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Editor's note to “A comprehensive review of the applications of machine learning for HVAC” [DeCarbon 2 (2024) 100023]
Pub Date : 2024-12-01 DOI: 10.1016/j.decarb.2024.100079
S.L. Zhou, A.A. Shah, P.K. Leung, X. Zhu, Q. Liao
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引用次数: 0
Editor's note to “Examining green-sustainable approaches for recycling of lithium-ion batteries” [DeCarbon 3 (2024) 100034]
Pub Date : 2024-12-01 DOI: 10.1016/j.decarb.2024.100081
Qi Zhao , Kuan Sun , Xun Wang , Qing Wang , John Wang
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引用次数: 0
Editor's note to “Host-guest regulations in functionalized metal and covalent organic frameworks raise the performance of lithium sulfur batteries” [DeCarbon 4 (2024) 100049]
Pub Date : 2024-12-01 DOI: 10.1016/j.decarb.2024.100082
Qilin Huang , Yulin Gao , Jianguo Sun , Binbin Liu , Ximeng Liu , Yuepeng Pang , Yu Liu , John Wang
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引用次数: 0
Editor's note to “Bio-decarbonization by microalgae: a comprehensive analysis of CO2 transport in photo-bioreactor” [DeCarbon 2 (2023) 100016]
Pub Date : 2024-12-01 DOI: 10.1016/j.decarb.2024.100078
Peirong Li , Yun Huang , Ao Xia , Xianqing Zhu , Xun Zhu , Qiang Liao
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引用次数: 0
Behavioral description of lithium-ion batteries by multiphysics modeling 通过多物理场建模对锂离子电池进行行为描述
Pub Date : 2024-10-15 DOI: 10.1016/j.decarb.2024.100076
Haosong Yang , Xueyan Li , Kang Fu , Wenxu Shang , Kai Sun , Zhi Yang , Guojun Hu , Peng Tan
Upgrades to power systems and the rapid growth of electric vehicles significantly heighten the importance of lithium-ion batteries (LiBs) in energy systems. As a complex dynamic system, the charging and discharging process of LiBs involves the evolution of multiphysics fields, such as concentration, electricity, and stress. For quantitative analysis of the internal mechanisms of LiBs, as well as the development guidance and performance prediction of high-performance batteries, modeling has advantages that cannot be matched by traditional experimental methods. Major research efforts in the past decades have made significant strides in modeling the internal processes and physical field evolution of LiBs. Importantly, the scattered ideas need to be integrated into a structured framework to form a complete LiBs multi-physical field model. This work reviews important advances in LiBs modeling from the perspectives of describing the internal processes of the battery and portraying the evolution of the physical field. First, quantitative descriptions of the charging and discharging behaviors and the side reactions are reviewed to investigate the battery reaction mechanisms. In addition, the characterization of the evolution of the stress and temperature fields within the battery as well as the coupling between them and the internal reactions are discussed. Finally, some suggestions for future improvements in the modeling are given, ranging from equation optimization to parameter acquisition and the application of artificial intelligence. It is hoped that this work will facilitate the development of models with sufficient accuracy and efficient computational cost to provide guidance for the improvement of LiBs.
电力系统的升级和电动汽车的快速发展大大提高了锂离子电池(LiBs)在能源系统中的重要性。作为一个复杂的动态系统,锂电池的充放电过程涉及浓度、电量和应力等多物理场的演变。对于锂电池内部机理的定量分析,以及高性能电池的开发指导和性能预测,建模具有传统实验方法无法比拟的优势。过去几十年的主要研究工作在锂电池内部过程和物理场演化的建模方面取得了重大进展。重要的是,需要将分散的想法整合到一个结构化框架中,以形成完整的锂电池多物理场模型。本研究从描述电池内部过程和描绘物理场演变的角度,回顾了锂电池建模的重要进展。首先,回顾了充放电行为和副反应的定量描述,以研究电池反应机制。此外,还讨论了电池内部应力场和温度场的演变特征,以及它们与内部反应之间的耦合。最后,还对建模的未来改进提出了一些建议,包括方程优化、参数采集和人工智能应用等。希望这项工作能促进开发具有足够准确性和高效计算成本的模型,为改进锂电池提供指导。
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引用次数: 0
Numerical study on induction heating enhanced methanol steam reforming for hydrogen production 感应加热强化甲醇蒸汽转化制氢的数值研究
Pub Date : 2024-09-30 DOI: 10.1016/j.decarb.2024.100075
Feng Wang , Delun Guan , Chuncen Wu , Xiuqin Zhang , Guoqiang Wang
Electromagnetic induction heating technology, characterized by its non-contact thermal heat transfer, diminished thermal inertia, and facile temperature management, is applied in this study to enhance catalytic methanol steam reforming (MSR) reaction process. A two-dimensional reactor model was developed integrating electromagnetic field coupling with MSR reactions, fluid dynamics and heat transfer. In the reactor, heat is induced instantaneously on the magnetic material through an electromagnetic induction process, which generated by renewable electricity. Results showed that the Internal - Double Row Cylinder (IN-DRC, cylinder means that the shape of induction heating element is cylindrical.) highest heating efficiency is 38.3%, which is limited by the kinetics of MSR reaction. Here, thermal efficiency reaches its maximum with the reaction channel outlet temperature reaching about 580 K. Internal - Double Row Cylinder (IN-DRC) and Internal - Double Row Ball (IN-DRB, ball means that the shape of induction heating element is spherical) methanol conversions are virtually identical, with a maximum value close to 100%. Furthermore, the findings that the adoption of internal induced heating, in contrast to external heating, across the four reactor designs can effectively mitigate temperature gradient within the reactors. This reduction in thermal disparity significantly amplifies methanol conversion within the reactor, thereby markedly enhancing its overall performance in hydrogen production.Therefore, non-contact internal induction heating method has the potential for substantially hydrogen production processes.
