13","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143943483","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Husain A Sumeru , Fajriana S Nurrusyda , Nova Rachmadona , Kuan Shiong Khoo , Pau Loke Show
{"title":"Intensified cavitation process for the pretreatment of microalgae: a mini review","authors":"Husain A Sumeru , Fajriana S Nurrusyda , Nova Rachmadona , Kuan Shiong Khoo , Pau Loke Show","doi":"10.1016/j.coche.2025.101142","DOIUrl":"10.1016/j.coche.2025.101142","url":null,"abstract":"<div><div>Advancement of microalgae pretreatment is shifting toward scalable and cost-effective methodologies to exploit the composition of microalgae biomass. The phenomenon of cavitation demonstrates its potential in industrial processes and is now being harnessed as a pretreatment strategy in microalgae biorefinery. Cavitation techniques through ultrasonication and hydrodynamic cavitation have proven its potential at generating cavities whose implosions create shear stress capable of disrupting microalgae cell walls that increase the yield of bioactive compounds in microalgae biomass. Although this technology shows promising results in the bioprocess of microalgae biomass, the leap to commercialization is fraught with the cost-intensive process. Intensive processes involving optimizing energy efficiency, controlled cavitation, scaling-up technology, and ensuring high quality of extracted compounds remain key areas for further research. Resolving these issues is vital for integrating cavitation into microalgae biorefinery and unlocking various bioproduct development. This review aims to offer insight into the practical application of cavitation in microalgae biomass valorization. As research advances, the potential of cavitation applications will determine its viability as a sustainable industry-standard process.</div></div>","PeriodicalId":292,"journal":{"name":"Current Opinion in Chemical Engineering","volume":"48 ","pages":"Article 101142"},"PeriodicalIF":8.0,"publicationDate":"2025-05-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143911961","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Yajuan Shi , Fangyou Yan , Jie Jin , Zheng-Hong Luo , Yin-Ning Zhou
{"title":"Advances in calculation of kinetic parameters in free-radical polymerization by data-driven methods","authors":"Yajuan Shi , Fangyou Yan , Jie Jin , Zheng-Hong Luo , Yin-Ning Zhou","doi":"10.1016/j.coche.2025.101141","DOIUrl":"10.1016/j.coche.2025.101141","url":null,"abstract":"<div><div>Kinetic parameters of free-radical polymerization (FRP) are crucial for determining polymerization rate and polymer molecular properties. This opinion article presents various data-driven methods for the determination of kinetic parameters with several case studies based on quantitative structure–property relationships. Such methods allow accurately predict the influence of chemical structural information on kinetic parameters, aligning well with known scientific knowledge. On the long run, with the development of machine learning algorithms, kinetic parameters can be calculated more accurately and efficiently, which can not only deepen the understanding of polymerization kinetics but also help to design new reactants used in FRP.</div></div>","PeriodicalId":292,"journal":{"name":"Current Opinion in Chemical Engineering","volume":"48 ","pages":"Article 101141"},"PeriodicalIF":8.0,"publicationDate":"2025-05-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143902501","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Industrialization of hydrodynamic cavitation in plant resource extraction","authors":"Francesco Meneguzzo, Federica Zabini","doi":"10.1016/j.coche.2025.101140","DOIUrl":"10.1016/j.coche.2025.101140","url":null,"abstract":"<div><div>Substantial evidence has accumulated about the outstanding effectiveness and efficiency of controlled hydrodynamic cavitation (HC) processes for extracting plant resources, as well as its compliance with the principles of green extraction of natural products. A few applications, such as the manufacturing of certain vegetable beverages and beer, offer considerable potential for industrial applications. However, resistance to innovation and possibly the issue of capital costs needed to replace or integrate existing installations can represent important barriers. Further promising application fields concern the manufacturing of dry extracts rich in bioactive compounds from plant resources. However, water removal steps account for most of the energy consumption, thus as high as possible biomass concentration should be used, which sets the design and test of effective strategies to intensify cavitation as a research priority. This short review surveys the most recent studies and proposes practical recommendations toward the actual industrialization of HC processes.</div></div>","PeriodicalId":292,"journal":{"name":"Current Opinion in Chemical Engineering","volume":"48 ","pages":"Article 101140"},"PeriodicalIF":8.0,"publicationDate":"2025-05-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143898767","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}