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Recent advances in amine catalyzed aldol condensations 胺催化醛缩反应的研究进展
Pub Date : 2022-04-03 DOI: 10.1080/01614940.2022.2048570
Bert Biesemans, J. Clercq, C. Stevens, J. Thybaut, J. Lauwaert
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引用次数: 7
Recent advances in BiOX-based photocatalysts to enhanced efficiency for energy and environment applications 生物氧化物基光催化剂在提高能源和环境应用效率方面的最新进展
Pub Date : 2022-03-24 DOI: 10.1080/01614940.2022.2041836
Asif Hussain, Jianhua Hou, M. Tahir, S. Ali, Z. Rehman, Muhammad Bilal, Tingting Zhang, Qian Dou, Xiaozhi Wang
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引用次数: 18
Organocatalysis: A recent development on stereoselective synthesis of o-glycosides 有机催化:邻糖苷立体选择性合成的新进展
Pub Date : 2022-03-21 DOI: 10.1080/01614940.2022.2041303
R. N. Yadav, Firoj Hossain, Aparna Das, A. Srivastava, B. Banik
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引用次数: 4
Silicon carbide in catalysis: from inert bed filler to catalytic support and multifunctional material 碳化硅在催化中的应用:从惰性床填料到催化载体和多功能材料
Pub Date : 2022-01-22 DOI: 10.1080/01614940.2022.2025670
Shekhar R. Kulkarni, Vijay Kumar Velisoju, F. Tavares, A. Dikhtiarenko, J. Gascón, P. Castaño
ABSTRACT Silicon carbide (SiC) or carborundum has unparalleled thermal stability and conductivity compared with many other materials. This feature together with its unique photoelectrical properties (tunable band gap: 2.39–3.33 eV), low thermal expansion, high strength, and good chemical and thermal stability makes it an ideal inert solid in catalysis. The evolution of methods for synthesizing SiC has also progressively endowed it with additional features at the multiscale. This review tracks the development of SiC from a secondary to a leading role material in catalysis. First, the intrinsic properties of SiC are discussed and compared with other state-of-the-art catalytic materials. The synthetic methods are systematically reviewed and compared. Then, the applications of SiC in catalysis are assessed, paying particular attention to those that involve C1 chemistry (Fischer–Tropsch Synthesis and the valorization of CO2 and CH4), photocatalysis and biomass conversion. Finally, the potential future applications of SiC are also addressed and discussed. Graphical Abstract
与许多其他材料相比,碳化硅(SiC)或碳化硅具有无与伦比的热稳定性和导电性。这一特性加上其独特的光电性能(可调带隙:2.39-3.33 eV)、低热膨胀、高强度、良好的化学和热稳定性,使其成为催化领域理想的惰性固体。合成碳化硅方法的发展也逐渐赋予了它在多尺度上的附加特征。本文回顾了碳化硅在催化领域从次要材料到主导材料的发展历程。首先,讨论了碳化硅的本征性质,并与其他先进的催化材料进行了比较。对各种合成方法进行了系统的评述和比较。然后,评估了SiC在催化中的应用,重点关注了涉及C1化学(费托合成和CO2和CH4的增值),光催化和生物质转化的应用。最后,对碳化硅未来的应用前景进行了展望和讨论。图形抽象
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引用次数: 7
Contribution of DFT to the optimization of Ni-based catalysts for dry reforming of methane: a review DFT对甲烷干重整镍基催化剂优化的贡献综述
Pub Date : 2022-01-21 DOI: 10.1080/01614940.2021.2020518
Oualid Alioui, M. Badawi, A. Erto, Mohammed A. Amin, V. Tirth, Byong-hun Jeon, S. M. Fakhrul Islam, M. Balsamo, M. Virginie, B. Ernst, Yacine Benguerba
ABSTRACT In recent years, Density Functional Theory (DFT) simulations have been utilized to gain insight into the Dry Reforming of Methane (DRM) process. It enables new and improved management of current reactions, acquiring extra information about specific elements of the catalytic process, and developing practical methods for rational in silico catalyst design. This study covers the significance of DFT and current research on Ni-based catalysts in the DRM process, including the reaction mechanism, coke production, metal sintering, and metal support interactions. The DFT tool may explain the catalytic characteristics of Ni-based catalysts and their relationship with their catalytic performances, which are necessary tools for a rational design of appropriate catalytic systems for DRM applications.