电磁感应加热技术具有非接触式热传导、热惯性小和温度管理方便等特点,本研究将其应用于提高催化甲醇蒸汽转化(MSR)反应过程。研究建立了一个二维反应器模型,该模型将电磁场耦合与 MSR 反应、流体动力学和传热学融为一体。在反应器中,通过电磁感应过程在磁性材料上瞬间产生热量,该过程由可再生能源发电产生。结果表明,内部-双排圆柱体(IN-DRC,圆柱体指感应加热元件的形状为圆柱形)的加热效率最高,为 38.3%,这受到 MSR 反应动力学的限制。内部-双排圆筒(IN-DRC)和内部-双排球(IN-DRB,球指感应加热元件的形状为球形)的甲醇转化率几乎相同,最高值接近 100%。此外,研究结果表明,在四种反应器设计中采用内部感应加热,而不是外部加热,可以有效缓解反应器内的温度梯度。因此,非接触式内部感应加热法具有大幅提高制氢工艺的潜力。
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引用次数: 0
Electrocatalytic lignin oxidation for hydrogen and fine chemical co-production using platinized nickel foam in a 3D printed reactor 在 3D 打印反应器中使用泡沫铂化镍进行电催化木质素氧化,以联合生产氢气和精细化学品
Pub Date : 2024-09-14 DOI: 10.1016/j.decarb.2024.100074
Mohmmad Khalid, Biswajit Samir De, Samaneh Shahgaldi
Biomass electrooxidation has garnered much attention in recent years, owing to its potential to circumvent greenhouse gas emissions. Substituting the sluggish water oxidation with biomass oxidizable species such as lignin at anode is thermodynamically more favorable, enabling energy efficient hydrogen production and concomitant fine chemicals. The present study shows the organosolv lignin electrooxidation in an additively manufactured 3D printed reactor (3DPR) consisting of platinized nickel foam (PtNF) as anode and cathode and compared with commercial hardware electrolyzer (CHE). The electrolysis of organosolv lignin in 3DPR outperformed CHE by achieving 1.23 times higher current at an applied voltage range from 0 to 2.2 ​V with a membrane (Nafion 115) interposed between anode and cathode under a continuous flow of lignin feed at the anode. The chronoamperometry study reveals a mixture of diverse aromatic compounds, including vanillic acid, syringic acid, 3,5-dimethoxy-4-hydroxyacetophenone, 2-hydroxyacetophenone, 4-ethycathecol, and 2,6-dimethoxyphenol in anolyte, and sinapic acid and vanillin acetate in catholyte. Thus, realizing renewable biomass electrolysis in the 3DPR is an intriguing strategy for the co-production of hydrogen and fine aromatic chemicals.
