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MSTFormer: A novel long-term time series prediction model for electricity consumption in the cement calcination process MSTFormer:一种新的水泥煅烧过程电力消耗长期时间序列预测模型
IF 4.7 2区 工程技术
Chemical Engineering Science Pub Date : 2025-09-26 DOI: 10.1016/j.ces.2025.122696
Xiaochen Hao, Yuqiang Qiu, Yonghang Li, Xunian Yang
{"title":"MSTFormer: A novel long-term time series prediction model for electricity consumption in the cement calcination process","authors":"Xiaochen Hao, Yuqiang Qiu, Yonghang Li, Xunian Yang","doi":"10.1016/j.ces.2025.122696","DOIUrl":"https://doi.org/10.1016/j.ces.2025.122696","url":null,"abstract":"The cement calcination process is a critical and energy-intensive step in the cement production process, with electricity consumption accounting for the majority of overall energy consumption. Due to the combined influence of multiple factors such as process parameters, equipment status, and environmental disturbances, electricity consumption data exhibits complex characteristics. These include high time-delay, pronounced nonlinearity, and multivariate coupling, which pose significant challenges for long-term trend modeling and prediction. This paper addresses the challenge of long sequence time-series forecasting (LSTF) for electricity consumption in the cement calcination process by proposing a predictive model, MSTFormer. It integrates multi-channel time-series inputs with a spatio-temporal self-attention mechanism. The model first preprocesses the raw electricity consumption signals using variational modal decomposition. It then constructs a parallel multi-channel time-series input structure based on a weighted mechanism, effectively enhancing long-term dependency modeling capabilities. Subsequently, a novel spatiotemporal ProbSparse self-attention mechanism is designed, combining spatio-temporal embedding and causal convolution to adaptively extract global trends and local dynamic features, thereby enhancing the model’s ability to capture complex time-series patterns. Experimental results on actual cement production datasets demonstrate that MSTFormer outperforms mainstream long-sequence forecasting models across various prediction lengths. Compared with other decomposition methods, VMD-based decomposition reduces prediction errors by over 30%. For 15-minute prediction length, the model achieves an MAE of 0.063 and R<sup>2</sup> of 0.991. Even at 60-minute length, it improves prediction accuracy by over 24%. This study provides an effective approach for intelligent scheduling and energy optimization, offering theoretical and practical value for enhancing industrial energy efficiency.","PeriodicalId":271,"journal":{"name":"Chemical Engineering Science","volume":"93 1","pages":""},"PeriodicalIF":4.7,"publicationDate":"2025-09-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145140570","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}
引用次数: 0
Surface Ce single atoms and S-vacancies synergically enhanced photoreduction of CO2 over Ce-ZnIn2S4 nanosheets 表面Ce单原子和s -空位协同增强了Ce- znin2s4纳米片上CO2的光还原
IF 4.3 2区 工程技术
Chemical Engineering Science Pub Date : 2025-09-26 DOI: 10.1016/j.ces.2025.122679
Shuzhao Sun , Jiayi Guo , Wenda Zhang , Zhiwen Wang , Yingzhang Shi , Masakazu Anpo , Yujie Song
{"title":"Surface Ce single atoms and S-vacancies synergically enhanced photoreduction of CO2 over Ce-ZnIn2S4 nanosheets","authors":"Shuzhao Sun ,&nbsp;Jiayi Guo ,&nbsp;Wenda Zhang ,&nbsp;Zhiwen Wang ,&nbsp;Yingzhang Shi ,&nbsp;Masakazu Anpo ,&nbsp;Yujie Song","doi":"10.1016/j.ces.2025.122679","DOIUrl":"10.1016/j.ces.2025.122679","url":null,"abstract":"<div><div>The rare intrinsic active sites and low charge transfer capabilities of catalysts cause the unsatisfied selectivity and activity in photocatalytic reduction of CO<sub>2</sub>. Utilizing single atoms doping into a catalyst to overcome these issues for improving the catalytic performance may be a highly desirable and challenging endeavor. Herein, single atoms Ce doped ZnIn<sub>2</sub>S<sub>4</sub> (ZIS) nanosheets were prepared as photocatalysts for the reduction of CO<sub>2</sub> under visible light, achieving efficient syngas production of 19.8 mmol g<sup>−1</sup>h<sup>−1</sup>, with an adjustable CO/H<sub>2</sub> ratios from 1:4 to 1:1. Characterizations results reveal that Ce