近年来,密度泛函理论(DFT)模拟被用于深入了解甲烷干重整(DRM)过程。它使新的和改进的管理当前的反应,获得有关催化过程的特定元素的额外信息,并开发合理的硅催化剂设计的实用方法。本研究涵盖了DFT的意义和ni基催化剂在DRM过程中的研究现状,包括反应机理、焦炭的产生、金属烧结和金属载体相互作用。DFT工具可以解释镍基催化剂的催化特性及其与催化性能的关系,这是合理设计适合DRM应用的催化体系的必要工具。
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引用次数: 7
Molecular Kinetic Modeling of Catalytic Naphtha Reforming: A Review of Complexities and Solutions 催化石脑油重整的分子动力学建模:复杂性及其解决方案综述
Pub Date : 2022-01-05 DOI: 10.1080/01614940.2021.2008622
S. A. Ali, Ali H. Alshareef, Rajesh Theravalappil, H. Alasiri, Mohammad M. Hossain
ABSTRACT Kinetic modeling is receiving more attention in recent years due to the availability of advanced computational tools and enhancement in the accuracy of analytical techniques. These advances facilitate investigation of the chemical transformations on a molecular level rather than on the bulk properties, such as density, distillation cuts, or octane number. Molecular kinetic modeling of catalytic naphtha reforming is of particular interest as it processes light petroleum fraction that enable full molecular-level analysis. Moreover, the process is an important source of valuable chemicals, hydrogen, and high-octane transportation fuel. Over the years, the goal of the kinetic modeling has evolved from predicting the octane number or other properties of reformate to tracking a particular molecule, such as benzene. Several kinetic models are published in the last decade – each of them strived to adopt somewhat different approach either in the complexity of proposed reaction network or in the methodology of estimating the kinetic parameters. The approaches that have been considered in formulating the rate expressions include: (i) classical power-law model; (ii) models based on Langmuir-Hinshelwood–Hougen–Watson kinetics; (iii) structure-oriented kinetics approach; and (iv) single-event fundamental model. The review presents a systematic comparison of these kinetic models in depth as well as their limitations. An appraisal of the mathematical methods for estimation of kinetic parameters and the computational tools employed for determination of the numerical values of these parameters is made. Finally, the current trends and outlook of this field is presented.
近年来,由于先进的计算工具的可用性和分析技术准确性的提高,动力学建模受到越来越多的关注。这些进步有助于在分子水平上研究化学转化,而不是在体积性质上,如密度、蒸馏切割或辛烷值。催化石脑油重整的分子动力学建模是特别感兴趣的,因为它处理轻石油馏分,使全分子水平的分析。此外,该过程是有价值的化学品、氢和高辛烷值运输燃料的重要来源。多年来,动力学建模的目标已经从预测重整物的辛烷值或其他性质发展到跟踪特定的分子,如苯。在过去的十年中发表了几个动力学模型,每个模型都试图采用不同的方法,无论是在提出的反应网络的复杂性还是在估计动力学参数的方法上。在表述速率表达式时考虑的方法包括:(i)经典幂律模型;(ii)基于Langmuir-Hinshelwood-Hougen-Watson动力学模型;(iii)结构导向动力学方法;(四)单事件基本模型。本文对这些动力学模型进行了系统的比较,并对它们的局限性进行了比较。评价了估计动力学参数的数学方法和用于确定这些参数数值的计算工具。最后,对该领域的发展趋势和前景进行了展望。
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引用次数: 4
Catalytic tri- and tetramerization of ethylene: a mechanistic overview 乙烯催化三聚和四聚:机理综述
Pub Date : 2022-01-03 DOI: 10.1080/01614940.2021.2014638
G. Tembe
ABSTRACT On purpose, selective oligomerization of ethylene to its linear trimer and tetramer such as 1-hexene and 1-octene has assumed significant commercial interest. Catalytic systems based on chromium and titanium have shown remarkable selectivity and productivity for the tri and tetramerization of ethylene to 1-hexene or 1-octene. Chromium-based catalysts are the most selective and active and show the highest structural diversity. This article discusses the most recent mechanistic approaches regarding active catalytic species that determine the selectivity to either hexene-1 or octene-1 and reaction parameters that control selectivity of byproducts. Isotopic labeling protocols, in-situ spectroscopic investigations and DFT studies on selected chromium-based catalyst systems are reviewed.