近年来,生物质电氧化法因其避免温室气体排放的潜力而备受关注。在阳极用木质素等生物质可氧化物代替缓慢的水氧化,在热力学上更为有利,可实现高能效制氢和相应的精细化学品。本研究展示了有机溶胶木质素在添加式制造的三维打印反应器(3DPR)中的电氧化过程,该反应器由铂化镍泡沫(PtNF)作为阳极和阴极组成,并与商用硬件电解槽(CHE)进行了比较。有机溶胶木质素在 3DPR 中的电解性能优于 CHE,在 0 至 2.2 V 的施加电压范围内,阳极和阴极之间有一层膜(Nafion 115),在阳极木质素进料连续流动的情况下,3DPR 的电流是 CHE 的 1.23 倍。时变研究显示,在阳极溶液中存在多种芳香族化合物的混合物,包括香草酸、丁香酸、3,5-二甲氧基-4-羟基苯乙酮、2-羟基苯乙酮、4-乙基己醇和 2,6-二甲氧基苯酚,在阴极溶液中存在山奈酸和乙酸香草酯。因此,在 3DPR 中实现可再生生物质电解是一种联合生产氢气和精细芳香化学品的有趣策略。
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引用次数: 0
Investigating mass transport in Li-ion battery electrodes using SECM and SICM 利用 SECM 和 SICM 研究锂离子电池电极中的质量传输
Pub Date : 2024-08-27 DOI: 10.1016/j.decarb.2024.100073
Anjana Raj Raju, Andrew Danis, Steen B. Schougaard

Lithium-ion batteries (LIBs) are indispensable as global energy production transitions to sustainable production. Nevertheless, the use of LIBs in renewable energy storage applications is challenging due to their limited power densities. To comprehend the origin of this limitation, it is crucial to investigate the effect of electrode architecture on the Li+ ion transport within their pores (solution-phase). In this work, the solution phase transport in various porous Li4Ti5O12 (LTO) films was investigated using scanning ion conductance microscopy (SICM) and scanning electrochemical microscopy (SECM). When the porosity of LTO film increases, SECM and SICM approach curves show an increase in current. This is attributed to the ion transport through the film pores. The 2D topographical mapping using both techniques shows their ability to detect the LTO film's heterogeneity. Most importantly, this work gives insight into the complementary nature of the two scanning probe techniques as demonstrated by the comparable MacMullin numbers.

在全球能源生产向可持续生产转型的过程中,锂离子电池(LIB)是不可或缺的。然而,由于锂离子电池的功率密度有限,在可再生能源存储应用中使用锂离子电池具有挑战性。要理解这一限制的根源,研究电极结构对其孔隙(溶液相)内 Li+ 离子传输的影响至关重要。在这项工作中,使用扫描离子传导显微镜(SICM)和扫描电化学显微镜(SECM)研究了各种多孔 Li4Ti5O12(LTO)薄膜中的溶液相传输。当 LTO 薄膜的孔隙率增加时,SECM 和 SICM 方法曲线显示电流增加。这归因于离子通过薄膜孔隙的传输。使用这两种技术绘制的二维地形图显示了它们检测 LTO 薄膜异质性的能力。最重要的是,这项工作让人们深入了解了这两种扫描探针技术的互补性,可比较的 MacMullin 数证明了这一点。
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引用次数: 0
Effects of silico-tungstic acid on the pseudo capacitive properties of manganese oxide for electrochemical capacitors applications 硅钨酸对电化学电容器应用中氧化锰伪电容特性的影响
Pub Date : 2024-08-10 DOI: 10.1016/j.decarb.2024.100066
Barham Thiam, Oumarou Savadogo

In this work manganese oxide (MnO2) is modified with silico-tungstic acid (STA). Three samples are synthesized by the co-precipitation method. The powders obtained after elaboration are characterized by X-ray diffraction (XRD), Scanning Electron Microscopy (SEM) imaging coupled to Electron Dispersive Spectroscopy (EDS) analysis and Brunauer-Emmet-Teller (BET) for their surface area determination. The effect of the modification of the manganese oxide with STA on its surface is determined. It is shown that MnO2 modified with STA exhibits better cumulative high specific surface areas and mesoporous volumes areas. For example, the sample fabricates with 10% STA (MnO2 – 10% STA) has a BET surface area of 153.6 ​m2 ​g−1 and volume area 0.92 ​cm3 ​g−1 whereas the sample without STA (MnO2 – 0% STA) has a surface area of 132.57 ​m2 ​g−1 and a mesoporous area of 0.26 ​cm3 ​g−1. The electrochemical performance analysis of the different working electrodes prepared for super-capacitors applications is carried out using cyclic voltammetry (CV)., using a solution of 0.5 M K2SO4 as an electrolyte in potential range of −0.4 and 0.9 ​V at a sweep speed of 10 ​mV/s. The CV results are correlated to those of the BET surface and mesoporous areas values Accordingly, it is shown that samples spiked with STA exhibit higher electrochemical double layer capacitance than those of none modified with STA. These measurements respectively give 38 ​F ​g−1, and 181 ​F ​g−1 for MnO2 without STA (MnO2 – 0% STA), and MnO2 modified with 10% STA (MnO2 – 5% STA).