single atoms sites are dispersed on the surface of ZIS, forming the abundant S-vacancies via the lattice distortion of ZIS. These Ce single atoms sites and S-vacancies (Sv) can greatly enhance the separation and transport efficiency of photogenerated carriers. Density functional theory calculations and experiment results exhibit that electrons-rich Ce atoms can selectively absorb and reduce CO<sub>2</sub>, while Sv serve as the active sites for the reduction of H<sub>2</sub>O. This work offers a unique horizon for constructing single-atom doped catalysts and understanding the synergistic catalytic pathway of surface metal single atoms and vacancies.</div></div>","PeriodicalId":271,"journal":{"name":"Chemical Engineering Science","volume":"320 ","pages":"Article 122679"},"PeriodicalIF":4.3,"publicationDate":"2025-09-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145141018","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}
引用次数: 0
Natural sporopollenin cooperated with Cu2O for enhancing Fenton-like reaction and insight into its adsorption contributing to the degradation of rhodamine b and methylene blue 天然孢粉素与Cu2O协同作用增强类fenton反应,深入了解其吸附对罗丹明b和亚甲基蓝的降解作用
IF 4.3 2区 工程技术
Chemical Engineering Science Pub Date : 2025-09-26 DOI: 10.1016/j.ces.2025.122686
Ying Liu , Jiao Jiao , Qing-Yan Gai , Yu-Jie Fu , Yi-Bo Qiu , Yuan Wang
{"title":"Natural sporopollenin cooperated with Cu2O for enhancing Fenton-like reaction and insight into its adsorption contributing to the degradation of rhodamine b and methylene blue","authors":"Ying Liu ,&nbsp;Jiao Jiao ,&nbsp;Qing-Yan Gai ,&nbsp;Yu-Jie Fu ,&nbsp;Yi-Bo Qiu ,&nbsp;Yuan Wang","doi":"10.1016/j.ces.2025.122686","DOIUrl":"10.1016/j.ces.2025.122686","url":null,"abstract":"<div><div>The extensive use of refractory organic dyes in the textile, printing, paper, food, and pharmaceutical industries is a significant source of water pollution. In this study, a novel magnetic hollow porous copper-based Fenton-like catalyst using cattail sporopollenin as a skeleton support (CSp/Fe<sub>3</sub>O<sub>4</sub>-Cu<sub>2</sub>O) was developed for the first time for the adsorption and efficient degradation of two refractory organic dyes rhodamine B and methylene blue in aqueous environments. Under the optimal conditions, CSp/Fe<sub>3</sub>O<sub>4</sub>-Cu<sub>2</sub>O showed complete ability to degrade the mixed dyes. The degradation kinetic constant of CSp/Fe<sub>3</sub>O<sub>4</sub>-Cu<sub>2</sub>O increased by 10.57 times compared to the control Fe<sub>3</sub>O<sub>4</sub>-Cu<sub>2</sub>O. The hollow porous structure of cattail sporopollenin (CSp) in CSp/Fe<sub>3</sub>O<sub>4</sub>-Cu<sub>2</sub>O not only adsorbed the dyes, but also promoted the continuous generation of active species by facilitating the redox cycling of Cu<sup>2+</sup>/Cu<sup>+</sup> through the adsorption of Cu<sup>2+</sup>, which synergistically realized the efficient degradation of mixed dyes. Furthermore, CSp/Fe<sub>3</sub>O<sub>4</sub>-Cu<sub>2</sub>O showed promising application potentials as follows: degradation rates of over 96 % for mixed dyes in a wide pH range of 3.0–11.0; complete degradation of mixed dyes in various water matrices including ultrapure water, tap water, and Songhua River water; and degradation rates of over 98 % for mixed dyes after six consecutive cycles. Overall, the novel Fenton-like catalyst CSp/Fe<sub>3</sub>O<sub>4</sub>-Cu<sub>2</sub>O developed in this study was found to be highly promising for the treatment of organic dye-contaminated water in chemical industries. This study also provided new insight into using the excellent adsorption properties of natural sporopollenin for the Fenton-like catalytic degradation of organic pollutants.</div></div>","PeriodicalId":271,"journal":{"name":"Chemical Engineering Science","volume":"321 ","pages":"Article 122686"},"PeriodicalIF":4.3,"publicationDate":"2025-09-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145141020","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}
引用次数: 0
Dissecting steric and polar substituent effects in linear free energy Relationships: Re-Assessment of the Taft equation with Temperature-Dependent kinetic modeling 线性自由能关系中的立体和极性取代效应解析:用温度相关动力学模型重新评价塔夫脱方程
IF 4.3 2区 工程技术
Chemical Engineering Science Pub Date : 2025-09-26 DOI: 10.1016/j.ces.2025.122700