乙烯选择性低聚成线性三聚体和四聚体,如1-己烯和1-辛烯,具有重要的商业意义。基于铬和钛的催化体系在乙烯三聚和四聚制1-己烯或1-辛烯方面表现出显著的选择性和生产率。铬基催化剂的选择性和活性最高,结构多样性也最高。本文讨论了有关活性催化物质决定对己烯-1或辛烯-1的选择性和控制副产物选择性的反应参数的最新机理方法。对选定的铬基催化剂体系的同位素标记方案、原位光谱研究和DFT研究进行了综述。
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引用次数: 3
Progressions in cathodic catalysts for oxygen reduction and hydrogen evolution in bioelectrochemical systems: Molybdenum as the next-generation catalyst 生物电化学系统中氧还原和析氢阴极催化剂的研究进展:钼作为下一代催化剂
Pub Date : 2021-12-27 DOI: 10.1080/01614940.2021.2003085
P. Mishra, Putla Sudarsanam, D. Mahapatra, Ahamad Elmekawy, D. Pant, L. Singh
ABSTRACT Oxygen reduction reactions (ORRs) are unanimously a key factor of system performances in bioelectrochemical systems (BESs), low-temperature fuel cells, and generally in several electrochemical platforms. Platinum (Pt)-based catalyst is the finest electrocatalyst for ORR in BESs; however, it is constrained by its low abundance, high price, and poor catalytic durability in an electrochemical setup for cathodic reaction kinetics. In recent years, significant efforts in trimming the metal-based catalyst up to nanoscale to cater high performance of ORR have been explored. Still, there are many opportunities to improve catalyst performance at cathode through proper selection of an efficient low-cost metal-based ORR catalyst. Molybdenum (Mo) with its multi-dimensional form as 2D and 3D layers and synergistic combination with other non-metals offers prospects of extraordinary performance as low-cost metal-based ORR catalyst over the Pt in delivering enhanced ORR potential. The present review throws light on current requirements of a sturdier catalyst material and thus provides a comprehensive review on the continuing efforts in exploring the possibility of Mo as a low-cost metal-based ORR catalyst. This literature analysis would enlighten the significance of ORR in BESs, followed by the electrochemistry of Mo-based cathodic catalyst, its underlying mechanism and performance limiting factors in the operation of ORR. Moreover, the extensive and systematic acumen in the context of Mo-based catalytic formulations for increased ORR potentials including nano-composite Mo-cathode catalyst; development of Mo-catalyst with varied configurations; carbon-supported Mo-catalyst; morphological changes; surface area modifications; and Mo-coupling with other transition metal and its derivatives were discussed in great detail to provide prospective application of Mo-based catalyst. Lastly, numerous opportunities and projections for future research in fabrication, juxtaposition, and implementation of Mo-based cathodic catalysts and consequent recommendations were discussed as conclusive remarks for bringing out the state-of-the-art review on this subject. Graphical abstract
氧还原反应(ORRs)一直是生物电化学系统(BESs)、低温燃料电池以及各种电化学平台中系统性能的关键因素。铂基催化剂是BESs中最好的ORR电催化剂;然而,在阴极反应动力学的电化学设置中,它受到丰度低、价格高和催化耐久性差的限制。近年来,为了满足ORR的高性能要求,人们对金属基催化剂的纳米级修饰进行了大量探索。尽管如此,通过适当选择高效、低成本的金属基ORR催化剂,仍有许多机会可以提高阴极催化剂的性能。钼(Mo)以其2D和3D层的多维形式,与其他非金属的协同组合,作为低成本的金属基ORR催化剂,在提供增强的ORR潜力方面比铂具有非凡的性能。本综述揭示了目前对更坚固的催化剂材料的需求,从而对继续探索Mo作为低成本金属基ORR催化剂的可能性进行了全面的回顾。通过文献分析,首先阐明ORR在BESs中的意义,其次阐述钼基阴极催化剂的电化学性质、作用机理以及ORR运行中性能限制因素。此外,在提高ORR电位的钼基催化配方方面的广泛和系统的敏锐,包括纳米复合钼阴极催化剂;多种构型钼催化剂的研制;carbon-supported Mo-catalyst;形态变化;表面积修改;并详细讨论了钼与其他过渡金属及其衍生物的偶联,为钼基催化剂的应用前景提供了参考。最后,讨论了钼基阴极催化剂在制备、并置和实施方面的许多未来研究机会和预测,并提出了相应的建议,作为结论性评论,提出了这一主题的最新进展。图形抽象
{"title":"Progressions in cathodic catalysts for oxygen reduction and hydrogen evolution in bioelectrochemical systems: Molybdenum as the next-generation catalyst","authors":"P. Mishra, Putla Sudarsanam, D. Mahapatra, Ahamad Elmekawy, D. Pant, L. Singh","doi":"10.1080/01614940.2021.2003085","DOIUrl":"https://doi.org/10.1080/01614940.2021.2003085","url":null,"abstract":"ABSTRACT Oxygen reduction reactions (ORRs) are unanimously a key factor of system performances in bioelectrochemical systems (BESs), low-temperature fuel cells, and generally in several electrochemical platforms. Platinum (Pt)-based catalyst is the finest electrocatalyst for ORR in BESs; however, it is constrained by its low abundance, high price, and poor catalytic durability in an