这项研究用硅钨酸(STA)对氧化锰(MnO2)进行了改性。通过共沉淀法合成了三种样品。通过 X 射线衍射 (XRD)、扫描电子显微镜 (SEM) 成像和电子分散光谱 (EDS) 分析,以及测定表面积的布鲁诺-艾美特-泰勒 (BET) 法,对制备后得到的粉末进行了表征。测定了用 STA 修饰氧化锰对其表面的影响。结果表明,用 STA 修饰的二氧化锰具有更好的累积高比表面积和介孔体积面积。例如,用 10% STA 制造的样品(MnO2 - 10% STA)的 BET 表面积为 153.6 m2 g-1,体积面积为 0.92 cm3 g-1,而不含 STA 的样品(MnO2 - 0% STA)的表面积为 132.57 m2 g-1,介孔面积为 0.26 cm3 g-1。使用循环伏安法(CV)对为超级电容器应用制备的不同工作电极进行了电化学性能分析,使用 0.5 M K2SO4 溶液作为电解质,电位范围为 -0.4 至 0.9 V,扫描速度为 10 mV/s。CV 结果与 BET 表面和介孔面积值相关。测量结果表明,不添加 STA 的 MnO2(MnO2 - 0% STA)和添加 10% STA 的 MnO2(MnO2 - 5% STA)的电化学双层电容分别为 38 F g-1 和 181 F g-1。
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引用次数: 0
Multi-interfaced FeCoNi@C/carbon cloth composites for eliminating electromagnetic wave pollution 用于消除电磁波污染的多界面 FeCoNi@C/碳布复合材料
Pub Date : 2024-08-04 DOI: 10.1016/j.decarb.2024.100065
Changlong Du , Ying Zhang , Gengping Wan , Lihong Wu , Liang Li , Pengpeng Mou , Lianrui Li , Hualin Xiong , Guizhen Wang

To tackle the increasing electromagnetic pollution, new and efficient electromagnetic wave absorption (EWA) and shielding (EWS) materials are urgently needed. Multi-component synergism and complex microstructure design are effective measures to improve the EWA and EWS properties. However, how to implement the above designs still faces huge challenges. Herein, multi-interface carbon-coated FeCoNi nanoneedles grown on carbon cloth (FeCoNi@C/CC) were synthesized by a combination of hydrothermal process and chemical vapor deposition (CVD) technology with the concept of “green synthesis”. Using acetylene as the carbon source and atmosphere, the FeCoNi ternary hydroxide can be transformed into a multiple magnetic component (Fe3O4, Ni, and Co metals) by simple annealing. Simultaneously, a uniform carbon layer is formed on the surface, resulting in a composite system with a variety of heterogeneous interfaces and loss mechanisms. Additionally, the dielectric and magnetic loss capacities can be effectively adjusted by changing the temperature of CVD. The optimized FeCoNi@C/CC as filler exhibits remarkable EWA performance with a minimum reflection loss of −69.3 ​dB at a thickness of 1.82 ​mm and a maximum effective absorption bandwidth of 6.80 ​GHz. Moreover, the composites as an integrated component also show a fascinating electromagnetic interference shielding efficiency of 42.2 ​dB. This work provides a guide for the structural design of high-performance electromagnetic protection materials with multi-heterogeneous interfaces.

为应对日益严重的电磁污染,迫切需要新型高效的电磁波吸收(EWA)和屏蔽(EWS)材料。多组分协同作用和复杂微结构设计是改善电磁波吸收和电磁波屏蔽性能的有效措施。然而,如何实现上述设计仍面临巨大挑战。本文以 "绿色合成 "为理念,结合水热法和化学气相沉积(CVD)技术,合成了生长在碳布上的多界面碳涂层铁钴镍纳米针(FeCoNi@C/CC)。以乙炔为碳源和气氛,通过简单的退火将铁钴镍三元氢氧化物转化为多种磁性成分(Fe3O4、镍和钴金属)。同时,表面会形成一层均匀的碳层,从而形成一个具有多种异质界面和损耗机制的复合系统。此外,还可以通过改变 CVD 温度来有效调节介电和磁损耗容量。经过优化的 FeCoNi@C/CC 填充物表现出卓越的 EWA 性能,在厚度为 1.82 mm 时的最小反射损耗为 -69.3 dB,最大有效吸收带宽为 6.80 GHz。此外,复合材料作为一个集成组件还显示出 42.2 dB 的惊人电磁干扰屏蔽效率。这项研究为具有多异质界面的高性能电磁防护材料的结构设计提供了指导。
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