Sindi Baco , Mélanie Mignot , Christoph Held , Julien Legros , Sébastien Leveneur
{"title":"Dissecting steric and polar substituent effects in linear free energy Relationships: Re-Assessment of the Taft equation with Temperature-Dependent kinetic modeling","authors":"Sindi Baco ,&nbsp;Mélanie Mignot ,&nbsp;Christoph Held ,&nbsp;Julien Legros ,&nbsp;Sébastien Leveneur","doi":"10.1016/j.ces.2025.122700","DOIUrl":"10.1016/j.ces.2025.122700","url":null,"abstract":"<div><div>Kinetic models are vital for developing process flow diagrams that support cost, risk, and environmental assessments, but constructing them is time-consuming, particularly when screening multiple substituents or solvents. Linear Free Energy Relationships (LFERs) can reduce experimental effort, yet most existing formulations neglect temperature effects. In this work, we quantify the temperature dependence (20–50 °C) of Taft’s polar (σ*) and steric (Es) substituent parameters for methyl, ethyl, n-propyl, and 2-chloroethyl groups using kinetic data from esterification and saponification of levulinate derivatives in aqueous media. Both σ* and Es varied linearly with temperature, with the strongest sensitivity observed for 2-chloroethyl (–0.007 °C<sup>−1</sup> for σ*, 0.008 °C<sup>−1</sup> for Es). Incorporating these temperature coefficients into LFER-based kinetic models enhances their predictive accuracy for reaction rates, enabling more efficient process design in biomass valorization and related chemical systems.</div></div>","PeriodicalId":271,"journal":{"name":"Chemical Engineering Science","volume":"320 ","pages":"Article 122700"},"PeriodicalIF":4.3,"publicationDate":"2025-09-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145153900","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}
引用次数: 0
Revealing the spin-polarization-induced d-band splitting effect of Fe-series atoms on the dehydrogenation performance of Pt/TiO2 catalyst for Dodecahydro-N-ethylcarbazole 揭示了fe系原子自旋极化诱导的d带分裂对十二氢- n-乙基咔唑Pt/TiO2催化剂脱氢性能的影响
IF 4.3 2区 工程技术
Chemical Engineering Science Pub Date : 2025-09-26 DOI: 10.1016/j.ces.2025.122684
Linsen Li , Zhuwei Yang , Riguang Zhang , Li Lin , Zhao Jiang
{"title":"Revealing the spin-polarization-induced d-band splitting effect of Fe-series atoms on the dehydrogenation performance of Pt/TiO2 catalyst for Dodecahydro-N-ethylcarbazole","authors":"Linsen Li ,&nbsp;Zhuwei Yang ,&nbsp;Riguang Zhang ,&nbsp;Li Lin ,&nbsp;Zhao Jiang","doi":"10.1016/j.ces.2025.122684","DOIUrl":"10.1016/j.ces.2025.122684","url":null,"abstract":"<div><div>Liquid organic hydrogen carriers (LOHC) technology has emerged as one of the most promising novel hydrogen storage approaches, whose bottleneck is the need to develop efficient and low-cost dehydrogenation catalysts. Among various catalytic systems, Pt-based bimetallic catalysts have attracted significant research attention due to their superior catalytic performance and potential for cost reduction. In this study, we conducted a systematic investigation into the influence of the introduction of Fe-series atoms (Fe, Co, Ni) on 12H-NECZ dehydrogenation reactions of Pt/TiO<sub>2</sub> catalyst. The results demonstrate that the introduced Fe-series atoms facilitate enhanced orbital hybridization, particularly between their 3d orbitals and the Pt-5d orbitals, leading to a pronounced spin polarization effect, modulating the d-band splitting (Δε<sub>d</sub>). These atoms have excellent electron migration properties, which increase the electron density around the Pt atoms. This electronic restructuring modulates the dual d-band centers of the metal Pt, weakens the strong adsorption of reaction intermediates/products and dramatically reduces the energy barrier of the breaking of C–H bonds. Specifically, the rate-determining-step (RDS) barrier of the most effective Pt<sub>3</sub>Co/TiO<sub>2</sub> catalyst is 0.43 eV lower than that of Pt/TiO<sub>2</sub>, which is attributed to the moderate spin polarization strength and optimal electron structure, balancing the adsorption of intermediates/products (ε<sub>d</sub>↑) and hydrogen (ε<sub>d</sub>↓). This study establishes a theoretical foundation for the design of cost-effective, high-performance dehydrogenation catalysts for LOHC.</div></div>","PeriodicalId":271,"journal":{"name":"Chemical Engineering Science","volume":"320 ","pages":"Article 122684"},"PeriodicalIF":4.3,"publicationDate":"2025-09-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145140572","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}