electrochemical setup for cathodic reaction kinetics. In recent years, significant efforts in trimming the metal-based catalyst up to nanoscale to cater high performance of ORR have been explored. Still, there are many opportunities to improve catalyst performance at cathode through proper selection of an efficient low-cost metal-based ORR catalyst. Molybdenum (Mo) with its multi-dimensional form as 2D and 3D layers and synergistic combination with other non-metals offers prospects of extraordinary performance as low-cost metal-based ORR catalyst over the Pt in delivering enhanced ORR potential. The present review throws light on current requirements of a sturdier catalyst material and thus provides a comprehensive review on the continuing efforts in exploring the possibility of Mo as a low-cost metal-based ORR catalyst. This literature analysis would enlighten the significance of ORR in BESs, followed by the electrochemistry of Mo-based cathodic catalyst, its underlying mechanism and performance limiting factors in the operation of ORR. Moreover, the extensive and systematic acumen in the context of Mo-based catalytic formulations for increased ORR potentials including nano-composite Mo-cathode catalyst; development of Mo-catalyst with varied configurations; carbon-supported Mo-catalyst; morphological changes; surface area modifications; and Mo-coupling with other transition metal and its derivatives were discussed in great detail to provide prospective application of Mo-based catalyst. Lastly, numerous opportunities and projections for future research in fabrication, juxtaposition, and implementation of Mo-based cathodic catalysts and consequent recommendations were discussed as conclusive remarks for bringing out the state-of-the-art review on this subject. Graphical abstract","PeriodicalId":9647,"journal":{"name":"Catalysis Reviews","volume":"39 1","pages":"986 - 1078"},"PeriodicalIF":0.0,"publicationDate":"2021-12-27","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"87151480","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 3
Recent progress in the application of Ni-based catalysts for the dry reforming of methane 镍基催化剂在甲烷干重整中的应用进展
Pub Date : 2021-12-06 DOI: 10.1080/01614940.2021.2006891
J. J. Torrez-Herrera, S. Korili, A. Gil
ABSTRACT Ni-based catalysts are highly efficient in methane-reforming processes. In the particular case of methane reforming in the presence of carbon dioxide, or dry reforming of methane (DRM), it is necessary to modify and control the initial properties of the catalyst to confer on it resistance to carbon deposition in particular, and to sintering of the Ni metal particles. In this regard, catalytic supports and promoters of different natures have been proposed. Likewise, the addition of small amounts of noble metals to avoid oxidation of the Ni active phase during the reforming reaction has been proposed. Catalyst preparation methods have also been identified as being of particular interest, since they can affect the structure of the Ni metal particles. In this review, the thermodynamic and kinetic aspects of the dry reforming of methane reaction are presented first. The most recent developments in synthetic methods (impregnation, sol-gel, co-precipitation, equilibrium deposition filtration, atomic layer deposition, non-thermal glow discharge plasma, multi-bubble sonoluminescence, “core-shell” structure) aimed at maximizing the dispersion and thermal resistance of Ni particles are then discussed and compared. The catalytic supports used to promote dispersion of the active metallic phase, the oxygen-storage capacity, and the metal/support interaction are also described. The review then addresses the fact that both the nature of the support and the addition of promoters and other metallic phases that modify the surface properties can control the interaction between the metal and the support, the electronic density of the active phase, and the degree of Ni reduction. Finally, new lines of research focused on the DRM process to make the reaction conditions milder and favor the process at low temperatures are also summarized.