引用次数: 0
Two-dimensional image-based nondestructive probing of micro- and nano-scale heterogeneous pore structures and their geological control 基于二维图像的微纳米非均质孔隙结构无损探测及其地质控制
IF 4.3 2区 工程技术
Chemical Engineering Science Pub Date : 2025-09-26 DOI: 10.1016/j.ces.2025.122648
Nan Fan , Yonggang Qiao , Chaojun Fan , Aiguo Wang , Cunbao Deng , Xi Chen
{"title":"Two-dimensional image-based nondestructive probing of micro- and nano-scale heterogeneous pore structures and their geological control","authors":"Nan Fan ,&nbsp;Yonggang Qiao ,&nbsp;Chaojun Fan ,&nbsp;Aiguo Wang ,&nbsp;Cunbao Deng ,&nbsp;Xi Chen","doi":"10.1016/j.ces.2025.122648","DOIUrl":"10.1016/j.ces.2025.122648","url":null,"abstract":"<div><div>Low-rank coals have a unique multiscale microstructure, which affects their gas storage and transport characteristics. This paper proposes a nondestructive characterization method based on computed tomography (CT) scanning and small-angle X-ray scattering (SAXS) for the micro- and nano-scale characterization of the pore-fracture structures in low-rank coals. CT 3D reconstruction and positive-deviation correction of the SAXS data were performed to systematically quantify the geometry, structural parameters, and spatial arrangement of the pore-fracture. The geological control of gas transport in multilevel pore structures was discussed on the basis of the pore size distribution (PSD) and porosity characterization. The results revealed that the pore-fracture in low-rank coals have spatial abundance and orientation. The skeletal structure parameters exhibited intense directionality, which was related to microstructural anisotropy. From the perspective of connectivity, the topological pore-throat parameters decreased with increasing coal metamorphism. SAXS results revealed the existence of pore fractals in the nano-scale pores; the pore fractal dimension (PFD) increased and then decreased with increasing coal metamorphism. The evolution of the specific surface area (SSA) presented a negative correlation with the average pore diameter. In terms of the geological control of gas transport, macroporosity and microporosity were positively correlated with pore connectivity and SSA, respectively. These findings shed new light on the storage and transport behaviors of coalbed methane (CBM) reservoirs.</div></div>","PeriodicalId":271,"journal":{"name":"Chemical Engineering Science","volume":"320 ","pages":"Article 122648"},"PeriodicalIF":4.3,"publicationDate":"2025-09-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145141021","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}
引用次数: 0
Molecular dynamics of TTIP and Ti(OCH3)4 reaction with H2O in thermal ALD–TiO2 Processes: A DFT study 热ALD-TiO2过程中TTIP和Ti(OCH3)4与H2O反应的分子动力学:DFT研究
IF 4.3 2区 工程技术
Chemical Engineering Science Pub Date : 2025-09-26 DOI: 10.1016/j.ces.2025.122698
P. Pungboon Pansila , Taddaow Khumpook , Tien-Chien Jen , Sina Karimzadeh , P.G. Mani-Gonzalez , Tanabat Promjun
{"title":"Molecular dynamics of TTIP and Ti(OCH3)4 reaction with H2O in thermal ALD–TiO2 Processes: A DFT study","authors":"P. Pungboon Pansila ,&nbsp;Taddaow Khumpook ,&nbsp;Tien-Chien Jen ,&nbsp;Sina Karimzadeh ,&nbsp;P.G. Mani-Gonzalez ,&nbsp;Tanabat Promjun","doi":"10.1016/j.ces.2025.122698","DOIUrl":"10.1016/j.ces.2025.122698","url":null,"abstract":"<div><div>The reaction mechanisms between Titanium(IV) isopropoxide (TTIP), Titanium(IV) methoxide [Ti(OCH<sub>3</sub>)<sub>4</sub>] as titanium precursors and water as oxygen agent respectively, were investigated. Atomic layer deposition (ALD)–TiO<sub>2</sub> thin film deposition process was assumed focusing on their molecular dynamics through interaction with hydroxyl molecule and titanium organic bonds. Based on the computational results obtained by performing the density functional theory (DFT) calculations, the sequence of bonds formation and interaction in these precursor molecules during their reaction with water align with the adsorption mechanism on the Si(100) surface. The differences in the relative energy at each stage of the reaction allow their comparison in terms of the reaction rate and process temperature. When interacted with the H<sub>2</sub>O molecule, the ligands of TTIP and Ti(OCH<sub>3</sub>)<sub>4</sub> molecules dissociate with average activation barriers of 15.9 and 14.5 kcal/mol, respectively, indicating that Ti(OCH<sub>3</sub>)<sub>4</sub> can undergo decomposition at lower temperatures compared to TTIP. This observation aligns with the adsorption behavior of TTIP and Ti(OCH<sub>3</sub>)<sub>4</sub> molecules on hydroxylated Si(100) surfaces, which exhibit activation barriers of 13.4 and 11.5 kcal/mol, respectively. These findings support the hypothesis that precursor molecules with lower decomposition barriers tend to adsorb more readily onto substrate surfaces and generally require lower process temperatures. These insights enabled us to predict the adsorption mechanisms of these titanium precursors based on their interactions with water molecules. Based on molecular behavior, it should provide a framework for the reaction mechanisms of various precursors on different substrate surfaces for producing a broad range of ALD metal oxide thin films.</div></div>","PeriodicalId":271,"journal":{"name":"Chemical Engineering Science","volume":"320 ","pages":"Article 122698"},"PeriodicalIF":4.3,"publicationDate":"2025-09-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145141023","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}
引用次数: 0
Molecular composition reconstruction of naphtha fractions through data-driven modeling and interpretable optimization 通过数据驱动建模和可解释优化的石脑油馏分分子组成重建
IF 4.7 2区 工程技术
Chemical Engineering Science Pub Date : 2025-09-26 DOI: 10.1016/j.ces.2025.122655
Shuofan Li, Zhongyu Zhang, Zukui Li, Guangqing Cai, Linzhou Zhang, Quan Shi
{"title":"Molecular composition reconstruction of naphtha fractions through data-driven modeling and interpretable optimization","authors":"Shuofan Li, Zhongyu Zhang, Zukui Li, Guangqing Cai, Linzhou Zhang, Quan Shi","doi":"10.1016/j.ces.2025.122655","DOIUrl":"https://doi.org/10.1016/j.ces.2025.122655","url":null,"abstract":"Molecular composition reconstruction models for petroleum fractions is important for the application in the process upgrading of modern refineries. In the traditional data-driven reconstruction framework, the underdetermined mapping from low-dimensional bulk properties to high-dimensional molecular compositions and the limited interpretability remain prominent challenges. In this study, a novel strategy is proposed for molecular composition reconstruction of naphtha fractions by integrating data-driven modeling with interpretable optimization. A feedforward neural network (FNN) is pre-trained to map molecular composition to bulk properties. For each sample to be reconstructed, the parameterized FNN is then embedded into an inverse optimization problem to reconstruct the molecular composition. Furthermore, a sample-specific reference composition is constructed from the database to guide the reconstruction, along with carbon number distribution and structural distribution profiles, ensuring chemical plausibility and similarity to realistic petroleum compositions. The reconstructed compositions demonstrate high accuracy. Model interpretability analysis using SHapley Additive exPlanations (SHAP) demonstrates that selecting key bulk properties facilitates the establishment of a robust and unbiased mapping between composition and properties. Furthermore, a broader set of bulk properties are predicted by a supplementary extreme gradient boosting model using limited key properties and its reconstructed composition as inputs.","PeriodicalId":271,"journal":{"name":"Chemical Engineering Science","volume":"15 1","pages":""},"PeriodicalIF":4.7,"publicationDate":"2025-09-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145141027","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}
引用次数: 0
Photothermal-driven BOPP/GO bilayer actuators for programmable 3D shaping and amphibious robot 用于可编程3D整形和两栖机器人的光热驱动BOPP/GO双层驱动器
IF 4.3 2区 工程技术
Chemical Engineering Science Pub Date : 2025-09-26 DOI: 10.1016/j.ces.2025.122693
Xuehao Feng , Zhizheng Gao , Ruiqian Wang , Bentao Zou , Wenguang Yang