镍基催化剂在甲烷重整过程中具有很高的效率。在有二氧化碳存在的甲烷重整或甲烷干重整(DRM)的特殊情况下,有必要修改和控制催化剂的初始性质,使其具有抗碳沉积的能力,特别是抗Ni金属颗粒的烧结能力。在这方面,已经提出了不同性质的催化载体和促进剂。同样,在重整反应中加入少量贵金属以避免Ni活性相的氧化也被提出。催化剂的制备方法也被认为是特别有趣的,因为它们可以影响镍金属颗粒的结构。本文首先介绍了甲烷干重整反应的热力学和动力学方面的研究进展。然后讨论和比较了旨在最大化Ni颗粒分散和热阻的合成方法(浸渍、溶胶-凝胶、共沉淀法、平衡沉积过滤、原子层沉积、非热辉光放电等离子体、多泡声致发光、“核-壳”结构)的最新进展。还描述了用于促进活性金属相分散的催化载体、储氧能力和金属/载体的相互作用。然后回顾了这样一个事实,即载体的性质和添加促进剂和其他金属相可以改变表面性能,可以控制金属与载体之间的相互作用,活性相的电子密度和Ni还原程度。最后,总结了DRM工艺的新研究方向,以使反应条件更温和,有利于在低温下进行。
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引用次数: 13
Recent advances in engineering montmorillonite into catalysts and related catalysis 工程蒙脱土催化剂及相关催化的最新进展
Pub Date : 2021-11-25 DOI: 10.1080/01614940.2021.1995163
Wei Jun Huang, Jia Hui Liu, Qingyan She, J. Zhong, G. Christidis, C. Zhou
ABSTRACT Montmorillonite, a ubiquitous clay mineral, has been engineered into a variety of porous and nanostructured catalysts, owing to its peculiar layered structure with characteristic surface and intercalation chemistry. Such a class of catalysts have continuously received considerable attention in both science and industry. This review examines recent advance in engineering montmorillonite into metal ion-exchanged montmorillonite catalysts, acid-activated montmorillonite catalysts, organo-montmorillonite catalysts, pillared interlayered montmorillonite catalysts and montmorillonite-supported catalysts. The former two types of montmorillonite-based catalysts have been used in the catalytic cracking, dehydration, hydrolysis, esterification, polymerization, alkylation, and Fischer-Tropic synthesis. The introduction of oxide pillars in the interlayer space of montmorillonite and the immobilization of metal oxides or zero-valent metals on the surface of montmorillonite allow montmorillonite to be used in the catalytic oxidation, reduction, isomerization and coupling reactions. Currently, the role of montmorillonite in acid catalysis, redox catalysis, and free radical catalysis have been partly revealed. The effect of the structures and the active sites of modified montmorillonite on its catalytic performance need to be investigated in more detail. Future work is suggested to focus on solving engineering problems and exploring novel catalytic applications of montmorillonite, in particular exfoliated montmorillonite nanolayers.
蒙脱土是一种普遍存在的粘土矿物,由于其独特的层状结构,具有独特的表面和插层化学性质,已被设计成各种多孔和纳米结构的催化剂。这类催化剂在科学界和工业界一直受到相当大的关注。综述了工程蒙脱土在金属离子交换蒙脱土催化剂、酸活化蒙脱土催化剂、有机蒙脱土催化剂、柱状层间蒙脱土催化剂和蒙脱土负载型催化剂等方面的研究进展。前两种蒙脱石基催化剂已用于催化裂化、脱水、水解、酯化、聚合、烷基化和费歇尔合成。在蒙脱土层间空间引入氧化柱,并将金属氧化物或零价金属固定在蒙脱土表面,使蒙脱土可用于催化氧化、还原、异构化和偶联反应。目前,蒙脱土在酸催化、氧化还原催化、自由基催化等方面的作用已得到部分揭示。改性蒙脱土的结构和活性位点对其催化性能的影响有待进一步研究。建议今后的工作重点是解决工程问题和探索新的催化应用蒙脱土,特别是剥离蒙脱土纳米层。
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引用次数: 13
期刊
Catalysis Reviews
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