{"title":"Photothermal-driven BOPP/GO bilayer actuators for programmable 3D shaping and amphibious robot","authors":"Xuehao Feng ,&nbsp;Zhizheng Gao ,&nbsp;Ruiqian Wang ,&nbsp;Bentao Zou ,&nbsp;Wenguang Yang","doi":"10.1016/j.ces.2025.122693","DOIUrl":"10.1016/j.ces.2025.122693","url":null,"abstract":"<div><div>Drawing inspiration from the phototropic motion characteristics of sunlight-responsive plants, this study presents the fabrication and characterization of bilayer actuators composed of polypropylene (BOPP) and graphene oxide (GO), leveraging GO’s photothermal conversion properties and the thermal expansion mismatch between BOPP and GO. Experimental results demonstrate optimal photothermal actuation at a GO mass fraction of 23.53 %, achieving a maximum bending angle of 70° with a 1.2 s response time and robust cycling stability. By spatially controlling BOPP tape and utilizing laser direct writing, we enable programmable 2D-to-3D structural transformations, including box-shaped and cubic configurations. Multifunctional robotic systems based on these actuators exhibit versatile capabilities: a grasping/lifting robot carries loads four times its weight; a biomimetic soft robot moves terrestrially via trunk bending; and an amphibious robot integrates the Marangoni effect to switch seamlessly between land (BOPP/GO thermal drive) and aquatic (NIR-induced surface tension gradients) locomotion. This work establishes a theoretical and experimental foundation for light-responsive systems in flexible robotics, offering novel design strategies for intelligent robots in complex environments.</div></div>","PeriodicalId":271,"journal":{"name":"Chemical Engineering Science","volume":"320 ","pages":"Article 122693"},"PeriodicalIF":4.3,"publicationDate":"2025-09-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145141022","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}
引用次数: 0
In-situ confinement of ellagic acid within conjugated microporous poly(aniline)s for efficient capture mercury (II) 共轭聚苯胺微孔中鞣花酸的原位约束及其对汞的高效捕集(ⅱ)
IF 4.3 2区 工程技术
Chemical Engineering Science Pub Date : 2025-09-25 DOI: 10.1016/j.ces.2025.122689
Xiaoyu Lou , Yanxuan Shi , Miaomiao Cui , Yawen Chen , Ningjing Yan , Changshen Ye , Ting Qiu , Jie Chen
{"title":"In-situ confinement of ellagic acid within conjugated microporous poly(aniline)s for efficient capture mercury (II)","authors":"Xiaoyu Lou ,&nbsp;Yanxuan Shi ,&nbsp;Miaomiao Cui ,&nbsp;Yawen Chen ,&nbsp;Ningjing Yan ,&nbsp;Changshen Ye ,&nbsp;Ting Qiu ,&nbsp;Jie Chen","doi":"10.1016/j.ces.2025.122689","DOIUrl":"10.1016/j.ces.2025.122689","url":null,"abstract":"<div><div>In practical wastewater treatment, microporous polymers and polyphenolic materials often suffer from limited adsorption performance for heavy metal ions, primarily due to the restricted pore structure of the former and the poor chemical stability of the latter. Herein, a novel EA@CMPA composite is developed via <em>in-situ</em> confinement of ellagic acid (EA) within Conjugated Microporous Poly(aniline) (CMPA) for efficient Hg(II) removal. EA is anchored within CMPA through dual interactions: (i) hydrogen-bonding and (ii) protonation. This design endows the composite with hierarchically structured mesoporous diffusion channels and abundant active adsorption sites, thereby enabling EA@CMPA to enhancement of the adsorption kinetics and capacity. The resulted EA@CMPA(200) has high Hg(II) adsorption rate <em>h</em> of 640 mg g<sup>-</sup><sup>1</sup> min<sup>-</sup><sup>1</sup> and adsorption capacity of 1024 mg g<sup>-1</sup>. Notably, EA@CMPA maintains a regeneration efficiency over 81.5% after 7 cycles of intensive reuse, demonstrating that the water-soluble ellagic acid is efficiently confined within the pore channels. It also exhibits excellent anti-interference ability and selectivity in actual Hg-containing wastewater, with Hg(II) removal rate of 95.41% and selectivity approaching 100%. The adsorption behavior and mechanism are characterized by FT-IR, XPS, and DFT calculations, revealing that the synergistic interactions between C=O and –NH– sites drive superior Hg(II) capture. This study highlights the potential of EA@CMPA as a high-performance adsorbent for mercury remediation.</div></div>","PeriodicalId":271,"journal":{"name":"Chemical Engineering Science","volume":"320 ","pages":"Article 122689"},"PeriodicalIF":4.3,"publicationDate":"2025-09-25","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145134413","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}
引用次数: 0
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